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P. Villars, K. Cenzual, R.

Gladyshevskii
Handbook of Inorganic Substances 2015
Also of Interest

Inorganic Substances Bibliography 2015


Pierre Villars, Karin Cenzual, Marinella Penzo, 2015
3 volume e-book set e-ISBN 978-3-11-031176-1

Inorganic Micro- and Nanomaterials


Angela Dibenedetto, Michele Aresta (Eds.), 2013
ISBN 978-3-11-030666-8
e-ISBN 978-3-11-030687-3

Nanocarbon-Inorganic Hybrids
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ISBN 978-3-11-026971-0
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Reviews in Inorganic Chemistry


Editor-in-Chief: Axel Schulz
ISSN 0193-4929
e-ISSN 2191-0227
Pierre Villars
Karin Cenzual
Roman Gladyshevskii

Handbook of Inorganic Substances


2015

De Gruyter
ISBN 978-3-11-031113-6
e-ISBN (PDF) 978-3-11-031174-7
e-ISBN (EPUB) 978-3-11-038306-5

Bibliographic information published by the Deutsche Nationalbibliothek


The Deutsche Nationalbibliothek lists this publication in the Deutsche Nationalbibliografie;
detailed bibliographic data are available on the Internet at http://dnb.dnb.de.

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Preface

Handbook of Inorganic Substances 2015


Over 100 000 different inorganic substances (also called compounds or phases) have been structurally charac-
terized since the discovery of X-ray diffraction in 1913. The information has been published in some 200 000
publications spread over more than 1 000 different scientific journals. The aim of this handbook is to provide
the researcher and student with a comprehensive compilation of presently defined crystallographically iden-
tified inorganic substances within one volume. The selection of data included in this volume is based on a
qualitative approach ⫺ all data having passed a quality check. In contrast, the companion publication
“Inorganic Substances Bibliography” tries to give a quantitative overview of relevant publications.
This handbook is a product of the PAULING FILE project1 (see below). An inorganic substance is defined
in the PAULING FILE by the chemical system and the crystal structure, and has been given a unique name
where the chemical formula is followed by a specification (e.g. ht, orth) when relevant. The crystal structure
is defined by referring to a prototype (structure type), if known. For not yet (fully) investigated structures,
partial structural information is given if available, e.g. the complete Pearson symbol may be replaced by t**
(tetragonal) or cI* (cubic body-centered).

How to read the Data


System Substance Prototype H-M Unit Cell Family Color DX C Ref.
Parameters
a,b,c,α,β,γ
(nm,∞∞)
Ac-Br-O AcBrO PbClF, P4/nmm 0.428,0.428, 7.9 A 25998
tP6,129 0.741,90,90,90
Alphabeti- Chemical Prototype Hermann- Standar- Mineral Density Code Reference
cally sorted formula (structure Mauguin dized cell name or (Mg m⫺3) indicating number,
chemical type): type- symbol for parameters structural calculated the level of link to a
elements defining the space family from the structural data source
compound, group chemical studies listed in the
Pearson formula (see list of Reference
symbol, and unit abbrevia- section
space group cell volume tions below)
number

A: no atom coordinates refined (or published), but prototype assigned


F: parent type assigned for a filled-up derivative
N: no atom coordinates refined (or published), prototype not assigned
P: part of atom coordinates not refined (proton sites ignored)
X: atom coordinates refined or fixed
Pearson symbol: first letter of the crystal system (c: cubic, h: hexagonal/trigonal, t: tetragonal, o: orthorhombic,
m: monoclinic, a: anorthic ⫽ triclinic) followed by the Bravais lattice and the sum of the multiplicities of all partly or
fully occupied sites in the unit cell (or estimated number of atoms in the unit cell for unknown structures); proton sites
are ignored
Table 1 Content of the main table.
vi Preface

All the data has been processed and critically evaluated by the editor team of the PAULING FILE, using a
unique software package. For the numerous cases where the same inorganic substance has been investigated
several times, representative data has been selected (119 500 selected from 256 000 processed entries).
The data has been sorted in first priority according to the number of chemical elements in the chemical
system, in second priority in alphabetic order of the chemical system, and in third priority according to the
chemical formula (automatic alphabetic order). Systems with 6⫺10 chemical elements have been grouped
together and sorted according to the first three elements of the alphabetically sorted element-system, and
then to the chemical formula.
The data part is followed by a reference part, giving minimal information required to uniquely identify the
scientific publications. The short document names contain the following parts: CODEN, year, volume, issue/
article, first page, last page. A table listing the CODENs and conventional abbreviated names of the over
1 000 quoted journals is given after the preface.
The prototype assignment is a well-known concept in inorganic chemistry, where often a large number of
compounds crystallize with very similar atom arrangements. The compilation ‘Strukturbericht’ started to
catalogue crystal structures into types, named by codes such as A1, B1 or A15. These notations are still in
use, however, nowadays prototypes are generally referred to by the name of the compound for which this
particular kind of atom arrangement was first identified, i.e. for the types enumerated above: Cu, NaCl,
Cr3Si. The PAULING FILE uses a longer notation, which also includes the Pearson symbol and the number
of the space group in the International Tables for Crystallography: Cu,cF4,225, NaCl,cF8,225, Cr3Si,cP8,223.
All data sets with published coordinates in the PAULING FILE are classified into prototypes, following
criteria defined in TYPIX2. According to this definition, isotypic compounds must crystallize in the same
space group, have similar cell parameter ratios and occupy the same Wyckoff positions in the standardized
description with the same or similar values of the atom coordinates. If all these criteria are fulfilled, the
atomic environments should be similar. No distinction is made between structures with fully and partly
occupied atom sites. When possible, a prototype has also been assigned to data sets without atom coordi-
nates. The prototype is often stated in the publication, in other cases it has been assigned by the editors.
The assigned type may, in some cases, be an approximation of the real structure, ignoring for instance, a
certain disorder.
The elements in the chemical formula are sorted according to an internal list and selected chemical units
(water, phosphate, sulfate, etc.) are emphasized in square brackets. The unit cell parameters have been stan-
dardized2, so that they always refer to the first description in the International Tables for Crystallography
(Niggli-reduced cell for triclinic structures, unique axis b for monoclinic structures, triple hexagonal cell for
rhombohedral structures). This is also true for the Hermann-Mauguin symbol. When relevant, the space
group, and/or the unit cell, has been corrected in order to take into consideration all of the symmetry elements
contained in the proposed structure model. Priority has been given to unit cell parameters determined at
ambient conditions, but may not always be the case. The reference number links the data row to the source
of the (originally published) unit cell parameters, whereas the colour or mineral name may come from another
publication. The structure class was assigned by the editors.
Due to lack of space, some columns have been omitted, or their content shortened, for multinary element-
systems. For more than three chemical elements, the Hermann-Mauguin symbol has been left out and the
type-defining compound replaced by “idem”, when identical to the chemical formula in the same row. For
the last section, containing data for systems with more than five elements, the complete expression for the
prototype has been replaced by the Pearson symbol and the space group number.
Crystallographic data of approx. 10 000 inorganic substances are published yearly in literature world-wide,
representing about 5 000 distinct substances. The information is contained in approx. 7 000 scientific publica-
tions. Each new edition of the handbook contains data for new substances, in addition to the updated
information for substances contained in the preceding edition.
Preface vii

PAULING FILE project


One of the most challenging tasks in material science is the design of new materials with distinct properties.
In general, two different approaches are explored:
1. The first one is to simulate the motion of the atoms in the material as well as their electronic interactions
as close to reality as possible by using calculations on the quantum-mechanical level. This is an extremely
demanding task, especially if the calculation of the property under investigation requires a long-time
simulation. However, at least in theory, there is no input other than the laws of quantum mechanics, so
using these calculations the material properties can be understood right away from first principles. Based
on this understanding, it should be possible to design new materials with distinct properties just by com-
puter simulations.
2. The second approach seems to be less challenging at first glance, since it does not ask for the really
fundamental principles but remains on a more pragmatic level: Most of our current knowledge in chemis-
try and material science has been collected empirically, just by searching for patterns and rules in experi-
mental results published in the literature. During the past 100 years or so, a huge pile of various types of
corresponding data like crystal structures, powder diffraction patterns, phase diagrams and physical prop-
erties has been collected for a large variety of compounds. This information is mainly available in various
materials databases.
Beside the classical use of these databases for analysis, phase identification and teaching purposes, it should
be worthwhile trying to use modern computer technology to search for additional rules and correlations
implied in these data and use them in materials design.
Both approaches have their own advantages and problems: While the first one does (at least in principle)
not rely on experiments and should result in a really deep understanding of fundamental correlation in solids,
it is computationally extremely demanding and can currently only be applied to a limited number of rather
simple solids. The second approach needs by far less computational effort and may thus (at least in the
beginning) lead to faster success; however, it is extremely depending on the availability of a sufficiently large
number of experimental data of appropriate quality. An additional problem concerning this second empirical
approach is that, up to now, the relevant data types have been stored in separate, isolated databases, each
using its own proprietary retrieval software. This made the investigations rather tedious and prohibited the
user from performing an overall data analysis in order to discover hidden patterns and correlations.
These shortcomings of the empirical approach provided the basic motivation for the initiation of the PAU-
LING FILE project, which started in 1995 as a collaboration between Japan Science and Technology Corpo-
ration (JST), Material Phases Data System (MPDS), and The University of Tokyo, RACE. Since 2002 the
project is under the leadership of MPDS.
The first goal is to create and maintain a comprehensive materials database for all non-organic (no C-H
bonds) solid state materials (systems), covering crystallographic data, phase diagrams, diffraction patterns
and physical properties. An important aspect, along with completeness, is the quality of the data. The data
have been checked with extreme care, since unrecognized errors will at least confuse the correlation tools, if
not result in wrong rules that may be deduced.

Notes
1
P. Villars, M. Berndt, K. Brandenburg, K. Cenzual, J. Daams, F. Hulliger, T. Massalski, H. Okamoto,
K. Osaki, A. Prince, H. Putz, S. Iwata, The PAULING FILE, Binaries Edition, J. Alloys Compd. 367 (2004) 293⫺297;
http://paulingfile.com
2
E. Parthé, L. Gelato, B. Chabot, M. Penzo, K. Cenzual, R. Gladyshevskii, Gmelin Handbook of Inorganic and Organo-
metallic Chemistry, 8th Ed. TYPIX ⫺ Standardized Data and Crystal Chemical Characterization of Inorganic Structure
Types, 4 volumes, Heidelberg: Springer 1993, 1994.
viii Handbook of Inorganic Substances ⫺ Edition 2015

Acknowledgements
We would like to thank Dr. S. Budnyk, Dr. I. Chumak, Dr. G. Demchenko, Dr. V. Dubenskyy, Dr. E.
Horeshnyk, Dr. V. Kuprysyuk, Dr. N. Melnychenko-Koblyuk, Dr. N. Muts, Dr. O. Pavlyuk, Dr. V. Romaka,
Dr. I. Savysyuk, Mr. O. Shcherban, Dr. O. Stelmakhovych, Dr. S. Stoyko, Dr. L. Sysa, Dr. I. Tarasyuk, Dr.
A. Tkachuk, Dr. I. Tokaychuk, Dr. Y. Verbovytskiy, Dr. O. Zaremba, and Dr. R. Zaremba for their contribu-
tion to the Structure part of the PAULING FILE.
Our hearty thanks also go to Dr. T. Ashino, Mr. J. L. C. Daams, Ms. E. Flack, Dr. A. Hannemann, Dr. F.
Hulliger, Prof. S. Iwata, Dr. Y. Kaneta, Mr. V. Luong, Prof. T. B. Massalski, Dr. H. Okamoto, Prof. K.
Osaki, Prof. A. Prince, Dr. T. Siegrist, and Mr. T. Vu for expertise and advice.
Special thanks to the supporting staff of JST: Mr. T. Atago, Prof. Y. Chen, Mr. K. Iijima, Mr. H. Kaneko,
Dr. K. Kuroda, Dr. C. Maeda, Mr. M. Obara, Ms. R. Nakajima, Prof. N. Onodera, and Mr. K. Yoshida, as
well as to the supporting staff of NIMS: Mr. M. Yamazaki, Dr. Y. Xu.

January 2015
Pierre Villars, Material Phases Data System (MPDS), Vitznau, Switzerland
Karin Cenzual, University of Geneva, Switzerland
Roman Gladyshevskii, Ivan Franko National University of Lviv, Ukraine

Handbook of Inorganic Substances data is copyrighted by Material Phases Data System (MPDS),
Switzerland & National Institute for Materials Science (NIMS), Japan, 2014
(Data generated pre-2002: Copyright ” MPDS & NIMS; Post-2001: Copyright ” MPDS).
JST, MPDS, NIMS and De Gruyter shall not be liable for any damage that may result from errors or
omissions in the handbook.
Handbook of Inorganic Substances – Edition 2015 ix

List of journal CODENs

11TNAQ Proc. U. N. Int. Conf. Peaceful Uses At. Energy, AGKGAA Kenkyu Hokoku - Asahi Garasu Kogyo Gijutsu BTC181 Bin. Tern. Carbide Nitride Uebergangsmetalle
2nd Shoreikai Phasenbeziehungen
12KYAL Plutonium 1960, Proc. Int. Conf. Plutonium AGSIDP Acta Geol. Sin. Engl. Transl. BTITA5 Bull. Tokyo Inst. Technol.
Metall., 2nd AGSREJ Arab Gulf J. Sci. Res. BUFCAE Bull. Soc. Fr. Mineral. Cristallogr.
12XNAJ Extr. Phys. Metall. Plutonium Alloys, Symp. AHUTA4 Arch. Hutn. BUGMAF Geol. Soc. Am. Bull.
14OQAV Vopr. Teor. Primen. Redkozem. Met., Mater. AIVLAQ Atti - Ist. Veneto Sci., Lett., Arti, Cl. Sci. Mat., BULMD9 Bull. Mineral.
Soveshch. Nat. BUMSDW Bull. Mater. Sci.
14PCAS Carbides Nucl. Energy, Proc. Symp. AJBOAA Am. J. Bot. BUPSAA Bull. Russ. Acad. Sci., Phys. Ser.
17HBA6 Struct. Alloys Certain Systems Cont. Uranium AJCHAS Aust. J. Chem. BYGSAR Brigham Young Univ. Geol. Stud.
Thorium AJCHEW Asian J. Chem. CAAJBI Chem. Asian J.
17XIA5 Chem. Ext. Defects Non-Met. Solids, Proc. Inst. AJSCAP Am. J. Sci. CALEER Catal. Lett.
Adv. Study AKMGAE Ark. Kemi Mineral. Geol. CAMIA6 Can. Mineral.
18IPAQ Plansee Proc. Pap. Plansee Semin. "De Re Met.", ALOSAX Arch. Lagerstaettenforsch. Ostalpen CASCFN C. R. Acad. Sci., Ser. IIc
2nd ALUMAB Aluminium (Isernhagen, Ger.) CCACAA Croat. Chem. Acta
18IPS0 Plansee Proc. Pap. Plansee Semin. "De Re Met.", AMATEB Acta Metall. Mater. CCCCAK Collect. Czech. Chem. Commun.
11th AMCICK Acta Microsc. CCCTD6 CALPHAD: Comput. Coupling Phase Diagrams
18IPS2 Plansee Proc. Pap. Plansee Semin. "De Re Met.", AMETAR Acta Metall. Thermochem.
12th AMMDAJ IMD Spec. Rep. Ser. CCLEE7 Chin. Chem. Lett.
18JWAI Proc. Conf. Rare Earth Res., 2nd AMMIAY Am. Mineral. CCMPA7 Clays Clay Miner., Proc. Conf.
18JXAL Proc. Conf. Rare Earth Res., 3rd AMNGAX Ark. Mineral. Geol. CCNRAI Cement Concr. Res.
18JYAO Proc. Conf. Rare Earth Res., 4th AMNVAA Arch. Math. Naturvidensk. CCOMA8 Chem. Commun. (London)
18LCA2 Proc. Int. Conf. Peaceful Uses At. Energy, 3rd AMREFI Adv. Mater. Res. Zuerich CEJCAZ Cent. Eur. J. Chem.
19EVAV Plutonium 1965, Proc. Int. Conf., 3rd AMSAEE Acta Metall. Sin. Engl. Ed., Ser. A CESPDK Ceram. Eng. Sci. Proc.
20EFAZ Anisotropy Single-Cryst. Refract. Compd., Proc. AMSBEE Acta Metall. Sin. Engl. Ed., Ser. B CETREW Ceram. Trans.
Int. Symp. ANCEAD Angew. Chem. CEUJED Chem. Eur. J.
20EZAR Thermodyn. Nucl. Mater., Proc. Symp. ANCHAM Anal. Chem. CGDEFU Cryst. Growth Des.
20ZRA6 Diagrammy Sostoyaniya Met. Sist., Mater. Vses. ANCPAC Ann. Chim. (Paris) CHBEAM Chem. Ber.
Soveshch. ANCRAI Ann. Chim. (Rome) CHBRFW Chem. Ber./Recl.
23HWAI Proc. Rare Earth Res. Conf., 7th ANPYA2 Ann. Phys. (Leipzig) CHCOFS Chem. Commun. (Cambridge)
24RIAX Proc. Rare Earth Res. Conf., 9th ANQUEX An. Quim. (1990-1995) CHDBAN C. R. Seances Acad. Sci., Ser. B
24WEAC Diagrammy Sostoyaniya Met. Sist., Mater. Vses. ANSCEN Anal. Sci. CHDCAQ C. R. Seances Acad. Sci., Ser. C
Soveshch., 4th APAMFC Appl. Phys. A CHDDAT C. R. Seances Acad. Sci., Ser. D
25CZAG Redkozem. Met. Splavy, Vses. Soveshch. APASAP Acta Phys. Austriaca CHEIDI Chem. Ind. (Dekker)
Redkozem. Elem. (Mater.), 6th APBOEM Appl. Phys. B: Lasers Opt. CHEMA0 Chem. Met. Alloys
29SDAO Strukt. Faz, Fazovye Prevrashch. Diagrammy APCPCS AIP Conf. Proc. CHEMM5 ChemPlusChem
Sostoyaniya Met. Sist. APEPC4 Appl. Phys. Express CHIMAD Chimia
30NNAD Proc. Rare Earth Res. Conf., 11th APHSEU Acta Phys. Sin. Overseas Ed. CHINAG Chem. Ind. (London)
31XGAD Thermodyn. Nucl. Mater., Proc. Symp., 4th APHYCC Appl. Phys. (Berlin) CHJPBS Chin. J. Phys. Peking
33DSAV Proc. Rare Earth Res. Conf., 10th APPLAB Appl. Phys. Lett. CHPAEG Chem. Pap.
33IYA6 Plutonium 1975 Other Actinides, Proc. Int. Conf., APSFDB Appl. Phys. A: Solids Surf. CHPHD2 Chin. Phys.
5th AQIEFZ An. Quim. Int. Ed. CHPHF4 Chin. Phys. (Beijing)
33WQAI Proc. Rare Earth Res. Conf., 12th AQVUA7 Av. Quim. CHPLBC Chem. Phys. Lett.
38NEA6 Valence Instab. Relat. Narrow-Band Phenom., AREIAT Arch. Eisenhuettenwes. CHSPA4 Jinshu Xuebao
Proc. Int. Conf. ARKEAD Ark. Kemi CHZVAN Chem. Zvesti
38QEAL Nek. Vopr. Eksp. Teor. Fiz. ARSFAM An. R. Soc. Esp. Fis. Quim., Ser. A CINNDH Ceram. Int.
39NVAU High-Pressure Low-Temp. Phys., Proc. Int. Conf. ASBSDK Acta Crystallogr. B CIWYAO Year Book - Carnegie Inst. Washington
40JAAX Handb. Phys. Chem. Rare Earths ASETE5 Adv. Sci. Technol. (Faenza, Italy) CJASFA Can. J. Anal. Sci. Spectrosc.
43GQAH Fast Ion Transp. Solids Electrodes Electrolytes, ASGVAH Arch. Sci. CJCHAG Can. J. Chem.
Proc. Int. Conf. ASMQAW ASM Trans. Q. CJGEEV Chin. J. Geochem.
44JWAN Proc. Int. Conf. Zeolites, 5th ASRBAC Appl. Sci. Res., Sect. B CJMTE4 Chin. J. Met. Sci. Technol.
45ITAG Thermodyn. Nucl. Mater.1979, Proc. Int. Symp. ASUEE6 Appl. Supercond. CJOCEV Chin. J. Chem.
46NDAY Ternary Supercond., Proc. Int. Conf. ATKEAR Atomkernenergie CJOPAW Chin. J. Phys. (Taipei)
47SFA4 Fazovye Ravnovesiya Met. Splavakh ATKEDU Atomkernenerg. / Kerntech. CJPHAD Can. J. Phys.
48YNAV Valence Instab., Proc. Int. Conf. ATPLB6 Acta Phys. Pol. A CJSPEM Can. J. Appl. Spectrosc.
48ZAAV Cryst. Electr. Field Eff. f-Electron Magn., Proc. ATVAA2 Atti Soc. Toscana Sci. Nat. Pisa, Mem., Ser. A CLADA8 Cryst. Lattice Defects
Int. Conf., 4th AUCGAY Acta Univ. Carol., Geol. CLASAJ Clay Sci.
49YJAQ Proc. Int. Conf. Rapidly Quenched Met., 4th AUJPAS Aust. J. Phys. CLCMAB Clays Clay Miner.
50IDAE Supercond. d- f-Band Met., Proc. Conf., 4th AUNVAW Avh. Nor. Vidensk.-Akad., 1: Mat. Naturvidensk. CLMIAF Clay Miner.
51BLA8 Issled. Primen. Splavov Tugoplavkikh Met. Kl. CMATEX Chem. Mater.
52TTAR Proc. Int. Conf. Magn. Rare-Earths Actinides AUSEA6 Acta Mineral. Petrogr. CMCAEK C. R. Acad. Sci., Ser. IIb
54JZA9 Wegliki, Azotki, Borki, Miedzynar. Konf., 3rd AXRAAA Adv. X-Ray Anal. CMLTAG Chem. Lett.
54NMAO Solid State Phys. Pressure: Recent Adv. Anvil AZKZAU Azerbaid. Khim. Zh. CMPEAP Contrib. Mineral. Petrol.
Devices BACCAT Bull. Acad. Sci. USSR, Div. Chem. Sci. CMPHC2 Chem. Phys.
55HCA5 Prog. Metall. Res.: Fundam. Appl. Aspects, Proc. BAPCAQ Bull. Acad. Pol. Sci., Ser. Sci. Chim. COBAAP Cobalt Engl. Ed.
Int. Conf. BASNA6 Bull. - Acad. Serbe Sci. Arts, Cl. Sci. Math. Nat.: COINAV Colloq. Int. C. N. R. S.
AAFCAX Ann. Acad. Sci. Fenn., Ser. A2 Sci. Nat. COREAF C. R. Hebd. Seances Acad. Sci.
AAFPA4 Ann. Acad. Sci. Fenn., Ser. A6 BBPCAX Ber. Bunsen-Ges. CPBHAJ Chin. Phys. B
AANLAW Atti Accad. Naz. Lincei, Cl. Sci. Fis., Mat. Nat., BCPREL Br. Ceram. Proc. CPDDT0 Comp. Phase Diagram Data, Ternary Phase
Rend. BCSAAF Bull. Cl. Sci., Acad. R. Belg. Equil. TM-B-C-Si, AFML-Tr-65-2, Part V
AASRFC Adv. Appl. Sci. Res. BCSJA8 Bull. Chem. Soc. Jpn. CPLEEU Chin. Phys. Lett.
AATFAA Atti Accad. Sci. Torino, Cl. Sci. Fis., Mat., Nat. BGGUA9 Bull. Groenl. Geol. Unders. CRAMED C. R. Acad. Sci., Ser. II
ACACBN Acta Crystallogr. A BIMADU Biomaterials CRAUAX C. R. (Dokl.) Acad. Sci. URSS
ACACEQ Acta Crystallogr. A BJAPAJ Br. J. Appl. Phys. CRBNAH Carbon
ACAGE4 Appl. Catal., A BJPHD5 Bulg. J. Phys. CRCOCR C. R. Chim.
ACAPCT Acta Chem. Scand. A BJPHE6 Braz. J. Phys. CRCUED Chem. Res. Chin. Univ.
ACBCAR Acta Crystallogr. B BKCSDE Bull. Korean Chem. Soc. CRECF4 CrystEngComm
ACCRA9 Acta Crystallogr. BKKIS1 Tezizy Dokl. Vses. Konf. Kristallokhim. CRGOAB C. R. Geosci.
ACGHAX Acta Geol. Hisp. Intermet. Soeden., 1st CRSUDO C. R. Seances Acad. Sci., Ser. 2
ACHSE7 Acta Chem. Scand. BKKIS2 Tezizy Dokl. Vses. Konf. Kristallokhim. CRTEDF Cryst. Res. Technol.
ACIEAY Angew. Chem. Int. Ed. Engl. Intermet. Soeden., 2nd CRYEF8 Cryst. Eng.
ACIEF5 Angew. Chem. Int. Ed. BKKIS3 Tezizy Dokl. Vses. Konf. Kristallokhim. CRYOAX Cryogenics
ACMAFD Acta Mater. Intermet. Soeden., 3rd CRYSBC Crystals
ACPYAR Acta Physicochim. URSS BKKIS4 Tezizy Dokl. Vses. Konf. Kristallokhim. CSBUEF Chin. Sci. Bull.
ACSAA4 Acta Chem. Scand. Intermet. Soeden., 4th CSCMCS Cryst. Struct. Commun.
ACSCEE Acta Crystallogr. C BKKIS5 Tezizy Dokl. Vses. Konf. Kristallokhim. CSRPB9 Chem. Scr.
ACSEBH Acta Crystallogr. E Intermet. Soeden., 5th CSSPAD Spec. Publ. - Chem. Soc.
ACSIEW Acta Chim. Sin. Engl. Ed. BKNSAW Bull. Boris Kidric Inst. Nucl. Sci. CTCPDB Changchun Dizhi Xueyuan Xuebao
ACSLE7 Acta Chim. Slov. BMUPA4 Beitr. Mineral. Petrogr. CUSCAM Curr. Sci.
ACSMC8 ACS Symp. Ser. BNSKAK Bunseki Kagaku CYSTE3 Crystallogr. Rep.
ADCSAJ Adv. Chem. Ser. BOCQAX Bol. Soc. Chil. Quim. CYXUEV Cailiao Yanjiu Xuebao
ADVMEW Adv. Mater. BPACEQ Bull. Pol. Acad. Sci. Chem. CZYPAO Czech. J. Phys.
AENGAB At. Energ. BPCMFX Bioceram., Proc. Int. Symp. Ceram. Med. DABBBA Diss. Abstr. Int. B
AENMFY Adv. Eng. Mater. BSCBAG Bull. Soc. Chim. Belg. DAKNEQ Dokl. Akad. Nauk
AFMDC6 Adv. Funct. Mater. BSCFAS Bull. Soc. Chim. Fr. DALTFG Dalton (2000)
AGHUE7 Acta Geol. Hung. BSRSA6 Bull. Soc. R. Sci. Liege DANKAS Dokl. Akad. Nauk SSSR
DANND6 Dopov. Akad. Nauk Ukr. RSR, Ser. B
x Handbook of Inorganic Substances – Edition 2015

DANSEM Dokl. Akad. Nauk Ukr. SSR HYYIFM Huaxue Yanjiu Yu Yingyong JCUGEX J. China Univ. Geosci.
DANTAL Dokl. Akad. Nauk Tadzh. SSR IAFMAF Izv. Akad. Nauk Az. SSR, Ser. Fiz.-Tekh. Mat. JCZSEQ J. Czech. Geol. Soc.
DAUREK Dopov. Akad. Nauk Ukr. RSR Nauk JDREAF J. Dent. Res.
DAZRA7 Dokl. Akad. Nauk Az. SSR IANFAY Izv. Akad. Nauk SSSR, Ser. Fiz. JECMA5 J. Electron. Mater.
DBANAD Dokl. Bolg. Akad. Nauk IASKA6 Izv. Akad. Nauk SSSR, Ser. Khim. JECNEC JAERI-Conf.
DBANEH Dokl. Bulg. Akad. Nauk. ICACEC Indian J. Chem., Sect. A JECSER J. Eur. Ceram. Soc.
DBGGAM Dopov. Akad. Nauk Ukr. RSR, Ser. B ICCI10 Abstr. 10th Int. Conf. Crystal Chem. Intermet. JEJOAC J. Electrochem. Soc. Jpn.
DBLRAC Dokl. Akad. Nauk BSSR Compd. JELJA7 J. Electron Microsc.
DDBPE8 Diffus. Defect Data, Pt. B or Solid State Phenom. ICCI11 Abstr. 11th Int. Conf. Crystal Chem. Intermet. JERNAF Jernkontorets Ann.
DEDIF0 Def. Diff. Forum Compd. JESOAN J. Electrochem. Soc.
DESOAP Dokl. Earth Sci. ICCIC6 Abstr. 6th Int. Conf. Crystal Chem. Intermet. JFHGAJ J. Fac. Sci., Hokkaido Univ., Ser. 4
DHWHAB Taehan Hwahakhoe Chi Compd. JFLCAR J. Fluorine Chem.
DIASA9 Diss. Abstr. ICCIC7 Abstr. 7th Int. Conf. Crystal Chem. Intermet. JGCHA4 J. Gen. Chem. USSR
DIKARM Diss. Univ. Karlsruhe Compd. JGREA2 J. Geophys. Res.
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FDISE6 Faraday Discuss. IVUKAR Izv. Vyssh. Uchebn. Zaved., Khim. Khim. JOAMF2 J. Optoelectron. Adv. Mater.
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FDXKEN Fuzhou Daxue Xuebao, Ziran Kexueban IVUMAX Izv. Vyssh. Uchebn. Zaved., Chern. Metall. JOCSET J. Braz. Chem. Soc.
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Handbook of Inorganic Substances – Edition 2015 xi

JSIRAC J. Sci. Ind. Res. MTARCE Mater. Trans. PMACRT Proc. Int. Symp. Magn. Anisotropy Coercivity
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KDGHEI Kyoto Daigaku Genshiro Jikkensho Gakujutsu NCSDDN Nuovo Cimento Soc. Ital. Fis. D PPSOAU Proc. Phys. Soc., London
Koenkai Hobunshu NDBSAL Kenkyu Kiyo - Nihon Daigaku Bunrigakubu PRAMCI Pramana
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KOBLAA Kobalt NKAKB8 Nippon Kagaku Kaishi PSSCGL Phys. Status Solidi C
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KRISAJ Kristallografiya NMATEI Neorg. Mater. PYLAAG Phys. Lett. A
KRTEAW Krist. Tech. NNOTER Nanotechnology PYSIA7 Physica (The Hague)
KSYHA5 Guisuanyan Xuebao NOGTAO Nor. Geol. Tidsskr. QDXKF9 Qingdao Daxue Xuebao, Ziran Kexueban
KTHPDM Gaodeng Xuexiao Huaxue Xuebao NPKZAZ Nippon Kagaku Zasshi RAACAP Radiochim. Acta
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LITHAN Lithos Ronbunshi RELTAN Rev. Electr. Commun. Lab.
LKZUE8 Latv. Kim. Z. NSSICD NATO Sci. Ser., II REMTDV Rare Earth Mod. Sci. Technol.
LTWMAS Lodz. Tow. Nauk., Pr. Wydz. 3 NSSTFF NATO Sci. Ser., 3 RFSSDV Rikogakubu Shuho (Saga Daigaku)
LZAKAM Latv. PSR Zinat. Akad. Vestis, Kim. Ser. NTNKAX Ned. Tijdschr. Natuurkd. RICHD7 Rev. Inorg. Chem.
LZFTA6 Latv. PSR Zinat. Akad. Vestis, Fiz. Teh. Zinat. NUKKAP Nukleonik RIHTAV Rev. Int. Hautes Temp. Refract.
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MCONEN Micron OKDSBO Osaka Kyoiku Daigaku Kiyo, Dai-3-bumon RJICAQ Russ. J. Inorg. Chem.
MDKKDY Meiji Daigaku Kagaku Gijutsu Kenkyusho Kiyo OMATET Opt. Mater. (Amsterdam) RJPCAR Russ. J. Phys. Chem.
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SCTE13 Abstr. 13th Int. Conf. Solid Compd. Transition TAIMAF Trans. Am. Inst. Min. Metall. Pet. Eng. WDRKA6 Rikogaku Kenkyusho Hokoku, Waseda Daigaku
Elem. TASEA7 Trans. Am. Soc. Met. WGDXEY Wuhan Gongye Daxue Xuebao
SCTHAO Sichuan Daxue Xuebao, Ziran Kexueban TCHPAX Dizhi Xuebao WHUXEO Wuji Huaxue Xuebao
SFKTE6 Sverkhprovodimost: Fiz. Khim. Tekh. TCKHAO Dizhi Kexue WHXUEU Wuli Huaxue Xuebao
SGNEAD Semento Gijutsu Nenpo TDKIE4 Tohoku Daigaku Sozai Kogaku Kenkyusho Iho WJCMAD World J. Condens. Matter Phys.
SGOXEB Shanghai Gongye Daxue Xuebao TFSOA4 Trans. Faraday Soc. WLHPAR Wuli Xuebao
SIMPAL Rend. Soc. Ital. Mineral. Petrol. THACAS Thermochim. Acta WUHUE7 Wuji Huaxue
SINCDO Stud. Inorg. Chem. THHPD3 Cuihua Xuebao XAERAK U.S.A.E.C.
SITKA7 Silikattechnik THSFAP Thin Solid Films XANLDG Argonne Natl. Lab., Rep. ANL
SJCCDA Sov. J. Coord. Chem. TIIMA3 Trans. Indian Inst. Met. XBNSDA X-sen Bunseki no Shinpo
SKHDFD Shizen Kagaku Kenkyusho Kenkyu Hokoku, TIKNAG Tr. Inst. Khim. Nauk, Akad. Nauk Kaz. SSR XIJID9 Xiyou Jinshu
Okayama Rika Daigaku TIKRAS Tr. Inst. Kristallogr., Akad. Nauk SSSR XJCGEA Xiyou Jinshu Cailiao Yu Gongcheng
SKTIAF Sven. Kem. Tidskr. TITAL0 Titanium Its Alloys Engl. Transl. XSAOAF Anal. Sci.: X-ray Struct. Anal. Online
SMCSB9 Semin. Chim. Etat Solide TJIMAA Trans. Jpn. Inst. Met. YGKSA4 Yogyo Kyokaishi
SMFRM0 Stabiln. Metastabiln. Fazovye Ravnovesiya Met. TJSCAU Tex. J. Sci. YIHUED Yingyong Huaxue
Sist. TKHCDJ Taehan Kumsok Hakhoechi YKJIEZ Yuanzineng Kexue Jishu
SMICES Semiconductors TLNRBV Kakuriken Kenkyu Hokoku (Tohoku Daigaku) YPHJAP Yoop Hakhoechi
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SOPJAQ Sov. Phys. J. TNMCEW Trans. Nonferrous Met. Soc. China ZBRNSI Zb. Rad. Prir.-Mat. Fak. Univ. Novom Sadu
SPCHBV Sov. Prog. Chem. TOKHA6 Toyota Kenkyu Hokoku ZEAPAA Z. Elektrochem. Angew. Phys. Chem.
SPHCA6 Sov. Phys. Crystallogr. TSMBAQ Titan Ego Splavy ZECEAL Z. Chem.
SPHDA9 Sov. Phys. Dokl. TTMMDZ TMPM, Tschermaks Mineral. Petrogr. Mitt. ZEELAI Z. Elektrochem.
SPHJAR Sov. Phys. JETP TYPIX0 TYPIX, Standardized Data Crystal Chem. ZEKRDZ Z. Kristallogr.
SPIPAG Sci. Pap. Inst. Phys. Chem. Res. (Jpn.) Characteriz. Inorg. Structure Types ZEMTAE Z. Metallkd.
SPMCAV Sov. Powder Metall. Met. Ceram. UFIZAW Ukr. Fiz. Zh. Russ. Ed. ZENAAU Z. Naturforsch. A
SPPPEL Springer Proc. Phys. UFZHAT Ukr. Fiz. Zh. Ukr. Ed. ZENBAX Z. Naturforsch. B
SPSSA7 Sov. Phys. Solid State UJPKAG Ukr. J. Phys. ZEOLD3 Zeolites
SPTPA3 Sov. Phys. Tech. Phys. UKAMBN U.K. At. Energy Auth., Harwell Lab., Memo ZEPCAC Z. Phys. Chem. Stoechiom. Verwandtschaftsl.
SRIMCN Synth. React. Inorg. Met.-Org. Chem. AERE-M ZEPYAA Z. Phys.
SRIMDO Synth. React. Inorg. Met.-Org. Nano-Met. Chem. UKCJEN Ukr. Chem. J. ZFKHA9 Zh. Fiz. Khim.
SROCDO Spec. Publ. - R. Soc. Chem. UKKZA9 Ukr. Khim. Zh. Ukr. Ed. ZHJIDO Zhongguo Jiguang
SSASEA Sci. Sin., Ser. A Engl. Ed. UKPJAK Ukr. Phys. J. ZKCMAJ Z. Kristallogr. - Cryst. Mater.
SSBSEF Sci. Sin., Ser. B Engl. Ed. UKZHAU Ukr. Khim. Zh. ZKKKAJ Z. Kristallogr.
SSCOA4 Solid State Commun. ULTRD6 Ultramicroscopy ZKNSFT Z. Kristallogr. - New Cryst. Struct.
SSCTDM Stud. Surf. Sci. Catal. URKN11 Tezisy Dokl Ukr. Resp. Konf. Neorg. Khim., ZMGPAS Zentralbl. Mineral. Geol. Palaeontol.
SSINAV Sci. Sin. Engl. Ed. 11th ZNASEI Z. Naturforsch. A
SSIOD3 Solid State Ionics UTSGAL Univ. Toronto Stud., Geol. Ser. ZNBAD2 Z. Naturforsch. B
SSSCFJ Solid State Sci. VBSFA5 Vestsi Akad. Navuk BSSR, Ser. Fiz.-Mat. Navuk ZNBSEN Z. Naturforsch. B
SSTEET Semicond. Sci. Technol. VDUPN0 Visn. Donetsk. Nats. Univ., Ser. A: Pryr. Nauky ZNOKAQ Zh. Neorg. Khim.
STAMCV Sci. Technol. Adv. Mater. VISPEK Vib. Spectrosc. ZPBBDJ Z. Phys. B: Condens. Matter Quanta
STCHES Struct. Chem. VKSFAY Visn. Kiiv. Univ., Ser. Fiz. ZPCBAL Z. Phys. Chem., Abt. B
STSUEB Stud. High Temp. Supercond. VLDUAB Visn. Lviv. Derzh. Univ., Ser. Khim. ZPCFAX Z. Phys. Chem. (Munich)
SUKBAJ Suom. Kemistil. B VLUFBI Vestn. Leningr. Univ., Ser. 4 ZPCMDN Z. Phys. B: Condens. Matter
SUNVAQ Skr. Nor. Vidensk.-Akad., Kl. 1: Mat.- VMUFAO Vestn. Mosk. Univ., Ser. 3 ZRMOBN Zap. Ross. Mineral. O-va.
Naturvidensk. Kl. VMUGAR Vestn. Mosk. Univ., Ser. 4 ZSTKAI Zh. Strukt. Khim.
SUSTEF Supercond. Sci. Technol. VMUKA5 Vestn. Mosk. Univ., Ser. 2 ZTAKDZ Z. Naturforsch. A
SVCMAJ Sb. Vys. Sk. Chem.-Technol. Praze, G: Mineral. VMUSAT Vestn. Mosk. Univ., Ser. Fiz.-Mat. Estestv. Nauk ZTEFA3 Zh. Tekh. Fiz.
SVRDAX Sov. Radiochem. VSKDAA Vestn. Slov. Kem. Drus. ZVMOAG Zap. Vses. Mineral. O-va.
SYMEDZ Synth. Met. VSUKEH Vestn. S.-Peterb. Univ. Ser. 4 ZVMOEK Zap. Vseross. Mineral. O-va.
TAAFA3 Sov. J. Contemp. Phys. VULPK0 Visn. Nats. Univ. "Lviv. Politekh.", Khim., ZXXUE5 Zhongguo Xitu Xuebao
TACAAH Trans. Am. Crystallogr. Assoc. Tekhnol. Rechovyn. Zas.
Contents

Preface . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . v

List of journal CODENs . . . . . . . . . . . . . . . . . . . . . . . . . . . ix

1 Handbook of Inorganic Substances 2015 : Data . . . . . . . . . . . . . . . . . . 1

2 Handbook of Inorganic Substances 2015 : References . . . . . . . . . . . . . . . 1541


Handbook of Inorganic Substances
2015

Data
Handbook of Inorganic Substances – Edition 2015 : Data 3

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ac Ac Cu,cF4,225 Fm-3m 0.5311,0.5311,0.5311,90,90,90 close-packed structure gray silvery 10.07 X 1459


Ag Ag Cu,cF4,225 Fm-3m 0.40863,0.40863,0.40863,90,90,90 close-packed structure gray silvery 10.50 X 33133
Ag Ag hp Hg,hR3,166 R-3m 0.2753,0.2753,0.671,90,90,120 close-packed structure - 12.20 X 50847
Ag Ag 2H Mg,hP2,194 P63/mmc 0.293,0.293,0.479,90,90,120 close-packed structure - 10.06 X 12915
Ag Ag 4H Nd,hP4,194 P63/mmc 0.293,0.293,1.018,90,90,120 close-packed structure - 9.47 X 12915
Ag Ag m *,oP16,* - 0.4119,0.841,0.8535,90,90,90 - - 9.69 N 49289
Al Al Cu,cF4,225 Fm-3m 0.40496,0.40496,0.40496,90,90,90 close-packed structure gray silvery 2.70 X 1605
Am Am rt Nd,hP4,194 P63/mmc 0.34681,0.34681,1.1241,90,90,120 close-packed structure white silvery 13.79 X 1692
Am Am ht1/hp1 Cu,cF4,225 Fm-3m 0.48984,0.48984,0.48984,90,90,90 close-packed structure - 13.73 X 1692
Am Am hp2 Pu,oF8,70 Fddd 0.3116,0.567,1.0115,90,90,90 - - 18.06 X 39337
Am Am hp3 Cs,oP4,62 Pnma 0.5093,0.4679,0.3028,90,90,90 close-packed structure - 22.37 X 39337
Ar Ar ccp Cu,cF4,225 Fm-3m 0.53112,0.53112,0.53112,90,90,90 close-packed structure - 1.77 X 3643
Ar Ar hcp Mg,hP2,194 P63/mmc 0.38,0.38,0.62,90,90,120 close-packed structure - 1.71 X 32864
As As As,hR6,166 R-3m 0.37598,0.37598,1.05475,90,90,120 - gray 5.78 X 4677
As As ars P,oS8,64 Cmce 0.365,1.1,0.447,90,90,90 arsenolamprite black 5.55 X 9258
As As m-hp *,tP*,* - 0.8691,0.8691,0.6363,90,90,90 - - - N 6800
As As hp1 Po,cP1,221 Pm-3m 0.255,0.255,0.255,90,90,90 - - 7.50 X 23946
As As hp2 *,mS8,15 C12/c1 0.74892,0.67464,0.32491,90,115.365,90 host-guest structure - 8.90 P 43785
As As hp3 W,cI2,229 Im-3m 0.2804,0.2804,0.2804,90,90,90 b.c.c. family - 11.29 X 30890
Au Au Cu,cF4,225 Fm-3m 0.40788,0.40788,0.40788,90,90,90 close-packed structure golden 19.28 X 2663
B B rhom1 B,hR423,166 R-3m 1.09221,1.09221,2.38067,90,90,120 β-boron family gray 2.34 X 52814
B B rhom2 B,hR36,166 R-3m 0.49179,0.49179,1.25805,90,90,120 - red 2.45 X 39484
B B hp B,oP28,58 Pnnm 0.50563,0.56126,0.6971,90,90,90 - red dark 2.54 X 51426
B B m tet B,tP50,134 P42/nnm 0.8708,0.8708,0.5075,90,90,90 - gray reddish 2.33 X 59621
B B m rhom B,hR45,166 R-3m 0.5594,0.5594,1.20756,90,90,120 - yellow orange 2.47 X 59621
B B tet2? B,tP196,76 P41 1.014,1.014,1.417,90,90,90 - black 2.34 X 11425
Ba Ba W,cI2,229 Im-3m 0.5028,0.5028,0.5028,90,90,90 b.c.c. family gray white 3.59 X 26069
Ba Ba hp1 Mg,hP2,194 P63/mmc 0.38513,0.38513,0.59729,90,90,120 close-packed structure - 5.94 X 29363
Ba Ba hp2 *,tI8,140 I4/mcm 0.84207,0.84207,0.43769,90,90,90 host-guest structure - 7.77 P 36482
Ba Ba hp3 *,tI8,140 I4/mcm 0.8346,0.8346,0.46966,90,90,90 host-guest structure - 7.50 N 36482
Ba Ba hp4 Mg,hP2,194 P63/mmc 0.31035,0.31035,0.48778,90,90,120 close-packed structure - 11.21 X 29363
Be Be rt Mg,hP2,194 P63/mmc 0.22859,0.22859,0.35842,90,90,120 close-packed structure gray white 1.85 X 318
Be Be ht W,cI2,229 Im-3m 0.2552,0.2552,0.2552,90,90,90 b.c.c. family - 1.80 X 13856
Be Be hp? Be,oP4,18 P21212 0.3416,0.3755,0.2168,90,90,90 close-packed structure - 2.15 X 17185
Bi Bi As,hR6,166 R-3m 0.45459,0.45459,1.18623,90,90,120 - gray silvery 9.81 A 317
Bi Bi hp1 Bi,mS4,12 C12/m1 0.66726,0.61108,0.33001,90,110.412,90 - black 11.01 X 42486
Bi Bi hp2 *,tI8,140 I4/mcm 0.85182,0.85182,0.41642,90,90,90 host-guest structure - 12.20 P 42913
Bi Bi ht-hp1 Cs,oS16,64 Cmce 1.1191,0.6622,0.6608,90,90,90 - - 11.34 X 58153
Bi Bi ht-hp2 W,cI2,229 Im-3m 0.38,0.38,0.38,90,90,90 b.c.c. family - 12.65 X 7366
Bk Bk rt Nd,hP4,194 P63/mmc 0.3412,0.3412,1.106,90,90,120 close-packed structure gray silvery 14.71 X 23688
Bk Bk ht/hp1 Cu,cF4,225 Fm-3m 0.4997,0.4997,0.4997,90,90,90 close-packed structure - 13.15 X 6074
Br [Br2 ] lt [I2],oS8,64 Cmce 0.6737,0.4548,0.8761,90,90,90 - - 3.95 A 1048
Br Br hp I,oI2,71 Immm 0.236,0.263,0.457,90,90,90 - - 9.36 X 22760
C C gra C-a,hP4,194 P63/mmc 0.2464,0.2464,0.6711,90,90,120 graphite black 2.26 X 9250
C C gra 3R C,hR6,166 R-3m 0.2461,0.2461,1.0061,90,90,120 - - 2.27 X 219
C C dia C,cF8,227 Fd-3m 0.35671,0.35671,0.35671,90,90,90 diamond colorless 3.52 X 29350
C C dia-n C,hR6,160 R3m 0.25321,0.25321,0.62023,90,90,120 - - 3.47 X 47229
C C lon C-b,hP4,194 P63/mmc 0.252,0.252,0.412,90,90,120 lonsdaleite - 3.52 X 3603
C C dia 8H C,hP16,194 P63/mmc 0.2481,0.2481,1.6268,90,90,120 adamantane structure black 3.68 X 49940
C C dense1 Si,cI16,206 Ia-3 0.4293,0.4293,0.4293,90,90,90 - - 4.03 X 22325
C C dense2 C,cI16,229 Im-3m 0.4279,0.4279,0.4279,90,90,90 - - 4.07 X 14607
C [C60 ] rt [C60],cF1924,225 Fm-3m 1.416,1.416,1.416,90,90,90 fullerene family brown dark 1.69 X 27142
C [C60 ] lt [C60],cP240,205 Pa-3 1.40478,1.40478,1.40478,90,90,90 fullerene family - 1.73 X 25223
C [C60 ] 1D orth Lix[C60],oP120,58 Pnnm 0.978,1.4752,0.9091,90,90,90 fullerene family - 1.82 X 50120
C [C60 ] 2D tet [C60],tP144,131 P42/mmc 0.9064,0.9064,1.5039,90,90,90 fullerene family - 1.94 X 41348
C [C60 ] 2D orth [C60]-a,oI120,71 Immm 0.909,0.909,1.495,90,90,90 fullerene family - 1.94 X 36461
C [C60 ] 2D rhom [C60]-b,hR180,166 R-3m 0.9175,0.9175,2.4568,90,90,120 fullerene family - 2.00 X 39910
C [C60 ] 3D cub [C60],cF240,202 Fm-3 1.193,1.193,1.193,90,90,90 fullerene family - 2.82 X 50530
C [C60 ] 3D orth [C60]-b,oI120,71 Immm 0.786,0.859,1.273,90,90,90 fullerene family - 2.78 X 47378
C [C70 ] hcp rt Mg,hP2,194 P63/mmc 1.0104,1.0104,1.8584,90,90,120 fullerene family - 1.70 X 28646
C [C70 ] hcp lt *,mP560,11 P121/m1 1.996,1.851,1.996,90,120.,90 fullerene family - 1.75 N 25893
C [C70 ] ccp ht Cu,cF4,225 Fm-3m 1.497,1.497,1.497,90,90,90 fullerene family - 1.66 X 27988
C [C76 ] Cu,cF4,225 Fm-3m 1.5475,1.5475,1.5475,90,90,90 fullerene family - 1.64 X 30898
C [C82 ] *,cP1968,205 Pa-3 1.576,1.576,1.576,90,90,90 fullerene family - 1.67 N 43756
C [C84 ] Cu,cF4,225 Fm-3m 1.5817,1.5817,1.5817,90,90,90 fullerene family - 1.69 X 34222
Ca Ca rt Cu,cF4,225 Fm-3m 0.55884,0.55884,0.55884,90,90,90 close-packed structure gray silvery 1.53 X 1051
Ca Ca ht/hp1 W,cI2,229 Im-3m 0.448,0.448,0.448,90,90,90 b.c.c. family - 1.48 X 1051
Ca Ca hp2 Po,cP1,221 Pm-3m 0.2642,0.2642,0.2642,90,90,90 - - 3.61 X 53194
Ca Ca hp3 Ca,tP8,92 P41212 0.3209,0.3209,0.8976,90,90,90 - - 5.76 X 51302
Ca Ca hp4 Ca,oS8,64 Cmce 0.4319,0.4505,0.4315,90,90,90 - - 6.34 X 51302
Ca Ca hp6 Ca,tP128,138 P42/ncm 1.1022,1.1022,0.9181,90,90,90 - - 7.64 X 59717
Ca Ca stab Mg,hP2,194 P63/mmc 0.394,0.394,0.644,90,90,120 close-packed structure - 1.54 X 741
Cd Cd Mg,hP2,194 P63/mmc 0.29789,0.29789,0.56172,90,90,120 close-packed structure gray bluish 8.65 X 23678
Ce Ce rt Nd,hP4,194 P63/mmc 0.3673,0.3673,1.1802,90,90,120 close-packed structure white silvery 6.75 X 1724
Ce Ce ht1/hp1 Cu,cF4,225 Fm-3m 0.51612,0.51612,0.51612,90,90,90 close-packed structure - 6.77 X 4096
Ce Ce ht2 W,cI2,229 Im-3m 0.412,0.412,0.412,90,90,90 b.c.c. family - 6.65 X 1444
Ce Ce hp2 Cu,cF4,225 Fm-3m 0.4628,0.4628,0.4628,90,90,90 close-packed structure - 9.39 X 10712
Ce Ce hp3 U,oS4,63 Cmcm 0.3049,0.5988,0.5215,90,90,90 close-packed structure - 9.78 X 10316
4 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ce Ce hp4 In,tI2,139 I4/mmm 0.2827,0.2827,0.4777,90,90,90 close-packed structure - 12.19 X 16972


Ce Ce m-hp1 Ce,mS2,12 C12/m1 0.5544,0.3102,0.3104,90,122.04,90 close-packed structure - 10.28 X 10316
Ce Ce m-hp2 Ce,mS4,12 C12/m1 0.5813,0.3148,0.5622,90,112.85,90 close-packed structure - 9.82 X 11799
Cf Cf Nd,hP4,194 P63/mmc 0.338,0.338,1.1025,90,90,120 close-packed structure gray silvery 15.28 X 23688
Cf Cf hp1 Cu,cF4,225 Fm-3m 0.478,0.478,0.478,90,90,90 close-packed structure - 15.27 X 19440
Cf Cf hp2 Cf,aP4,2 P-1 0.2793,0.3307,0.7412,85.70,89.06,85.15 close-packed structure - 24.51 X 19124
Cl [Cl2] lt [I2],oS8,64 Cmce 0.62929,0.45361,0.81617,90,90,90 - - 2.02 X 17311
Cm Cm rt Nd,hP4,194 P63/mmc 0.352,0.352,1.1396,90,90,120 close-packed structure gray silvery 13.42 X 23688
Cm Cm ht/hp1 Cu,cF4,225 Fm-3m 0.4933,0.4933,0.4933,90,90,90 close-packed structure - 13.67 X 23688
Cm Cm hp2 Cm,mS4,15 C12/c1 0.5346,0.2886,0.5328,90,116.2,90 - - 22.24 X 45523
Cm Cm hp3 Pu,oF8,70 Fddd 0.2737,0.5315,0.8925,90,90,90 - - 25.27 X 45523
Cm Cm hp4 Cs,oP4,62 Pnma 0.4634,0.4394,0.2682,90,90,90 close-packed structure - 30.04 X 45523
Co Co rt Mg,hP2,194 P63/mmc 0.25089,0.25089,0.40696,90,90,120 close-packed structure white silvery 8.82 X 33133
Co Co ht Cu,cF4,225 Fm-3m 0.35447,0.35447,0.35447,90,90,90 close-packed structure - 8.79 X 33133
Co Co m cub Mn,cP20,213 P4132 0.6097,0.6097,0.6097,90,90,90 - black 8.64 X 35401
Co Co m hex Co,hP46,186 P63mc 0.8288,0.8288,1.0542,90,90,120 - - 7.18 X 5601
Cr Cr W,cI2,229 Im-3m 0.2885,0.2885,0.2885,90,90,90 b.c.c. family gray steel 7.19 X 659
Cr Cr m Cr,cP8,223 Pm-3n 0.46,0.46,0.46,90,90,90 - - 7.10 X 10713
Cr Cr (H) Mg,hP2,194 P63/mmc 0.27224,0.27224,0.44342,90,90,120 close-packed structure - 6.07 X 1501
Cs Cs W,cI2,229 Im-3m 0.6141,0.6141,0.6141,90,90,90 b.c.c. family golden pale 1.91 X 6037
Cs Cs hp1 Cu,cF4,225 Fm-3m 0.6465,0.6465,0.6465,90,90,90 close-packed structure - 3.27 X 6037
Cs Cs hp2 Cs,oS84,20 C222 1 0.92718,1.33013,3.42025,90,90,90 close-packed structure - 4.40 X 39345
Cs Cs hp3 Cs,tI4,141 I41/amd 0.33366,0.33366,1.2408,90,90,90 - - 6.39 X 36166
Cs Cs hp4 Cs,oS16,64 Cmce 1.1205,0.6626,0.6595,90,90,90 - - 7.21 X 35065
Cs Cs hp5 Mg,hP2,194 P63/mmc 0.3011,0.3011,0.4855,90,90,120 close-packed structure - 11.58 X 25293
Cu Cu Cu,cF4,225 Fm-3m 0.36152,0.36152,0.36152,90,90,90 close-packed structure orange red 8.93 X 24851
D [D2] lt1 Mg,hP2,194 P63/mmc 0.3606,0.3606,0.58884,90,90,120 close-packed structure - 0.20 X 16969
D [D2] lt2 [N2],cP8,205 Pa-3 0.5084,0.5084,0.5084,90,90,90 close-packed structure - 0.20 A 3224
Dy Dy rt Mg,hP2,194 P63/mmc 0.35903,0.35903,0.56475,90,90,120 close-packed structure white silvery 8.56 X 745
Dy Dy ht W,cI2,229 Im-3m 0.3982,0.3982,0.3982,90,90,90 b.c.c. family - 8.55 X 22687
Dy Dy lt U,oS4,63 Cmcm 0.36016,0.61917,0.56728,90,90,90 close-packed structure - 8.53 A 51235
Dy Dy hp1 Sm,hR9,166 R-3m 0.34014,0.34014,2.456,90,90,120 close-packed structure - 9.87 A 49319
Dy Dy hp2 Nd,hP4,194 P63/mmc 0.3145,0.3145,1.0117,90,90,120 close-packed structure - 12.46 X 49319
Dy Dy hp3 Cu,cF4,225 Fm-3m 0.39778,0.39778,0.39778,90,90,90 close-packed structure - 17.15 X 49319
Dy Dy hp4 rhom Pr,hR24,166 R-3m 0.56256,0.56256,1.3767,90,90,120 close-packed structure - 17.16 X 49319
Dy Dy hp4 orth Dy,oS8,65 Cmmm 0.56307,0.78958,0.2922,90,90,90 - - 16.62 X 49319
Er Er Mg,hP2,194 P63/mmc 0.35588,0.35588,0.55874,90,90,120 close-packed structure white silvery 9.06 X 745
Er Er hp1 Sm,hR9,166 R-3m 0.328,0.328,2.3236,90,90,120 close-packed structure - 11.55 X 56618
Er Er hp2 Nd,hP4,194 P63/mmc 0.3043,0.3043,0.9904,90,90,120 close-packed structure - 13.99 X 56618
Er Er hp3 Pr,hR24,166 R-3m 0.55412,0.55412,1.35788,90,90,120 close-packed structure - 18.46 X 56618
Er Er hp4 Ce,mS4,12 C12/m1 0.45402,0.2667,0.43553,90,105.77,90 close-packed structure - 21.89 X 56618
Er Er tf Cu,cF4,225 Fm-3m 0.509,0.509,0.509,90,90,90 close-packed structure - 8.42 X 7544
Er Er stab W,cI2,229 Im-3m 0.394,0.394,0.394,90,90,90 b.c.c. family - 9.08 X 2388
Eu Eu W,cI2,229 Im-3m 0.4606,0.4606,0.4606,90,90,90 b.c.c. family white silvery 5.16 X 745
Eu Eu hp1 Mg,hP2,194 P63/mmc 0.30978,0.30978,0.47744,90,90,120 close-packed structure - 12.72 X 59618
Eu Eu hp2 Ga,mS4,15 C12/c1 0.30838,0.53002,0.47239,90,90.39,90 - - 13.07 X 59303
Eu Eu hp3 Cs,oP4,62 Pnma 0.4977,0.4264,0.2944,90,90,90 close-packed structure - 16.16 X 57138
Eu Eu hp-stab1 Eu,hR18,167 R-3c 0.9293,0.9293,0.5381,90,90,120 - - 11.29 X 58826
Eu Eu hp-stab2 Ga,cI12,220 I-43d 0.6667,0.6667,0.6667,90,90,90 - - 10.22 X 59618
F [F2] lt1 [F2],cP8,223 Pm-3n 0.667,0.667,0.667,90,90,90 - yellow pale 1.70 X 2110
F [F2] lt2 [F2],mS8,15 C12/c1 0.55,0.328,0.728,90,102.17,90 - - 1.97 X 5426
Fe Fe rt W,cI2,229 Im-3m 0.28652,0.28652,0.28652,90,90,90 b.c.c. family gray 7.89 X 14824
Fe Fe ht1 Cu,cF4,225 Fm-3m 0.36477,0.36477,0.36477,90,90,90 close-packed structure - 7.64 X 2819
Fe Fe ht2 W,cI2,229 Im-3m 0.29378,0.29378,0.29378,90,90,90 b.c.c. family - 7.32 X 3770
Fe Fe hp Mg,hP2,194 P63/mmc 0.2416,0.2416,0.387,90,90,120 close-packed structure - 9.48 X 3574
Fe Fe ht-hp Cs,oP4,57 Pbcm 0.236,0.4172,0.4098,90,90,90 - - 9.19 X 36911
Ga Ga Ga,oS8,64 Cmce 0.4523,0.7661,0.4524,90,90,90 - gray silvery 5.91 X 1791
Ga Ga hp1 Ga,oS104,20 C222 1 0.5976,0.8576,3.5758,90,90,90 - - 6.57 X 43798
Ga Ga hp2 Eu,hR18,167 R-3c 0.83272,0.83272,0.47221,90,90,120 - - 7.35 X 43798
Ga Ga hp4 Cu,cF4,225 Fm-3m 0.336,0.336,0.336,90,90,90 close-packed structure - 12.21 X 35058
Ga Ga hp1-m In,tI2,139 I4/mmm 0.2813,0.2813,0.4452,90,90,90 close-packed structure - 6.57 X 11639
Ga Ga m1 Ga,mS4,15 C12/c1 0.2766,0.8053,0.3332,90,92.03,90 - - 6.24 X 4449
Ga Ga m2 Ga,oS40,63 Cmcm 1.0593,1.3523,0.5203,90,90,90 - - 6.21 X 6410
Ga Ga m3 Ga,hR66,166 R-3m 0.9087,0.9087,1.702,90,90,120 - - 6.28 X 7182
Gd Gd rt Mg,hP2,194 P63/mmc 0.3636,0.3636,0.57826,90,90,120 close-packed structure white silvery 7.89 X 745
Gd Gd ht W,cI2,229 Im-3m 0.4063,0.4063,0.4063,90,90,90 b.c.c. family - 7.79 X 22687
Gd Gd hp1 Sm,hR9,166 R-3m 0.3436,0.3436,2.483,90,90,120 close-packed structure - 9.26 A 11623
Gd Gd hp2 Nd,hP4,194 P63/mmc 0.3415,0.3415,1.0864,90,90,120 close-packed structure - 9.52 X 49314
Gd Gd hp3 Cu,cF4,225 Fm-3m 0.439,0.439,0.439,90,90,90 close-packed structure - 12.35 X 49314
Gd Gd hp4 Pr,hR24,166 R-3m 0.6138,0.6138,1.5185,90,90,120 close-packed structure - 12.65 X 49314
Gd Gd hp5 Ce,mS4,12 C12/m1 0.532,0.2802,0.5,90,112.01,90 close-packed structure - 15.12 X 49314
Gd Gd tf Cu,cF4,225 Fm-3m 0.54,0.54,0.54,90,90,90 close-packed structure - 6.63 X 7544
Ge Ge C,cF8,227 Fd-3m 0.56579,0.56579,0.56579,90,90,90 - white gray 5.32 X 8689
Ge Ge hp1 Sn,tI4,141 I41/amd 0.48894,0.48894,0.26922,90,90,90 - - 7.49 X 51649
Ge Ge hp2 Si,oI4,74 Imma 0.4386,0.4572,0.2461,90,90,90 - - 9.77 X 32272
Ge Ge hp3 (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.24631,0.24631,0.22917,90,90,120 - - 10.01 X 37997
Ge Ge hp4 Cs,oS16,64 Cmce 0.7885,0.4655,0.4651,90,90,90 - - 11.30 X 37997
Ge Ge hp5 Mg,hP2,194 P63/mmc 0.2398,0.2398,0.3909,90,90,120 close-packed structure - 12.38 X 39347
Handbook of Inorganic Substances – Edition 2015 : Data 5

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ge Ge m-hp1 Si,cI16,206 Ia-3 0.6932,0.6932,0.6932,90,90,90 - - 5.79 X 28003


Ge Ge m-hp2 Ge,tP12,92 P41212 0.59281,0.59281,0.69803,90,90,90 - - 5.90 X 51649
Ge Ge m 4H C,hP8,194 P63/mmc 0.39902,0.39902,1.3107,90,90,120 - - 5.34 X 54753
Ge Ge m allo *,oP128,26 Pmc21 2.3887,0.7787,1.6304,90,90,90 - - 5.09 N 15045
Ge Ge clath Si,cF136,227 Fd-3m 1.52115,1.52115,1.52115,90,90,90 clathrate - 4.66 X 47813
H [H2] lt1 Mg,hP2,194 P63/mmc 0.3782,0.3782,0.6167,90,90,120 close-packed structure - 0.09 X 16593
H [H2] lt2 Cu,cF4,225 Fm-3m 0.521,0.521,0.521,90,90,90 close-packed structure - 0.09 X 3153
He He hp Mg,hP2,194 P63/mmc 0.365,0.365,0.5945,90,90,120 close-packed structure - 0.19 X 1734
He He lt-hp Cu,cF4,225 Fm-3m 0.4242,0.4242,0.4242,90,90,90 close-packed structure - 0.35 X 1503
He He hp-bcc? W,cI2,229 Im-3m 0.411,0.411,0.411,90,90,90 b.c.c. family - 0.19 X 1734
Hf Hf rt Mg,hP2,194 P63/mmc 0.31965,0.31965,0.5058,90,90,120 close-packed structure gray dark 13.24 X 20580
Hf Hf ht W,cI2,229 Im-3m 0.3625,0.3625,0.3625,90,90,90 b.c.c. family - 12.44 X 1916
Hg Hg lt/hp1 Hg,hR3,166 R-3m 0.34644,0.34644,0.66775,90,90,120 close-packed structure gray silvery 14.40 X 843
Hg Hg hp2 Pa,tI2,139 I4/mmm 0.3995,0.3995,0.2825,90,90,90 b.c.c. family - 14.78 X 1111
Hg Hg hp3 Hg,mS6,12 C12/m1 0.5179,0.2797,0.7964,90,107.96,90 - - 18.21 X 49136
Hg Hg hp4 Mg,hP2,194 P63/mmc 0.2815,0.2815,0.4927,90,90,120 close-packed structure - 19.70 X 49136
Ho Ho Mg,hP2,194 P63/mmc 0.35773,0.35773,0.56158,90,90,120 close-packed structure white silvery 8.80 X 745
Ho Ho hp1 Sm,hR9,166 R-3m 0.334,0.334,2.41,90,90,120 close-packed structure - 10.59 A 2766
Ho Ho tf Cu,cF4,225 Fm-3m 0.515,0.515,0.515,90,90,90 close-packed structure - 8.02 X 7544
Ho Ho stab W,cI2,229 Im-3m 0.396,0.396,0.396,90,90,90 b.c.c. family - 8.82 X 2388
I [I2] [I2],oS8,64 Cmce 0.71802,0.47102,0.98103,90,90,90 - gray 5.08 X 26496
I I hp1 I,mS8,12 C12/m1 0.3951,0.5768,0.89603,90,90.091,90 - - 8.26 X 51203
I I hp2 In,oF4,69 Fmmm 0.42039,0.4228,0.54868,90,90,90 - - 8.64 X 44052
I I hp3 I,oI2,71 Immm 0.2904,0.3031,0.5252,90,90,90 - - 9.12 X 15484
I I hp4 In,tI2,139 I4/mmm 0.29416,0.29416,0.488,90,90,90 close-packed structure - 9.98 X 44052
I I hp5 Cu,cF4,225 Fm-3m 0.424,0.424,0.424,90,90,90 close-packed structure - 11.06 X 20599
In In In,tI2,139 I4/mmm 0.32529,0.32529,0.49459,90,90,90 close-packed structure gray white 7.29 X 23678
In In hp In,oF4,69 Fmmm 0.3769,0.3846,0.414,90,90,90 - - 12.71 X 27973
Ir Ir Cu,cF4,225 Fm-3m 0.38393,0.38393,0.38393,90,90,90 close-packed structure white silvery 22.56 X 24851
K K W,cI2,229 Im-3m 0.5328,0.5328,0.5328,90,90,90 b.c.c. family gray silvery 0.86 X 19224
K K hp1 Cu,cF4,225 Fm-3m 0.657,0.657,0.657,90,90,90 close-packed structure - 0.92 X 29354
K K hp2 *,tI16,140 I4/mcm 0.9715,0.9715,0.4687,90,90,90 host-guest structure - 3.53 P 47362
K K hp3 Na,oP8,62 Pnma 0.5602,0.3311,0.638,90,90,90 - - 4.39 X 53223
K K hp4 Cs,tI4,141 I4 1/amd 0.2322,0.2322,0.8669,90,90,90 - - 5.56 X 53223
K K hp5 Cs,oS16,64 Cmce 0.8032,0.4753,0.4716,90,90,90 - - 5.77 A 53223
K K hp hex Nd,hP4,194 P63/mmc 0.4218,0.4218,0.57369,90,90,120 close-packed structure - 2.94 X 53257
Kr Kr lt Cu,cF4,225 Fm-3m 0.56458,0.56458,0.56458,90,90,90 close-packed structure - 3.09 X 3643
Kr Kr hp hex Mg,hP2,194 P63/mmc 0.316,0.316,0.518,90,90,120 close-packed structure - 6.21 X 40703
La La rt Nd,hP4,194 P63/mmc 0.377,0.377,1.2159,90,90,120 close-packed structure white silvery 6.16 X 745
La La ht1 Cu,cF4,225 Fm-3m 0.53057,0.53057,0.53057,90,90,90 close-packed structure - 6.18 X 3590
La La ht2 W,cI2,229 Im-3m 0.426,0.426,0.426,90,90,90 b.c.c. family - 5.97 X 1444
Li Li rt W,cI2,229 Im-3m 0.35107,0.35107,0.35107,90,90,90 b.c.c. family white silvery 0.53 X 880
Li Li lt Sm,hR9,166 R-3m 0.3101,0.3101,2.27649,90,90,120 close-packed structure - 0.55 A 22751
Li Li hp1 Cu,cF4,225 Fm-3m 0.4357,0.4357,0.4357,90,90,90 close-packed structure - 0.56 X 9378
Li Li hp2 Hg,hR3,166 R-3m 0.24023,0.24023,0.55159,90,90,120 close-packed structure - 1.25 X 37904
Li Li hp3 Na,cI16,220 I-43d 0.5138,0.5138,0.5138,90,90,90 - - 1.36 X 37904
Lu Lu Mg,hP2,194 P63/mmc 0.35031,0.35031,0.55509,90,90,120 close-packed structure white silvery 9.85 X 745
Lu Lu stab W,cI2,229 Im-3m 0.39,0.39,0.39,90,90,90 b.c.c. family - 9.80 X 2388
Mg Mg Mg,hP2,194 P63/mmc 0.32093,0.32093,0.52103,90,90,120 close-packed structure gray 1.74 X 317
Mg Mg hp W,cI2,229 Im-3m 0.2953,0.2953,0.2953,90,90,90 b.c.c. family - 3.14 X 18401
Mn Mn rt Mn,cI58,217 I-43m 0.8911,0.8911,0.8911,90,90,90 - gray silvery 7.48 X 4979
Mn Mn ht1 Mn,cP20,213 P4132 0.6315,0.6315,0.6315,90,90,90 - - 7.25 X 11303
Mn Mn ht2 stab In,tI2,139 I4/mmm 0.26842,0.26842,0.3592,90,90,90 close-packed structure - 7.05 X 6139
Mn Mn ht3 W,cI2,229 Im-3m 0.308,0.308,0.308,90,90,90 b.c.c. family - 6.24 X 15543
Mn Mn lt Mn,tI58,121 I-42m 0.8877,0.8877,0.8873,90,90,90 - - 7.57 X 28884
Mo Mo W,cI2,229 Im-3m 0.3147,0.3147,0.3147,90,90,90 b.c.c. family gray silvery 10.22 X 4312
N [N2] lt1 [N2]-b,hP24,194 P63/mmc 0.4087,0.4087,0.665,90,90,120 - colorless 0.97 A 1044
N [N2] lt2 [N2],cP8,198 P213 0.565,0.565,0.565,90,90,90 - - 1.03 X 6497
N [N2] hp-lt γ [N2],tP4,136 P42/mnm 0.3957,0.3957,0.5109,90,90,90 - - 1.16 X 5339
N [N2] hp [O2],cP64,223 Pm-3n 0.6164,0.6164,0.6164,90,90,90 - - 1.59 X 14047
N [N2] hp-lt ε [N2],hR48,167 R-3c 0.802,0.802,1.1104,90,90,120 - - 1.81 X 19175
N [N2] hp-lt δ* [N2],tP176,138 P42/ncm 0.8063,0.8063,0.5685,90,90,90 - - 2.01 X 52645
N [N2] ht-hp [N2],cI8,199 I2 13 0.34542,0.34542,0.34542,90,90,90 - - 4.51 X 43670
Na Na rt W,cI2,229 Im-3m 0.4283,0.4283,0.4283,90,90,90 b.c.c. family white silvery 0.97 X 2707
Na Na lt Sm,hR9,166 R-3m 0.37659,0.37659,2.7653,90,90,120 close-packed structure - 1.01 A 22751
Na Na hp1 Cu,cF4,225 Fm-3m 0.36627,0.36627,0.36627,90,90,90 close-packed structure - 3.11 X 40702
Na Na hp2 Na,cI16,220 I-43d 0.5461,0.5461,0.5461,90,90,90 - - 3.75 X 49295
Na Na hp3 *,oS120,* - 0.665,1.312,1.317,90,90,90 - - 3.99 N 51341
Na Na hp4 *,aP90,* - 0.7283,0.7366,1.6138,89.28,89.21,77.96 - - 4.06 N 51341
Na Na hp5 Na,oP8,62 Pnma 0.4765,0.302,0.5251,90,90,90 - - 4.04 X 51341
Na Na hp6 *,tI50,* - 0.7234,0.7234,0.9193,90,90,90 - - 3.97 N 51341
Na Na ht-hp *,mP512,* - 1.306,2.88,1.353,90,104.9,90 - - 3.97 N 51341
Nb Nb W,cI2,229 Im-3m 0.33004,0.33004,0.33004,90,90,90 b.c.c. family gray 8.58 X 5295
Nd Nd rt Nd,hP4,194 P63/mmc 0.36579,0.36579,1.17992,90,90,120 close-packed structure white silvery 7.01 X 745
Nd Nd ht W,cI2,229 Im-3m 0.413,0.413,0.413,90,90,90 b.c.c. family - 6.80 X 1444
Nd Nd hp1 Cu,cF4,225 Fm-3m 0.4917,0.4917,0.4917,90,90,90 close-packed structure - 8.06 X 11623
Nd Nd hp2? Tb,hP6,194 P63/mmc 0.3262,0.3262,1.576,90,90,120 close-packed structure - 9.90 A 19079
Nd Nd hp3 Sm,hP3,152 P3121 0.2851,0.2851,0.6806,90,90,120 close-packed structure - 15.00 A 44603
6 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Nd Nd hp4 Ce,mS4,12 C12/m1 0.4858,0.2712,0.5051,90,118.6,90 close-packed structure - 16.40 X 36004


Nd Nd hp5 U,oS4,63 Cmcm 0.2421,0.4788,0.434,90,90,90 close-packed structure - 19.04 X 37987
Ne Ne lt/hp Cu,cF4,225 Fm-3m 0.44636,0.44636,0.44636,90,90,90 close-packed structure - 1.51 X 2663
Ni Ni Cu,cF4,225 Fm-3m 0.35241,0.35241,0.35241,90,90,90 close-packed structure gray silvery 8.91 X 33133
Ni Ni stab Mg,hP2,194 P63/mmc 0.265,0.265,0.432,90,90,120 close-packed structure - 7.42 X 56181
Ni Ni m cub1 W,cI2,229 Im-3m 0.276,0.276,0.276,90,90,90 b.c.c. family - 9.27 X 1
Ni Ni m cub2 Cu,cF4,225 Fm-3m 0.4241,0.4241,0.4241,90,90,90 close-packed structure - 5.11 X 55104
Ni Ni m cub3 *,cF*,225 Fm-3m 0.7406,0.7406,0.7406,90,90,90 - - - N 55104
Ni Ni m tet1 *,tI*,139 I4/mmm 0.6809,0.6809,0.9713,90,90,90 - - - N 55104
Ni Ni m tet2 *,tP*,136 P42/mnm 0.4566,0.4566,0.2948,90,90,90 - - - N 55104
Ni Ni m orth *,oP*,59 Pmmn 0.3561,1.1485,0.4357,90,90,90 - - - N 55104
Np Np rt Np,oP8,62 Pnma 0.6663,0.4723,0.4887,90,90,90 b.c.c. family gray silvery 20.48 X 428
Np Np ht1 Np,tP4,129 P4/nmm 0.4897,0.4897,0.3388,90,90,90 b.c.c. family - 19.38 X 429
Np Np ht2 W,cI2,229 Im-3m 0.352,0.352,0.352,90,90,90 b.c.c. family - 18.05 X 429
O [O2] lt1 [F2],cP8,223 Pm-3n 0.683,0.683,0.683,90,90,90 - blue faint 1.33 X 2110
O [O2] lt2/hp1 [O2],hR6,166 R-3m 0.3289,0.3289,1.1281,90,90,120 - blue faint 1.51 X 17383
O [O2] lt3 [O2],mS4,12 C12/m1 0.5403,0.3433,0.4247,90,117.841,90 - blue light 1.53 X 17383
O [O2] hp2 [O2],oF8,69 Fmmm 0.29567,0.42151,0.66897,90,90,90 - orange 2.55 X 15933
O [O2] hp3 [O2],mS16,12 C12/m1 0.776,0.551,0.3656,90,116.5,90 - red dark 3.04 X 47226
O [O2] hp4 *,mS16,12 C12/m1 0.7253,0.4197,0.321,90,112.2,90 - - 4.70 N 52644
O [O2] ht-hp [O2],hP4,194 P63/mmc 0.2561,0.2561,0.6575,90,90,120 - - 2.85 X 52644
O [O2] tf *,m**,* - 0.3414,0.6668,0.9225,90,94.95,90 - - - N 14901
O [O3] [O3],oP24,61 Pbca 0.66973,0.68413,0.77888,90,90,90 - - 1.79 X 39363
Os Os Mg,hP2,194 P63/mmc 0.27348,0.27348,0.43193,90,90,120 close-packed structure gray bluish 22.58 X 58577
P P black P,oS8,64 Cmce 0.33133,1.0473,0.4374,90,90,90 - black 2.71 X 12467
P P white lt P,aP24,2 P-1 0.5503,1.0884,1.1024,94.68,99.83,100.55 - yellow pale 1.94 X 20597
P P white m P,mS16,12 C12/m1 0.91709,0.83385,0.54336,90,90.311,90 - - 1.98 X 45770
P P red mon P,mP84,13 P12/c1 0.921,0.915,2.260,90,106.1,90 - red 2.36 X 4368
P P red tric P,aP42,2 P-1 0.7075,1.16318,1.2198,71.067,73.69,84.17 - red 2.37 X 44174
P P hp1 As,hR6,166 R-3m 0.3377,0.3377,0.8806,90,90,120 - - 3.55 X 1997
P P hp2 Po,cP1,221 Pm-3m 0.2377,0.2377,0.2377,90,90,90 - - 3.83 X 1997
P P hp3 Sn,oS2,65 Cmmm 0.2766,0.3204,0.2064,90,90,90 - - 5.62 X 51272
P P hp4 (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.21164,0.21164,0.20203,90,90,120 - - 6.56 X 37980
P P hp5 Na,cI16,220 I-43d 0.4778,0.4778,0.4778,90,90,90 - - 7.54 X 59257
Pa Pa rt Pa,tI2,139 I4/mmm 0.3932,0.3932,0.3238,90,90,90 b.c.c. family - 15.33 X 1063
Pa Pa ht Cu,cF4,225 Fm-3m 0.5031,0.5031,0.5031,90,90,90 close-packed structure - 12.05 X 5986
Pb Pb Cu,cF4,225 Fm-3m 0.495,0.495,0.495,90,90,90 close-packed structure gray 11.35 X 317
Pb Pb hp1 Mg,hP2,194 P63/mmc 0.3007,0.3007,0.4906,90,90,120 close-packed structure - 17.91 X 23949
Pb Pb hp2 W,cI2,229 Im-3m 0.3124,0.3124,0.3124,90,90,90 b.c.c. family - 22.57 X 23949
Pd Pd Cu,cF4,225 Fm-3m 0.38911,0.38911,0.38911,90,90,90 close-packed structure white silvery 12.00 X 43617
Pd Pd hp *,m*4,* - 0.3884,0.3884,0.3898,90,90.18,90 - - 12.02 N 35946
Pd Pd1.7 (O) Pd1.7 ,hP5,164 P-3m1 0.2779,0.2779,0.6809,90,90,120 - - 6.60 X 13360
Pm Pm Nd,hP4,194 P63/mmc 0.365,0.365,1.165,90,90,120 close-packed structure - 7.17 X 6017
Po Po rt Po,cP1,221 Pm-3m 0.3359,0.3359,0.3359,90,90,90 - black 9.16 X 3161
Po Po ht Po,hR3,166 R-3m 0.5093,0.5093,0.4927,90,90,120 - black 9.41 X 3161
Pr Pr rt Nd,hP4,194 P63/mmc 0.36715,0.36715,1.18354,90,90,120 close-packed structure white gray 6.77 X 2056
Pr Pr ht W,cI2,229 Im-3m 0.413,0.413,0.413,90,90,90 b.c.c. family - 6.64 X 1444
Pr Pr hp1 Cu,cF4,225 Fm-3m 0.488,0.488,0.488,90,90,90 close-packed structure - 8.05 X 2355
Pr Pr hp2 Pr,hR24,166 R-3m 0.65429,0.65429,1.62403,90,90,120 close-packed structure - 9.33 X 53239
Pr Pr hp3 Pr,mS16,12 C12/m1 1.09391,0.62012,0.63817,90,125.623,90 - - 10.64 X 53239
Pr Pr hp4 U,oS4,63 Cmcm 0.27743,0.56165,0.48924,90,90,90 close-packed structure - 12.28 X 53239
Pr Pr hp5 Pr,oP4,19 P21212 1 0.2434,0.4433,0.4813,90,90,90 - - 18.02 X 42912
Pt Pt Cu,cF4,225 Fm-3m 0.39276,0.39276,0.39276,90,90,90 close-packed structure white gray 21.39 X 52524
Pu Pu rt Pu,mP16,11 P121/m1 0.6183,0.4822,1.0963,90,101.79,90 - white silvery 20.26 X 1834
Pu Pu ht1 Pu,mS34,12 C12/m1 1.18302,1.0449,0.7824,90,128.814,90 - - 18.28 A 1043
Pu Pu ht2 Pu,oF8,70 Fddd 0.31587,0.57682,1.0162,90,90,90 - - 17.51 X 661
Pu Pu ht3 Cu,cF4,225 Fm-3m 0.4639,0.4639,0.4639,90,90,90 close-packed structure - 16.23 X 2702
Pu Pu ht4 In,tI2,139 I4/mmm 0.3339,0.3339,0.4446,90,90,90 close-packed structure - 16.35 X 805
Pu Pu ht5 W,cI2,229 Im-3m 0.3639,0.3639,0.3639,90,90,90 b.c.c. family - 16.82 X 2277
Pu Pu hp Cs,oP4,62 Pnma 0.47,0.449,0.276,90,90,90 close-packed structure - 27.83 X 45526
Ra Ra W,cI2,229 Im-3m 0.5148,0.5148,0.5148,90,90,90 b.c.c. family white silvery 5.50 X 4224
Rb Rb W,cI2,229 Im-3m 0.5711,0.5711,0.5711,90,90,90 b.c.c. family white gray 1.52 X 255
Rb Rb hp1 Cu,cF4,225 Fm-3m 0.5417,0.5417,0.5417,90,90,90 close-packed structure - 3.57 X 15599
Rb Rb hp2 Rb,oS52,20 C222 1 0.7886,1.124,1.8431,90,90,90 - - 4.52 X 40714
Rb Rb hp3 *,tI16,140 I4/mcm 1.03503,1.03503,0.51865,90,90,90 host-guest structure - 4.38 P 39344
Rb Rb hp4 Cs,tI4,141 I41/amd 0.30277,0.30277,1.1328,90,90,90 - - 5.47 X 36483
Rb Rb hp5 Cs,oS16,64 Cmce 0.93718,0.55501,0.55278,90,90,90 - - 7.90 X 36502
Re Re Mg,hP2,194 P63/mmc 0.27612,0.27612,0.44012,90,90,120 close-packed structure gray 21.28 X 1787
Re Re m Mn,cP20,213 P4132 0.697,0.697,0.697,90,90,90 - - 18.26 A 24686
Rh Rh Cu,cF4,225 Fm-3m 0.38033,0.38033,0.38033,90,90,90 close-packed structure white silvery 12.42 X 33133
Ru Ru Mg,hP2,194 P63/mmc 0.27058,0.27058,0.42811,90,90,120 close-packed structure white silvery 12.37 X 1200
Ru Ru m Cu,cF4,225 Fm-3m 0.381,0.381,0.381,90,90,90 close-packed structure - 12.14 X 46803
S S 6-r S,hR18,148 R-3 1.0766,1.0766,0.4225,90,90,120 - - 2.26 X 12015
S S 6,10-r S,mS64,15 C12/c1 1.9232,0.9431,0.8831,90,101.21,90 - orange 2.17 X 16757
S S 7-r γ S,mP28,14 P121/c1 0.9680,0.7641,0.9409,90,102.08,90 - yellow 2.19 X 13871
S S 7-r δ S,mP56,14 P121/c1 1.5096,0.5998,2.09509,90,133.907,90 - - 2.18 X 13871
S S 8-r α rt S,oF128,70 Fddd 1.04633,1.28786,2.44784,90,90,90 - yellow 2.07 X 10709
S S 8-r β ht S,mP64,14 P121/c1 1.0926,1.0855,1.0790,90,95.92,90 - - 2.01 X 9825
Handbook of Inorganic Substances – Edition 2015 : Data 7

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

S S 8-r β m S,mP64,4 P1211 1.06883,1.07232,1.08125,90,95.746,90 - yellow 2.07 X 46118


S S 8-r β lt S,mP48,4 P1211 1.0663,1.0684,1.0799,90,95.71,90 - - 2.09 X 10708
S S 8-r γ S,mP32,13 P12/c1 0.8230,1.3052,0.9267,90,122.57,90 rosickyite colorless 2.03 X 26996
S S 9-r α S,mP72,14 P121/c1 0.7902,1.3908,1.6948,90,103.26,90 - yellow deep 2.11 X 31614
S S 10-r S,mS40,15 C12/c1 1.2533,1.0275,0.8239,90,107.39,90 - yellow 2.10 X 16757
S S 11-r S,oP88,29 Pca21 1.4933,0.8321,1.8086,90,90,90 - yellow 2.08 X 19799
S S 12-r S,oP24,58 Pnnm 0.4725,0.9104,1.4532,90,90,90 - yellow pale 2.04 X 14694
S S 13-r S,mP104,14 P121/c1 1.295,1.236,1.761,90,110.41,90 - yellow 2.10 X 19799
S S 14-r S,aP28,2 P-1 0.5469,0.9662,1.4331,95.97,98.96,100.43 - yellow 2.05 X 34125
S S 18-r α S,oP72,19 P212121 0.7581,1.1441,2.1152,90,90,90 - yellow lemon 2.09 X 8611
S S 18-r β S,mP36,14 P121/c1 1.075,0.725,1.597,90,130.0,90 - - 2.01 X 8153
S S 20-r S,oP80,60 Pbcn 1.8580,1.3181,0.8600,90,90,90 - yellow pale 2.02 X 8611
S S chain S,mP80,3 P121 1.38,0.925,1.76082,90,113.07,90 - - 2.06 X 4729
S S hp2 Se,tI16,141 I4 1/amd 0.7841,0.7841,0.31,90,90,90 - - 4.47 X 43775
S S hp3 S,mS2,12 C12/m1 0.28288,0.34698,0.22187,90,113.289,90 - - 5.32 X 45467
S S hp4 Te,hR3,166 R-3m 0.3277,0.3277,0.2584,90,90,120 - - 6.65 X 28004
S S ht-hp S,hP9,152 P3121 0.70897,0.70897,0.43024,90,90,120 - - 2.56 X 39581
S S hp? *,m*96,* - 0.983,1.033,2.065,90,100.66,90 - - 2.17 N 27994
Sb Sb As,hR6,166 R-3m 0.43084,0.43084,1.1274,90,90,120 - gray 6.69 X 1822
Sb Sb hp1 *,tI8,140 I4/mcm 0.80553,0.80553,0.38991,90,90,90 host-guest structure - 8.48 P 42183
Sb Sb hp2 W,cI2,229 Im-3m 0.3324,0.3324,0.3324,90,90,90 b.c.c. family - 11.01 X 16603
Sb Sb m cub1 Po,cP1,221 Pm-3m 0.316,0.316,0.316,90,90,90 - - 6.41 X 12777
Sb Sb m cub2 Cu,cF4,225 Fm-3m 0.461,0.461,0.461,90,90,90 close-packed structure - 8.25 X 12777
Sb Sb m tet In,tI2,139 I4/mmm 0.301,0.301,0.496,90,90,90 close-packed structure - 9.00 X 12777
Sb Sb m hex Mg,hP2,194 P63/mmc 0.333,0.333,0.523,90,90,120 close-packed structure - 8.05 X 12777
Sc Sc rt Mg,hP2,194 P63/mmc 0.33035,0.33035,0.52247,90,90,120 close-packed structure white silvery 3.02 X 45500
Sc Sc ht W,cI2,229 Im-3m 0.37559,0.37559,0.37559,90,90,90 b.c.c. family - 2.82 X 51109
Sc Sc hp1 *,tI8,140 I4/mcm 0.75672,0.75672,0.34398,90,90,90 host-guest structure - 4.00 P 47321
Sc Sc hp4 Sc,hP6,178 P6122 0.2355,0.2355,1.0446,90,90,120 - - 8.93 X 45500
Se Se Se,hP3,152 P3121 0.43662,0.43662,0.49536,90,90,120 - gray purple 4.81 X 3530
Se Se mon α Se-b,mP32,14 P121/c1 0.9054,0.9083,1.4615,90,127.47,90 - red deep 4.40 X 6458
Se Se mon β Se-a,mP32,14 P121/c1 0.931,0.807,1.285,90,93.13,90 - - 4.35 X 491
Se Se mon γ Se,mP64,14 P121/c1 1.5018,1.4713,0.8789,90,93.61,90 - red 4.33 X 13307
Se Se rhom S,hR18,148 R-3 1.1362,1.1362,0.4429,90,90,120 - - 4.77 X 13381
Se Se hp1 Se,tI16,141 I4 1/amd 0.9148,0.9148,0.3626,90,90,90 - - 6.91 X 43775
Se Se hp2 Te,aP3,2 P-1 0.26481,0.34648,0.62578,102.718,93.093,112.02 - - 7.66 X 43783
Se Se hp3 *,mS*,12 C12/m1 0.32527,0.40026,0.25735,90,113.341,90 - - - N 43765
Se Se hp4 Te,hR3,166 R-3m 0.38704,0.38704,0.29123,90,90,120 - - 10.41 X 26193
Se Se hp5 W,cI2,229 Im-3m 0.27941,0.27941,0.27941,90,90,90 b.c.c. family - 12.02 X 26193
Se Se hp1 mon Se,mS6,12 C12/m1 0.657,0.269,0.629,90,105.4,90 - - 7.34 X 30743
Se Se m Po,cP1,221 Pm-3m 0.2982,0.2982,0.2982,90,90,90 - - 4.94 X 11014
Se Se tf C,cF8,227 Fd-3m 0.604,0.604,0.604,90,90,90 - - 4.76 X 1317
Si Si C,cF8,227 Fd-3m 0.54309,0.54309,0.54309,90,90,90 - gray bluish 2.33 X 9060
Si Si hp1 Sn,tI4,141 I4 1/amd 0.469,0.469,0.2578,90,90,90 - - 3.29 X 19475
Si Si hp2 Si,oI4,74 Imma 0.4502,0.4737,0.255,90,90,90 - - 3.43 X 27972
Si Si hp3 (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.2551,0.2551,0.2387,90,90,120 - - 3.47 X 19475
Si Si hp4 (Sn0.6 Bi0.4),oS16,64 Cmce 0.80242,0.47961,0.4776,90,90,90 - - 4.06 X 36480
Si Si hp5 Mg,hP2,194 P63/mmc 0.24729,0.24729,0.4188,90,90,120 close-packed structure - 4.21 X 36480
Si Si hp6 Cu,cF4,225 Fm-3m 0.334,0.334,0.334,90,90,90 close-packed structure - 5.01 X 20598
Si Si m-hp1 Si,cI16,206 Ia-3 0.66265,0.66265,0.66265,90,90,90 - - 2.56 X 53492
Si Si m-hp2 Si,hR24,148 R-3 0.91932,0.91932,0.5441,90,90,120 - - 2.81 X 29356
Si Si stab C-b,hP4,194 P63/mmc 0.404,0.404,0.66,90,90,120 - - 2.00 X 10154
Sm Sm rt Sm,hR9,166 R-3m 0.3621,0.3621,2.625,90,90,120 close-packed structure white silvery 7.54 X 568
Sm Sm ht Mg,hP2,194 P63/mmc 0.3644,0.3644,0.5876,90,90,120 close-packed structure - 7.39 X 9377
Sm Sm hp1 Nd,hP4,194 P63/mmc 0.3565,0.3565,1.1456,90,90,120 close-packed structure - 7.92 X 11623
Sm Sm hp4 Sm,hP3,152 P3121 0.2806,0.2806,0.6648,90,90,120 close-packed structure - 16.53 X 29371
Sm Sm hp5 In,tI2,139 I4/mmm 0.2402,0.2402,0.4231,90,90,90 close-packed structure - 20.46 X 25307
Sn Sn lt C,cF8,227 Fd-3m 0.64892,0.64892,0.64892,90,90,90 - gray 5.77 X 634
Sn Sn rt Sn,tI4,141 I4 1/amd 0.58308,0.58308,0.3181,90,90,90 - white 7.29 X 14531
Sn Sn hp1 Pa,tI2,139 I4/mmm 0.3448,0.3448,0.3251,90,90,90 b.c.c. family - 10.20 X 18940
Sn Sn hp2 I,oI2,71 Immm 0.3239,0.3449,0.3463,90,90,90 - - 10.19 X 59716
Sn Sn hp3 W,cI2,229 Im-3m 0.311,0.311,0.311,90,90,90 b.c.c. family - 13.10 X 22736
Sn Sn hp4 Mg,hP2,194 P63/mmc 0.269,0.269,0.4375,90,90,120 close-packed structure - 14.38 X 57207
Sn Sn tf *,oP*,* - 0.578,0.598,0.602,90,90,90 - - - N 26938
Sn Sn (O) Sn,oS2,65 Cmmm 0.3181,0.58308,0.29154,90,90,90 - - 7.29 X 19078
Sr Sr rt Cu,cF4,225 Fm-3m 0.60849,0.60849,0.60849,90,90,90 close-packed structure gray white 2.58 X 479
Sr Sr ht/hp1 W,cI2,229 Im-3m 0.485,0.485,0.485,90,90,90 b.c.c. family - 2.55 X 479
Sr Sr hp2 Sn,tI4,141 I4 1/amd 0.5504,0.5504,0.296,90,90,90 - - 6.49 X 34908
Sr Sr hp3 Sr,mS12,9 C1c1 0.74784,0.78009,0.5537,90,130.308,90 - - 7.09 X 47324
Sr Sr hp4 *,tI8,140 I4/mcm 0.6958,0.6958,0.3959,90,90,90 host-guest structure - 8.20 P 37979
Sr Sr stab Mg,hP2,194 P63/mmc 0.432,0.432,0.706,90,90,120 close-packed structure - 2.55 X 479
Ta Ta W,cI2,229 Im-3m 0.33029,0.33029,0.33029,90,90,90 b.c.c. family gray bluish 16.68 X 388
Ta Ta m cub Cu,cF4,225 Fm-3m 0.404,0.404,0.404,90,90,90 close-packed structure - 18.23 X 46803
Ta Ta m tet Ta,tP30,113 P-421m 1.0211,1.0211,0.53064,90,90,90 - gray silvery 16.29 X 41274
Ta Ta lt-m Ta,tP30,81 P-4 1.01815,1.01815,0.5295,90,90,90 - gray silvery 16.42 X 41274
Ta Ta tf Ta,hP24,176 P63/m 0.2831,0.2831,0.5337,90,90,120 - - 16.22 X 7431
Tb Tb rt Mg,hP2,194 P63/mmc 0.36055,0.36055,0.56966,90,90,120 close-packed structure white silvery 8.23 X 7476
Tb Tb ht W,cI2,229 Im-3m 0.402,0.402,0.402,90,90,90 b.c.c. family - 8.12 X 2388
8 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Tb Tb hp1 Sm,hR9,166 R-3m 0.35842,0.35842,2.57523,90,90,120 close-packed structure - 8.29 A 4689


Tb Tb hp2 Nd,hP4,194 P63/mmc 0.326,0.326,1.043,90,90,120 close-packed structure - 11.00 X 18440
Tb Tb hp3 Pr,hR24,166 R-3m 0.6006,0.6006,1.43,90,90,120 close-packed structure - 14.18 X 49380
Tb Tb hp4 Ce,mS4,12 C12/m1 0.4519,0.2669,0.4296,90,105.4,90 close-packed structure - 21.13 X 49380
Tb Tb hp? Cu,cF4,225 Fm-3m 0.4236,0.4236,0.4236,90,90,90 close-packed structure - 13.89 X 18440
Tb Tb tf Cu,cF4,225 Fm-3m 0.52,0.52,0.52,90,90,90 close-packed structure - 7.51 X 7544
Tc Tc Mg,hP2,194 P63/mmc 0.27407,0.27407,0.4398,90,90,120 close-packed structure gray 11.38 X 6955
Tc Tc stab Cu,cF4,225 Fm-3m 0.3956,0.3956,0.3956,90,90,90 close-packed structure - 10.51 X 11842
Te Te Se,hP3,152 P3121 0.4456,0.4456,0.5921,90,90,120 - gray 6.24 X 22113
Te Te hp1 Te,aP3,2 P-1 0.30977,0.40682,0.73577,74.743,86.42,67.844 - - 7.68 X 43783
Te Te hp2 *,mS*,12 C12/m1 0.38912,0.47333,0.30612,90,112.614,90 - - - N 42209
Te Te hp3 W,cI2,229 Im-3m 0.3468,0.3468,0.3468,90,90,90 b.c.c. family - 10.16 X 21697
Te Te ht-hp? Te,hR3,166 R-3m 0.46873,0.46873,0.35474,90,90,120 - - 9.42 X 47366
Te Te tf C,cF8,227 Fd-3m 0.56408,0.56408,0.56408,90,90,90 - - 9.44 X 7727
Te Te hp? As,hR6,166 R-3m 0.4208,0.4208,1.2036,90,90,120 - - 6.89 X 2378
Th Th rt Cu,cF4,225 Fm-3m 0.50843,0.50843,0.50843,90,90,90 close-packed structure gray black 11.73 X 739
Th Th ht W,cI2,229 Im-3m 0.4056,0.4056,0.4056,90,90,90 b.c.c. family - 11.55 X 1143
Th Th hp In,tI2,139 I4/mmm 0.2525,0.2525,0.4178,90,90,90 close-packed structure - 28.93 X 25294
Ti Ti rt Mg,hP2,194 P63/mmc 0.29486,0.29486,0.467,90,90,120 close-packed structure white gray 4.52 X 14523
Ti Ti ht W,cI2,229 Im-3m 0.33149,0.33149,0.33149,90,90,90 b.c.c. family - 4.37 X 1134
Ti Ti hp1 Ti,hP3,191 P6/mmm 0.4625,0.4625,0.2813,90,90,120 - - 4.58 X 1999
Ti Ti hp2 U,oS4,63 Cmcm 0.2382,0.4461,0.3876,90,90,90 close-packed structure - 7.73 X 40295
Ti Ti hp3 Ti,oS4,63 Cmcm 0.3861,0.26296,0.36323,90,90,90 - - 8.63 X 40295
Tl Tl rt Mg,hP2,194 P63/mmc 0.3463,0.3463,0.5539,90,90,120 close-packed structure white silvery 11.80 X 28725
Tl Tl ht W,cI2,229 Im-3m 0.3871,0.3871,0.3871,90,90,90 b.c.c. family - 11.70 X 1760
Tl Tl hp Cu,cF4,225 Fm-3m 0.431,0.431,0.431,90,90,90 close-packed structure - 16.96 X 28725
Tl Tl tet? In,tI2,139 I4/mmm 0.33588,0.33588,0.54,90,90,90 close-packed structure - 11.14 X 5
Tm Tm Mg,hP2,194 P63/mmc 0.35426,0.35426,0.55708,90,90,120 close-packed structure gray silvery 9.27 X 4692
Tm Tm hp1 Sm,hR9,166 R-3m 0.3247,0.3247,2.267,90,90,120 close-packed structure - 12.20 X 56608
Tm Tm hp2 Nd,hP4,194 P63/mmc 0.3023,0.3023,0.9776,90,90,120 close-packed structure - 14.50 X 56608
Tm Tm hp4 Pr,hR24,166 R-3m 0.5349,0.5349,1.3105,90,90,120 close-packed structure - 20.73 X 56608
Tm Tm hp5 Ce,mS4,12 C12/m1 0.4325,0.2555,0.4314,90,104.4,90 close-packed structure - 24.30 X 56608
Tm Tm tf Cu,cF4,225 Fm-3m 0.506,0.506,0.506,90,90,90 close-packed structure - 8.66 X 7544
Tm Tm stab W,cI2,229 Im-3m 0.392,0.392,0.392,90,90,90 b.c.c. family - 9.31 X 2388
U U rt U,oS4,63 Cmcm 0.28536,0.58698,0.49555,90,90,90 close-packed structure gray silvery 19.05 A 1605
U U ht1 U,tP30,136 P42/mnm 1.07589,1.07589,0.56531,90,90,90 Frank-Kasper phase - 18.12 X 21081
U U ht2 W,cI2,229 Im-3m 0.35321,0.35321,0.35321,90,90,90 b.c.c. family - 17.94 X 1147
U U stab Cu,cF4,225 Fm-3m 0.489,0.489,0.489,90,90,90 close-packed structure - 13.52 X 7286
V V W,cI2,229 Im-3m 0.303,0.303,0.303,90,90,90 b.c.c. family gray bluish 6.08 X 49293
V V hp Te,hR3,166 R-3m 0.39098,0.39098,0.23704,90,90,120 - - 8.09 X 49384
W W W,cI2,229 Im-3m 0.31652,0.31652,0.31652,90,90,90 b.c.c. family white gray 19.26 X 29331
Xe Xe lt/hp1 Cu,cF4,225 Fm-3m 0.615,0.615,0.615,90,90,90 close-packed structure - 3.75 X 6948
Xe Xe hp hex Mg,hP2,194 P63/mmc 0.34,0.34,0.55,90,90,120 close-packed structure - 7.92 X 40703
Y Y rt Mg,hP2,194 P63/mmc 0.36474,0.36474,0.57306,90,90,120 close-packed structure white silvery 4.47 X 745
Y Y hp4 Ce,mS4,12 C12/m1 0.47063,0.28333,0.42497,90,104.08,90 close-packed structure - 10.74 X 58635
Y Y tf Cu,cF4,225 Fm-3m 0.583,0.583,0.583,90,90,90 close-packed structure - 2.98 X 9900
Yb Yb rt Cu,cF4,225 Fm-3m 0.54847,0.54847,0.54847,90,90,90 close-packed structure white silvery 6.97 X 6223
Yb Yb ht/hp1 W,cI2,229 Im-3m 0.444,0.444,0.444,90,90,90 b.c.c. family - 6.57 X 1444
Yb Yb lt/hp2 Mg,hP2,194 P63/mmc 0.38799,0.38799,0.63859,90,90,120 close-packed structure - 6.90 X 6223
Zn Zn Mg,hP2,194 P63/mmc 0.26657,0.26657,0.49472,90,90,120 close-packed structure gray silvery 7.13 X 23678
Zr Zr rt Mg,hP2,194 P63/mmc 0.32333,0.32333,0.51523,90,90,120 close-packed structure white silvery 6.49 X 6203
Zr Zr ht/hp2 W,cI2,229 Im-3m 0.3614,0.3614,0.3614,90,90,90 b.c.c. family - 6.42 X 26219
Zr Zr hp1 Ti,hP3,191 P6/mmm 0.5035,0.5035,0.3141,90,90,120 - - 6.59 X 14222
Handbook of Inorganic Substances – Edition 2015 : Data 9

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ac-Br AcBr3 UCl3,hP8,176 P63/m 0.808,0.808,0.469,90,90,120 - - 5.85 A 287


Ac-Cl AcCl3 UCl3,hP8,176 P63/m 0.764,0.764,0.456,90,90,120 - - 4.80 A 4144
Ac-F AcF3 HoH3,hP24,165 P-3c1 0.741,0.741,0.755,90,90,120 - - 7.88 A 309
Ac-H AcH2 CaF2 ,cF12,225 Fm-3m 0.567,0.567,0.567,90,90,90 fluorite family - 8.35 X 1459
Ac-O Ac2O3 La2O3,hP5,164 P-3m1 0.408,0.408,0.63,90,90,120 - - 9.18 X 309
Ac-S Ac2.67 S4 Th3P 4,cI28,220 I-43d 0.899,0.899,0.899,90,90,90 - - 6.71 A 310
Ag-Al Ag0.3 Al0.7 Cu,cF4,225 Fm-3m 0.40524,0.40524,0.40524,90,90,90 close-packed structure - 5.12 X 4010
Ag-Al Ag0.66 Al0.34 Mg,hP2,194 P63/mmc 0.2884,0.2884,0.46,90,90,120 close-packed structure - 8.06 X 13520
Ag-Al Ag0.75 Al0.25 ht W,cI2,229 Im-3m 0.324,0.324,0.324,90,90,90 b.c.c. family - 8.56 X 114
Ag-Al Ag0.75 Al0.25 rt Mn,cP20,213 P4132 0.6942,0.6942,0.6942,90,90,90 - - 8.70 A 6345
Ag-Al Ag0.79 Al0.21 Cu,cF4,225 Fm-3m 0.4065,0.4065,0.4065,90,90,90 close-packed structure - 8.99 X 26065
Ag-As Ag0.875 As0.125 ht Mg,hP2,194 P63/mmc 0.29025,0.29025,0.47339,90,90,120 close-packed structure - 9.98 X 1497
Ag-As Ag0.93 As0.07 Cu,cF4,225 Fm-3m 0.40968,0.40968,0.40968,90,90,90 close-packed structure - 10.20 X 1162
Ag-Au Ag0.5 Au0.5 rt Cu,cF4,225 Fm-3m 0.40752,0.40752,0.40752,90,90,90 close-packed structure - 14.96 X 5997
Ag-B AgB2 AlB2 ,hP3,191 P6/mmm 0.3,0.3,0.324,90,90,120 AlB2 family - 8.51 X 1491
Ag-Ba BaAg FeB-b,oP8,62 Pnma 0.8657,0.4982,0.6651,90,90,90 CrB(TlI)-FeB - 5.68 X 14027
Ag-Ba BaAg2 KHg2,oI12,74 Imma 0.4958,0.8063,0.8453,90,90,90 AlB2 family - 6.94 X 2861
Ag-Ba BaAg5 CaCu5,hP6,191 P6/mmm 0.5803,0.5803,0.4612,90,90,120 - - 8.35 X 20166
Ag-Ba Ba0.77 Ag5.46 Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.56797,0.56797,0.47021,90,90,120 CaCu5-Zr4Al3 - 8.78 A 58987
Ag-Ba Ba3Ag2 Er3Ni2,hR45,148 R-3 1.0385,1.0385,1.9332,90,90,120 - - 5.20 A 20166
Ag-Be Be12 Ag ThMn12,tI26,139 I4/mmm 0.7284,0.7284,0.4246,90,90,90 CaCu5-Zr4Al3 - 3.18 A 928
Ag-Be Be2Ag ht MgCu2,cF24,227 Fd-3m 0.6287,0.6287,0.6287,90,90,90 Friauf-Laves phase - 6.73 X 113
Ag-Bi Ag0.5 Bi0.5 m Mg,hP2,194 P63/mmc 0.2998,0.2998,0.4849,90,90,120 close-packed structure - 13.94 X 10266
Ag-Bi Ag0.98 Bi0.02 Cu,cF4,225 Fm-3m 0.4112,0.4112,0.4112,90,90,90 close-packed structure - 10.50 X 26065
Ag-Br AgBr hp K[NH2],mP4,11 P121/m1 0.3821,0.398,0.5513,90,95.9,90 - - 7.48 X 36466
Ag-Br AgBr rt NaCl,cF8,225 Fm-3m 0.5775,0.5775,0.5775,90,90,90 bromargyrite - 6.48 X 20468
Ag-Ca CaAg TlI,oS8,63 Cmcm 0.40522,1.1447,0.46443,90,90,90 CrB(TlI)-FeB gray silver 4.56 X 53580
Ag-Ca CaAg2 KHg2,oI12,74 Imma 0.4689,0.7301,0.8139,90,90,90 AlB2 family - 6.10 X 49663
Ag-Ca Ca2Ag7 rt Ag7 Yb2,oS36,63 Cmcm 0.94784,0.55251,1.4079,90,90,90 - - 7.52 X 30223
Ag-Ca Ca3Ag8 (N) Ca3Ag8,cI44,229 Im-3m 0.981,0.981,0.981,90,90,90 - - 6.92 X 2070
Ag-Ca Ca5Ag3 Cr5B3,tI32,140 I4/mcm 0.8039,0.8039,1.5011,90,90,90 - white silver3.59 X 1650
Ag-Cd Ag0.05 Cd0.95 Mg,hP2,194 P63/mmc 0.299,0.299,0.5475,90,90,120 close-packed structure - 8.79 X 1458
Ag-Cd Ag0.25 Cd0.75 Mg,hP2,194 P63/mmc 0.3072,0.3072,0.48163,90,90,120 close-packed structure - 9.39 X 1458
Ag-Cd Ag0.48 Cd0.52 ht1 Mg,hP2,194 P63/mmc 0.3017,0.3017,0.4863,90,90,120 close-packed structure - 9.55 X 8507
Ag-Cd Ag0.48 Cd0.52 ht2 W,cI2,229 Im-3m 0.3392,0.3392,0.3392,90,90,90 b.c.c. family - 9.38 X 8507
Ag-Cd Ag0.875 Cd0.125 Cu,cF4,225 Fm-3m 0.4117,0.4117,0.4117,90,90,90 close-packed structure - 10.32 X 8249
Ag-Cd Ag0.96 Cd1.04 rt CsCl,cP2,221 Pm-3m 0.3347,0.3347,0.3347,90,90,90 b.c.c. family - 9.76 X 8507
Ag-Cd Ag1.02 Cd0.98 mart1 *,t**,* - 0.48,0.48,0.32,90,90,90 - - - N 7639
Ag-Cd Ag1.02 Cd0.98 mart2 *,o**,* - 0.24,0.3,0.53,90,90,90 - - - N 7639
Ag-Cd Ag5Cd8 Cu5Zn8,cI52,217 I-43m 1.0035,1.0035,1.0035,90,90,90 γ-brass - 9.46 A 11854
Ag-Ce AgCe lt CuTi,tP2,123 P4/mmm 0.3739,0.3739,0.3811,90,90,90 b.c.c. family - 7.73 X 30737
Ag-Ce AgCe rt CsCl,cP2,221 Pm-3m 0.3785,0.3785,0.3785,90,90,90 b.c.c. family - 7.59 X 17286
Ag-Ce Ag0.98 Ce0.02 Cu,cF4,225 Fm-3m 0.40868,0.40868,0.40868,90,90,90 close-packed structure - 10.56 X 15974
Ag-Ce Ag2Ce rt KHg2,oI12,74 Imma 0.4702,0.7331,0.8193,90,90,90 AlB2 family - 8.37 A 42303
Ag-Ce Ag51 Ce14 rt Ag51 Gd14,hP68,175 P6/m 1.2891,1.2891,0.95054,90,90,120 - - 9.06 A 38851
Ag-Cl AgCl hp1 K[NH2],mP4,11 P121/m1 0.3587,0.3992,0.5307,90,98.4,90 - - 6.33 X 36466
Ag-Cl AgCl hp2 TlI,oS8,63 Cmcm 0.3399,1.0124,0.4032,90,90,90 CrB(TlI)-FeB - 6.86 X 36466
Ag-Cl AgCl NaCl,cF8,225 Fm-3m 0.5461,0.5461,0.5461,90,90,90 rocksalt family - 5.85 X 36466
Ag-Cu Ag0.01 Cu0.99 Cu,cF4,225 Fm-3m 0.362,0.362,0.362,90,90,90 close-packed structure - 8.96 X 27383
Ag-Cu Ag0.5 Cu0.5 m Cu,cF4,225 Fm-3m 0.38765,0.38765,0.38765,90,90,90 close-packed structure - 9.77 X 3132
Ag-Cu Ag0.97 Cu0.03 m Cu,cF4,225 Fm-3m 0.40877,0.40877,0.40877,90,90,90 close-packed structure - 10.36 X 27383
Ag-Dy AgDy CsCl,cP2,221 Pm-3m 0.3623,0.3623,0.3623,90,90,90 b.c.c. family - 9.44 X 23667
Ag-Dy Ag0.945 Dy0.055 Cu,cF4,225 Fm-3m 0.4091,0.4091,0.4091,90,90,90 close-packed structure - 10.76 X 24559
Ag-Dy Ag2Dy MoSi2,tI6,139 I4/mmm 0.3697,0.3697,0.9213,90,90,90 b.c.c. family gray silver 9.98 X 4731
Ag-Dy Ag51 Dy14 Ag51 Gd14,hP68,175 P6/m 1.2655,1.2655,0.9275,90,90,120 - - 10.04 A 27403
Ag-Er AgEr CsCl,cP2,221 Pm-3m 0.3578,0.3578,0.3578,90,90,90 b.c.c. family - 9.97 X 24887
Ag-Er Ag0.935 Er0.065 Cu,cF4,225 Fm-3m 0.40994,0.40994,0.40994,90,90,90 close-packed structure - 10.77 X 24559
Ag-Er Ag2Er MoSi2,tI6,139 I4/mmm 0.3668,0.3668,0.9159,90,90,90 b.c.c. family - 10.32 X 6761
Ag-Er Ag51 Er14 Ag51 Gd14,hP68,175 P6/m 1.2596,1.2596,0.9236,90,90,120 - - 10.26 A 4973
Ag-Eu AgEu FeB-b,oP8,62 Pnma 0.8037,0.4764,0.6259,90,90,90 CrB(TlI)-FeB - 7.20 X 13350
Ag-Eu Ag0.9975 Eu0.0025 Cu,cF4,225 Fm-3m 0.4089,0.4089,0.4089,90,90,90 close-packed structure - 10.49 X 24559
Ag-Eu Ag2Eu rt KHg2,oI12,74 Imma 0.4753,0.7488,0.8164,90,90,90 AlB2 family - 8.41 X 2861
Ag-Eu Ag2Eu3 U3Si2,tP10,127 P4/mbm 0.8461,0.8461,0.4515,90,90,90 - - 6.90 X 13350
Ag-Eu Ag5Eu CaCu5,hP6,191 P6/mmm 0.5629,0.5629,0.4638,90,90,120 - - 9.02 X 12481
Ag-F AgF hp1 NiAs,hP4,194 P63/mmc 0.32434,0.32434,0.62386,90,90,120 AlB2 family - 7.41 X 34676
Ag-F AgF hp2 CsCl,cP2,221 Pm-3m 0.2945,0.2945,0.2945,90,90,90 b.c.c. family - 8.25 X 6805
Ag-F AgF NaCl,cF8,225 Fm-3m 0.4932,0.4932,0.4932,90,90,90 rocksalt family yellow 7.02 X 6805
Ag-F AgF2 hp CuF2,mP6,14 P121/c1 0.335,0.458,0.54723,90,122.043,90 - brownish 6.81 X 3174
Ag-F AgF2 AgF2,oP12,61 Pbca 0.5101,0.5568,0.5831,90,90,90 - blue black 5.85 X 24207
Ag-F AgF3 AuF3,hP24,178 P6122 0.50782,0.50782,1.54523,90,90,120 - red 4.76 X 24741
Ag-F Ag2F CdI2 ,hP3,164 P-3m1 0.29988,0.29988,0.5695,90,90,120 CdI2-PbI2 polytype greenish 8.79 X 22455
Ag-F Ag2F5 Ag2F5,aP28,2 P-1 0.4999,0.7357,1.1087,90.05,90.18,106.54 - brown dark 5.28 X 40925
Ag-F Ag3F8 Au3F8,mP22,14 P121/c1 0.50466,1.10542,0.78756,90,136.647,90 - - 5.24 X 37175
Ag-Fe Ag0.22 Fe0.78 tf W,cI2,229 Im-3m 0.294,0.294,0.294,90,90,90 b.c.c. family - 8.79 X 21277
Ag-Fe Ag0.5 Fe0.5 tf Cu,cF4,225 Fm-3m 0.403,0.403,0.403,90,90,90 close-packed structure - 8.31 X 21277
Ag-Ga AgGa CsCl,cP2,221 Pm-3m 0.3171,0.3171,0.3171,90,90,90 b.c.c. family - 9.25 X 24868
Ag-Ga Ag0.75 Ga0.25 ht Mg,hP2,194 P63/mmc 0.28818,0.28818,0.46956,90,90,120 close-packed structure - 9.67 X 44912
Ag-Ga Ag0.92 Ga0.08 Cu,cF4,225 Fm-3m 0.40753,0.40753,0.40753,90,90,90 close-packed structure - 10.29 X 44912
10 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Ga Ag2Ga rt Mg2In,hP9,189 P-62m 0.7768,0.7768,0.28759,90,90,120 Fe2P family - 9.46 X 35259


Ag-Ga Ag3Ga2 *,oP*,* - 0.322,0.3884,0.67276,90,90,90 - - - N 48565
Ag-Gd AgGd CsCl,cP2,221 Pm-3m 0.366,0.366,0.366,90,90,90 b.c.c. family - 8.98 X 15311
Ag-Gd Ag0.945 Gd0.055 Cu,cF4,225 Fm-3m 0.4096,0.4096,0.4096,90,90,90 close-packed structure - 10.69 X 24559
Ag-Gd Ag2Gd rt MoSi2,tI6,139 I4/mmm 0.3743,0.3743,0.9352,90,90,90 b.c.c. family - 9.45 X 24947
Ag-Gd Ag51Gd14 Ag51Gd14,hP68,175 P6/m 1.2670,1.2670,0.9332,90,90,120 - - 9.86 X 5707
Ag-Ge Ag0.74 Ge0.26 hp-ht Mg,hP2,194 P63 /mmc 0.286,0.286,0.4666,90,90,120 close-packed structure - 9.92 X 24858
Ag-Ge Ag0.8 Ge0.2 m *,t**,* - 0.8116,0.8116,2.052,90,90,90 - - - N 6808
Ag-Ge Ag0.84 Ge0.16 Cu,cF4,225 Fm-3m 0.409,0.409,0.409,90,90,90 close-packed structure - 9.92 X 26065
Ag-Hf AgHf CuTi,tP4,129 P4/nmm 0.3427,0.3427,0.6362,90,90,90 b.c.c. family - 12.73 A 55916
Ag-Hf AgHf2 CuZr2,tI6,139 I4/mmm 0.3195,0.3195,1.1828,90,90,90 close-packed structure - 12.79 A 55916
Ag-Hg AgHg *,hP24,180 P6222 0.8147,0.8147,0.8855,90,90,120 - gray silver - N 9064
Ag-Hg Ag0.565 Hg0.435 Mg,hP2,194 P63 /mmc 0.29853,0.29853,0.48413,90,90,120 schachnerite - 13.17 X 1497
Ag-Hg Ag0.6 Hg0.4 (Cu0.75 Ti0.25),oS4,63 Cmcm 0.296,0.513,0.483,90,90,90 paraschachnerite - 13.13 A 6926
Ag-Hg Ag0.733 Hg0.267 Cu,cF4,225 Fm-3m 0.41585,0.41585,0.41585,90,90,90 close-packed structure - 12.25 X 986
Ag-Hg Ag5Hg7.55 Ag5Hg7.55 ,cI52,197 I23 1.00506,1.00506,1.00506,90,90,90 moschellandsbergite - 13.44 X 6475
Ag-Ho AgHo CsCl,cP2,221 Pm-3m 0.3601,0.3601,0.3601,90,90,90 b.c.c. family - 9.70 X 23667
Ag-Ho Ag2Ho MoSi2,tI6,139 I4/mmm 0.3682,0.3682,0.9181,90,90,90 b.c.c. family - 10.16 X 4732
Ag-Ho Ag51Ho14 Ag51Gd14,hP68,175 P6/m 1.2609,1.2609,0.9257,90,90,120 - - 10.18 A 4973
Ag-Ho Ag7Ho2 *,oP*,* - 0.7044,0.7855,0.7964,90,90,90 - - - N 3140
Ag-I AgI 12H AgI,hP24,186 P63 mc 0.4592,0.4592,4.506,90,90,120 - - 5.69 X 7872
Ag-I AgI 12T AgI,hP24,156 P3m1 0.459,0.459,4.508,90,90,120 - - 5.69 X 10317
Ag-I AgI 16T AgI,hP32,156 P3m1 0.4592,0.4592,6.008,90,90,120 - - 5.69 X 7872
Ag-I AgI 6H SiC,hP12,186 P63 mc 0.45,0.45,2.24,90,90,120 adamantane structure - 5.95 X 2798
Ag-I AgI 8T AgI,hP16,156 P3m1 0.4592,0.4592,3.004,90,90,120 - - 5.69 X 7872
Ag-I AgI hp1 NaCl,cF8,225 Fm-3m 0.60339,0.60339,0.60339,90,90,90 rocksalt family brown red 7.10 X 36466
Ag-I AgI hp2 AgI,tP4,115 P-4m2 0.458,0.458,0.6,90,90,90 - - 6.20 X 4111
Ag-I AgI hp3 K[NH2],mP4,11 P121/m1 0.4056,0.4057,0.5615,90,98.43,90 - - 8.53 X 36466
Ag-I AgI ht m SiC,hP8,186 P63 mc 0.45979,0.45979,1.5029,90,90,120 adamantane structure - 5.67 X 8741
Ag-I AgI ht AgI,cI38,229 Im-3m 0.5062,0.5062,0.5062,90,90,90 - brown dark 6.01 X 12044
Ag-I AgI m ZnS,cF8,216 F-43m 0.6496,0.6496,0.6496,90,90,90 adamantane structure green 5.69 X 43834
Ag-I AgI rt ZnO,hP4,186 P63 mc 0.45937,0.45937,0.75152,90,90,120 iodargyrite green 5.68 X 20461
Ag-In AgIn2 CuAl2,tI12,140 I4/mcm 0.6881,0.6881,0.562,90,90,90 - - 8.42 X 6743
Ag-In Ag0.75 In0.25 ht1 Mg,hP2,194 P63 /mmc 0.29563,0.29563,0.47857,90,90,120 close-packed structure - 10.05 X 1497
Ag-In Ag0.75 In0.25 ht2 W,cI2,229 Im-3m 0.33682,0.33682,0.33682,90,90,90 b.c.c. family - 9.53 X 1392
Ag-In Ag0.8 In0.2 Cu,cF4,225 Fm-3m 0.415,0.415,0.415,90,90,90 close-packed structure - 10.15 X 26065
Ag-In Ag3In rt Cu3Au,cP4,221 Pm-3m 0.4144,0.4144,0.4144,90,90,90 close-packed structure - 10.23 X 5187
Ag-In Ag9In4 rt Cu9Al4,cP52,215 P-43m 0.9922,0.9922,0.9922,90,90,90 γ-brass - 9.73 X 10484
Ag-K KAg2 hp MgZn2,hP12,194 P63 /mmc 0.55891,0.55891,0.94761,90,90,120 Friauf-Laves phase golden 6.60 X 33429
Ag-K K2Ag hp Hg2U,hP3,191 P6/mmm 0.55434,0.55434,0.377,90,90,120 AlB2 family - 3.08 X 31683
Ag-K K3Ag hp BiF3,cF16,225 Fm-3m 0.7837,0.7837,0.7837,90,90,90 b.c.c. family gray silver 3.11 X 31683
Ag-La AgLa hp1 CuTi,tP2,123 P4/mmm 0.3658,0.3658,0.384,90,90,90 b.c.c. family - 7.98 X 11124
Ag-La AgLa hp2 AuCd,oP4,51 Pmma 0.475,0.3,0.54,90,90,90 close-packed structure - 10.65 A 33099
Ag-La AgLa rt CsCl,cP2,221 Pm-3m 0.37924,0.37924,0.37924,90,90,90 b.c.c. family - 7.51 X 50694
Ag-La Ag0.99 La0.01 Cu,cF4,225 Fm-3m 0.40864,0.40864,0.40864,90,90,90 close-packed structure - 10.53 X 15974
Ag-La Ag2La rt KHg2,oI12,74 Imma 0.4825,0.7287,0.8196,90,90,90 AlB2 family - 8.17 A 4094
Ag-La Ag2.5 La0.5 rt MgZn2,hP12,194 P63 /mmc 0.557,0.557,0.9079,90,90,120 Friauf-Laves phase - 9.23 A 56225
Ag-La Ag51La14 Ag51Gd14,hP68,175 P6/m 1.2955,1.2955,0.9525,90,90,120 - - 8.93 A 4973
Ag-Li LiAg tet UPb,tI8,141 I41/amd 0.39658,0.39658,0.82803,90,90,90 close-packed structure - 5.86 X 55380
Ag-Li Li0.35 Ag0.65 rt Cu,cF4,225 Fm-3m 0.4042,0.4042,0.4042,90,90,90 close-packed structure - 7.30 X 1915
Ag-Li Li0.98 Ag0.02 rt W,cI2,229 Im-3m 0.34913,0.34913,0.34913,90,90,90 b.c.c. family - 0.70 X 4488
Ag-Li Li1.18 Ag0.82 cub CsCl,cP2,221 Pm-3m 0.31818,0.31818,0.31818,90,90,90 b.c.c. family - 4.98 X 51435
Ag-Li Li8.89 Ag5 rt Cu5Zn8,cI52,217 I-43m 0.96066,0.96066,0.96066,90,90,90 γ-brass - 4.50 X 51435
Ag-Lu Ag0.955 Lu0.045 Cu,cF4,225 Fm-3m 0.4108,0.4108,0.4108,90,90,90 close-packed structure - 10.62 X 5488
Ag-Lu Ag2Lu MoSi2,tI6,139 I4/mmm 0.3628,0.3628,0.9113,90,90,90 b.c.c. family - 10.82 A 3340
Ag-Lu Ag4Lu MoNi4,tI10,87 I4/m 0.66696,0.66696,0.41581,90,90,90 close-packed structure - 10.89 A 4973
Ag-Mg MgAg CsCl,cP2,221 Pm-3m 0.33102,0.33102,0.33102,90,90,90 b.c.c. family - 6.05 X 3577
Ag-Mg MgAg3 rt Cu3Au,cP4,221 Pm-3m 0.41111,0.41111,0.41111,90,90,90 close-packed structure - 8.32 X 1114
Ag-Mg Mg0.25 Ag0.75 ht Cu,cF4,225 Fm-3m 0.41526,0.41526,0.41526,90,90,90 close-packed structure - 8.07 X 4679
Ag-Mg Mg0.98 Ag0.02 Mg,hP2,194 P63 /mmc 0.3197,0.3197,0.5184,90,90,120 close-packed structure - 1.88 X 56232
Ag-Mg Mg1.04 Ag2.96 rt ZrAl3,tI16,139 I4/mmm 0.41088,0.41088,1.6444,90,90,90 close-packed structure - 8.25 A 4679
Ag-Mg Mg1.12 Ag2.88 SrPb3,tP4,123 P4/mmm 0.4106,0.4106,0.413,90,90,90 close-packed structure - 8.06 X 723
Ag-Mg Mg25.04 Ag7.96 rt Mg19(Mg0.9 Ag0.1 )7Ag7,cF264,202 Fm-3 1.7612,1.7612,1.7612,90,90,90 - - 3.57 X 39508
Ag-Mg Mg37Ag9 Mg37Ag9,hP116,176 P63 /m 1.24852,1.24852,1.44117,90,90,120 - gray silver 3.19 X 45756
Ag-Mg Mg54Ag17 ht Hf54Os17,oI142,71 Immm 1.4209,1.424,1.4663,90,90,90 - - 3.52 X 21847
Ag-Mn Ag0.03 Mn0.97 ht3 Cu,cF4,225 Fm-3m 0.3718,0.3718,0.3718,90,90,90 close-packed structure - 7.31 X 262
Ag-Mn Ag0.84 Mn0.16 Cu,cF4,225 Fm-3m 0.40854,0.40854,0.40854,90,90,90 close-packed structure - 9.68 X 4615
Ag-N Ag[N3] hp K[N3],tI16,140 I4/mcm 0.552,0.552,0.557,90,90,90 - white 5.87 X 56574
Ag-N Ag[N3] ht Ag[N3],mP16,14 P121/c1 0.60756,0.61663,0.65729,90,114.19,90 - - 4.43 X 48487
Ag-N Ag[N3] orth Ag[N3],oI16,72 Ibam 0.558,0.593,0.604,90,90,90 - white 4.98 X 88
Ag-N Ag[N3] tet *,tP*,76 P41 1.3614,1.3614,0.9452,90,90,90 - - - N 27356
Ag-Na NaAg2 rt MgCu2,cF24,227 Fd-3m 0.7923,0.7923,0.7923,90,90,90 Friauf-Laves phase white silver6.38 X 1549
Ag-Nd AgNd hp AuCd,oP4,51 Pmma 0.4534,0.2778,0.5268,90,90,90 close-packed structure - 12.62 A 33099
Ag-Nd AgNd lt CuTi,tP2,123 P4/mmm 0.3712,0.3712,0.3698,90,90,90 b.c.c. family - 8.22 X 9066
Ag-Nd AgNd rt CsCl,cP2,221 Pm-3m 0.37181,0.37181,0.37181,90,90,90 b.c.c. family - 8.14 X 9066
Ag-Nd Ag0.97 Nd0.03 Cu,cF4,225 Fm-3m 0.40873,0.40873,0.40873,90,90,90 close-packed structure - 10.60 X 15974
Ag-Nd Ag2Nd ht1 *,hP*,* - 0.4789,0.4789,0.706,90,90,120 - - - N 11599
Ag-Nd Ag2Nd rt KHg2,oI12,74 Imma 0.47719,0.7026,0.8153,90,90,90 AlB2 family - 8.75 A 40675
Handbook of Inorganic Substances – Edition 2015 : Data 11

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Nd Ag51 Nd14 Ag51 Gd14,hP68,175 P6/m 1.27231,1.27231,0.93852,90,90,120 - - 9.49 A 40675


Ag-Ni Ag0.5 Ni0.5 tf Cu,cF4,225 Fm-3m 0.383,0.383,0.383,90,90,90 close-packed structure - 9.85 X 28869
Ag-O AgO cub ZnS,cF8,216 F-43m 0.4816,0.4816,0.4816,90,90,90 adamantane structure - 7.37 X 1098
Ag-O AgO mon AgO,mP8,14 P121/c1 0.58592,0.34842,0.54995,90,107.506,90 - - 7.68 X 21301
Ag-O AgO tet AgO,tI32,88 I41/a 0.6833,0.6833,0.9122,90,90,90 - black 7.73 X 19325
Ag-O Ag2O cub Cu2O,cP6,224 Pn-3m 0.47306,0.47306,0.47306,90,90,90 - black 7.27 X 40047
Ag-O Ag2O hp1 *,hP6,* - 0.471,0.471,0.78,90,90,120 - - 7.70 N 20728
Ag-O Ag2O hp2 *,hP12,* - 0.324,0.324,2.182,90,90,120 - - 7.76 N 15477
Ag-O Ag2O trig CdI2 ,hP3,164 P-3m1 0.3072,0.3072,0.4941,90,90,120 CdI2-PbI2 polytype - 9.53 X 1887
Ag-O Ag2O2.47 cub Ag2O2.5 ,cP10,224 Pn-3m 0.4904,0.4904,0.4904,90,90,90 - - 7.19 X 1099
Ag-O Ag2O3 orth Au2O3,oF40,43 Fdd2 1.049,1.2869,0.36638,90,90,90 - black 7.08 X 19681
Ag-O Ag3O BiI3,hP8,162 P-31m 0.5318,0.5318,0.4951,90,90,120 - - 9.30 X 14237
Ag-O Ag3O4 rt Ag3O4,mP14,14 P121/c1 0.35787,0.92079,0.56771,90,106.135,90 - black 7.16 X 20350
Ag-P AgP 2 CuP 2,mP12,14 P121/c1 0.62167,0.50587,0.78059,90,113.48,90 - - 5.01 X 15666
Ag-P Ag3P 11 Ag3P 11,mS28,8 C1m1 1.2999,0.7555,0.6612,90,118.84,90 - black 3.88 X 14171
Ag-Pb Ag0.8 Pb0.2 prec Mg,hP2,194 P63/mmc 0.292,0.292,0.476,90,90,120 close-packed structure - 12.07 X 674
Ag-Pb Ag0.98 Pb0.02 Cu,cF4,225 Fm-3m 0.4108,0.4108,0.4108,90,90,90 close-packed structure - 10.53 X 26065
Ag-Pd Ag0.21 Pd0.79 ht Cu,cF4,225 Fm-3m 0.39295,0.39295,0.39295,90,90,90 close-packed structure - 11.68 X 56812
Ag-Pr AgPr rt CsCl,cP2,221 Pm-3m 0.3722,0.3722,0.3722,90,90,90 b.c.c. family - 8.01 X 18200
Ag-Pr Ag0.975 Pr0.025 Cu,cF4,225 Fm-3m 0.4087,0.4087,0.4087,90,90,90 close-packed structure - 10.58 X 15974
Ag-Pr Ag2Pr ht *,hP*,* - 0.4777,0.4777,0.6867,90,90,120 - - - N 11599
Ag-Pr Ag2Pr rt KHg2,oI12,74 Imma 0.4821,0.6917,0.825,90,90,90 AlB2 family - 8.61 A 53948
Ag-Pr Ag51 Pr14 Ag51 Gd14,hP68,175 P6/m 1.2836,1.2836,0.9434,90,90,120 - - 9.22 A 53948
Ag-Pt Ag0.06 Pt0.94 Cu,cF4,225 Fm-3m 0.3929,0.3929,0.3929,90,90,90 close-packed structure - 20.79 X 31759
Ag-Pt Ag0.5 Pt0.5 m Cu,cF4,225 Fm-3m 0.398,0.398,0.398,90,90,90 close-packed structure - 15.96 X 16153
Ag-Pt Ag0.67 Pt0.33 Cu,cF4,225 Fm-3m 0.4004,0.4004,0.4004,90,90,90 close-packed structure - 14.14 X 31759
Ag-Pt Ag0.75 Pt0.25 ht1 Cu,cF4,225 Fm-3m 0.39,0.39,0.39,90,90,90 close-packed structure - 14.52 X 239
Ag-Pt Ag15 Pt17 ht *,c*32,* - 0.8,0.8,0.8,90,90,90 - - - N 31759
Ag-Pt Ag3Pt rt Cu3Au,cP4,221 Pm-3m 0.3887,0.3887,0.3887,90,90,90 close-packed structure - 14.67 X 239
Ag-Pu Ag51 Pu14 Ag51 Gd14,hP68,175 P6/m 1.2727,1.2727,0.9392,90,90,120 - - 11.24 A 6204
Ag-S Ag2S hp1 Ag2Se,oP12,19 P212121 0.41479,0.6725,0.72945,90,90,90 - black 8.09 X 58326
Ag-S Ag2S hp2 Ag2S-b,mP12,14 P121/c1 0.4092,0.57519,0.87134,90,114.123,90 - black 8.79 X 58326
Ag-S Ag2S ht1 Ag2S,cI20,229 Im-3m 0.486,0.486,0.486,90,90,90 - - 7.17 X 13436
Ag-S Ag2S ht2 UO2.12 ,cF92,225 Fm-3m 0.62831,0.62831,0.62831,90,90,90 fluorite family - 6.64 X 57106
Ag-S Ag2S lt Ag2S-a,mP12,14 P121/c1 0.41266,0.66989,0.82219,90,109.983,90 acanthite black 7.71 X 58326
Ag-S Ag2S tf *,tP*,115 P-4m2 0.69,0.69,0.477,90,90,90 - - - N 7427
Ag-S Ag8S Ag8S,oI18,44 Imm2 0.59,0.64,0.87,90,90,90 - - 9.05 X 29879
Ag-Sb Ag0.85 Sb0.15 rt Mg,hP2,194 P63/mmc 0.2942,0.2942,0.4802,90,90,120 close-packed structure - 10.15 X 46532
Ag-Sb Ag0.93 Sb0.07 Cu,cF4,225 Fm-3m 0.413,0.413,0.413,90,90,90 close-packed structure - 10.26 X 26065
Ag-Sb Ag2Sb *,oS30,20 C222 1 0.775,1.232,0.842,90,90,90 - white tin 6.97 N 163
Ag-Sb Ag3.15 Sb0.85 Ag3(Ag0.15 Sb0.85 ),oP4,25 Pmm2 0.3008,0.4828,0.5214,90,90,90 dyscrasite - 9.72 X 9726
Ag-Sc AgSc CsCl,cP2,221 Pm-3m 0.3412,0.3412,0.3412,90,90,90 b.c.c. family - 6.39 X 1764
Ag-Sc Ag0.91 Sc0.09 Cu,cF4,225 Fm-3m 0.41075,0.41075,0.41075,90,90,90 close-packed structure - 9.80 X 5488
Ag-Sc Ag2Sc MoSi2,tI6,139 I4/mmm 0.3524,0.3524,0.8941,90,90,90 b.c.c. family - 7.80 A 6012
Ag-Sc Ag4Sc MoNi4,tI10,87 I4/m 0.6574,0.6574,0.40686,90,90,90 close-packed structure - 9.00 A 4973
Ag-Se AgSe tf ZnS,cF8,216 F-43m 0.565,0.565,0.565,90,90,90 adamantane structure - 6.88 X 6988
Ag-Se Ag13.5 Se4 tf *,cF*,* - 0.696,0.696,0.696,90,90,90 - - - N 1761
Ag-Se Ag2Se ht Ag2S,cI20,229 Im-3m 0.5006,0.5006,0.5006,90,90,90 - - 7.80 X 21884
Ag-Se Ag2Se rt Ag2Se,oP12,19 P212121 0.43359,0.707,0.7774,90,90,90 naumannite black 8.21 X 55706
Ag-Se Ag2Se tricl Ag2Se,aP12,1 P1 0.43,0.7,0.78,92.,92.,91.5 - - 8.35 X 15490
Ag-Si Ag0.85 Si0.15 m Mg,hP2,194 P63/mmc 0.287,0.287,0.4528,90,90,120 close-packed structure - 9.86 X 6808
Ag-Si Ag2Si m URe2,oS24,63 Cmcm 0.556,0.916,0.849,90,90,90 Friauf-Laves phase - 7.49 A 8288
Ag-Sm AgSm CsCl,cP2,221 Pm-3m 0.3673,0.3673,0.3673,90,90,90 b.c.c. family - 8.66 X 1914
Ag-Sm Ag0.9975 Sm0.0025 Cu,cF4,225 Fm-3m 0.40872,0.40872,0.40872,90,90,90 close-packed structure - 10.50 X 5488
Ag-Sm Ag51 Sm14 Ag51 Gd14,hP68,175 P6/m 1.2727,1.2727,0.9359,90,90,120 - - 9.62 A 53948
Ag-Sn Ag0.04 Sn0.96 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3174,0.3174,0.2957,90,90,120 - - 7.61 X 2985
Ag-Sn Ag0.87 Sn0.13 Cu,cF4,225 Fm-3m 0.4142,0.4142,0.4142,90,90,90 close-packed structure - 10.21 X 26065
Ag-Sn Ag0.877 Sn0.123 Mg,hP2,194 P63/mmc 0.2956,0.2956,0.4752,90,90,120 close-packed structure - 10.09 X 55916
Ag-Sn Ag3Sn rt Cu3Ti,oP8,59 Pmmn 0.47821,0.59957,0.51654,90,90,90 close-packed structure - 9.92 X 45557
Ag-Sr SrAg orth1 SrAg,oP16,62 Pnma 1.6558,0.4788,0.6385,90,90,90 CrB(TlI)-FeB - 5.13 X 14027
Ag-Sr SrAg orth2 CaCu,oP40,62 Pnma 4.1315,0.47879,0.63881,90,90,90 CrB(TlI)-FeB gray silver 5.14 X 51523
Ag-Sr SrAg2 KHg2,oI12,74 Imma 0.4817,0.7716,0.8263,90,90,90 AlB2 family - 6.56 X 2861
Ag-Sr SrAg5 CaCu5,hP6,191 P6/mmm 0.5644,0.5644,0.4631,90,90,120 - - 8.15 X 5604
Ag-Sr Sr3Ag2 Er3Ni2,hR45,148 R-3 0.9962,0.9962,1.861,90,90,120 - - 4.47 X 17470
Ag-Sr Sr7Ag3 Th7Fe3,hP20,186 P63mc 1.138,1.138,0.7277,90,90,120 - - 3.81 A 17470
Ag-Tb AgTb lt CuTi,tP2,123 P4/mmm 0.3613,0.3613,0.3626,90,90,90 b.c.c. family - 9.36 X 8492
Ag-Tb AgTb rt CsCl,cP2,221 Pm-3m 0.3627,0.3627,0.3627,90,90,90 b.c.c. family - 9.29 X 8492
Ag-Tb Ag0.95 Tb0.05 Cu,cF4,225 Fm-3m 0.40971,0.40971,0.40971,90,90,90 close-packed structure - 10.66 X 23282
Ag-Tb Ag2 Tb MoSi2,tI6,139 I4/mmm 0.3709,0.3709,0.9251,90,90,90 b.c.c. family - 9.78 X 4094
Ag-Tb Ag51 Tb14 Ag51 Gd14,hP68,175 P6/m 1.2643,1.2643,0.9296,90,90,120 - - 9.97 X 45490
Ag-Te AgTe rt AgTe,oP32,62 Pnma 2.01,0.8882,0.4614,90,90,90 empressite bronze pale 7.60 X 42666
Ag-Te AgTe 3 hp AgTe 3,hR12,160 R3m 0.8645,0.8645,0.5272,90,90,120 - golden 7.16 X 15041
Ag-Te Ag0.26 Te0.74 tf Po,cP1,221 Pm-3m 0.3055,0.3055,0.3055,90,90,90 - - 7.13 X 1684
Ag-Te Ag10.6 Te7 rt Ag10.6 Te7,hP155,189 P-62m 1.3456,1.3456,1.6917,90,90,120 stützite gray 7.65 X 32418
Ag-Te Ag2 Te hp1 *,tP*,* - 0.892,0.892,0.609,90,90,90 - - - N 4742
Ag-Te Ag2 Te hp2 *,tP*,* - 0.868,0.868,0.609,90,90,90 - - - N 4742
Ag-Te Ag2 Te ht1 Cu2Se,cF44,225 Fm-3m 0.6576,0.6576,0.6576,90,90,90 fluorite family purple dark 8.02 X 18300
Ag-Te Ag2 Te ht2 Ag2S,cI20,229 Im-3m 0.529,0.529,0.529,90,90,90 - - 7.70 X 1412
12 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Te Ag2 Te rt Ag2 Te,mP12,14 P121/c1 0.8058,0.4468,0.8977,90,123.04,90 hessite gray 8.42 X 27008
Ag-Te Ag7 Te4 rt Ag7 Te4,hP55,191 P6/mmm 1.348,1.348,0.849,90,90,120 - - 7.86 X 3246
Ag-Th AgTh2 CuAl2,tI12,140 I4/mcm 0.7591,0.7591,0.5844,90,90,90 - - 11.28 X 6743
Ag-Th Ag2 Th Hg2U,hP3,191 P6/mmm 0.4837,0.4837,0.3354,90,90,120 AlB2 family - 10.94 X 20232
Ag-Th Ag51 Th14 Ag51Gd14,hP68,175 P6/m 1.2766,1.2766,0.9419,90,90,120 - - 10.93 A 20232
Ag-Ti AgTi tet1 CdTi,tP4,129 P4/nmm 0.2903,0.2903,0.812,90,90,90 close-packed structure - 7.56 A 5569
Ag-Ti AgTi tet2 CuAu,tP2,123 P4/mmm 0.2902,0.2902,0.4077,90,90,90 close-packed structure - 7.53 X 536
Ag-Ti AgTi2 rt CuZr2,tI6,139 I4/mmm 0.2952,0.2952,1.185,90,90,90 close-packed structure - 6.55 A 5569
Ag-Ti AgTi3 SrPb3,tP4,123 P4/mmm 0.4187,0.4187,0.395,90,90,90 close-packed structure - 6.03 X 519
Ag-Ti Ag0.07 Ti0.93 rt Mg,hP2,194 P63 /mmc 0.294,0.294,0.4703,90,90,120 close-packed structure - 4.91 X 519
Ag-Tl Ag0.965 Tl0.035 Cu,cF4,225 Fm-3m 0.40884,0.40884,0.40884,90,90,90 close-packed structure - 10.81 X 186
Ag-Tm AgTm CsCl,cP2,221 Pm-3m 0.3543,0.3543,0.3543,90,90,90 b.c.c. family - 10.34 X 15307
Ag-Tm Ag0.96 Tm0.04 Cu,cF4,225 Fm-3m 0.4108,0.4108,0.4108,90,90,90 close-packed structure - 10.57 X 5488
Ag-Tm Ag2 Tm rt MoSi2,tI6,139 I4/mmm 0.3653,0.3653,0.914,90,90,90 b.c.c. family - 10.47 X 5342
Ag-Tm Ag3 Tm cub Cu3Au,cP4,221 Pm-3m 0.42117,0.42117,0.42117,90,90,90 close-packed structure - 10.95 X 4973
Ag-Tm Ag3 Tm orth Cu3Ti,oP8,59 Pmmn 0.4948,0.6075,0.5163,90,90,90 close-packed structure - 10.54 A 4973
Ag-Y AgY CsCl,cP2,221 Pm-3m 0.3618,0.3618,0.3618,90,90,90 b.c.c. family - 6.90 X 29415
Ag-Y Ag0.98 Y0.02 Cu,cF4,225 Fm-3m 0.40915,0.40915,0.40915,90,90,90 close-packed structure - 10.42 X 24559
Ag-Y Ag2 Y hex *,hP*,* - 0.3025,0.3025,0.505,90,90,120 - - - N 2132
Ag-Y Ag2 Y tet MoSi2,tI6,139 I4/mmm 0.36882,0.36882,0.92436,90,90,90 b.c.c. family - 8.05 A 40675
Ag-Y Ag51 Y14 Ag51Gd14,hP68,175 P6/m 1.263,1.263,0.9307,90,90,120 - - 8.71 A 40675
Ag-Yb AgYb ht CsCl,cP2,221 Pm-3m 0.36787,0.36787,0.36787,90,90,90 b.c.c. family - 9.37 X 2945
Ag-Yb AgYb rt FeB-b,oP8,62 Pnma 0.759,0.467,0.6013,90,90,90 CrB(TlI)-FeB - 8.75 X 5324
Ag-Yb Ag0.99 Yb0.01 Cu,cF4,225 Fm-3m 0.4088,0.4088,0.4088,90,90,90 close-packed structure - 10.55 X 24559
Ag-Yb Ag2 Yb orth KHg2,oI12,74 Imma 0.4663,0.7211,0.8184,90,90,90 AlB2 family - 9.38 X 4094
Ag-Yb Ag2 Yb tet MoSi2,tI6,139 I4/mmm 0.3624,0.3624,0.888,90,90,90 b.c.c. family - 11.07 A 2945
Ag-Yb Ag2 Yb3 U3Si2,tP10,127 P4/mbm 0.8219,0.8219,0.4218,90,90,90 - - 8.57 X 5324
Ag-Yb Ag3 Yb5 Cr5B3,tI32,140 I4/mcm 0.7942,0.7942,1.4881,90,90,90 - - 8.41 X 5324
Ag-Yb Ag7 Yb2 Ag7 Yb2,oS36,63 Cmcm 0.948,0.5526,1.4076,90,90,90 - gray silver 9.92 X 25578
Ag-Zn AgZn hp CsCl,cP2,221 Pm-3m 0.3088,0.3088,0.3088,90,90,90 b.c.c. family - 9.77 X 18194
Ag-Zn Ag0.045 Zn0.955 Mg,hP2,194 P63 /mmc 0.27075,0.27075,0.47627,90,90,120 close-packed structure - 7.39 X 2146
Ag-Zn Ag0.26 Zn0.74 Mg,hP2,194 P63 /mmc 0.2824,0.2824,0.4447,90,90,120 close-packed structure - 8.26 X 17287
Ag-Zn Ag0.5 Zn0.5 ht W,cI2,229 Im-3m 0.3155,0.3155,0.3155,90,90,90 b.c.c. family - 9.16 X 18194
Ag-Zn Ag1.07 Zn0.93 rt CsCl,cP2,221 Pm-3m 0.31588,0.31588,0.31588,90,90,90 b.c.c. family - 9.28 X 13523
Ag-Zn Ag4.5 Zn4.5 ht (Ag0.56 Zn0.44 )8Zn,hP9,147 P-3 0.76360,0.76360,0.28197,90,90,120 b.c.c. family - 9.09 X 371
Ag-Zn Ag5Zn8 Cu5Zn8,cI52,217 I-43m 0.93407,0.93407,0.93407,90,90,90 γ-brass - 8.66 X 561
Ag-Zr AgZr CuTi,tP4,129 P4/nmm 0.3468,0.3468,0.6603,90,90,90 b.c.c. family - 8.33 X 433
Ag-Zr AgZr2 CuZr2,tI6,139 I4/mmm 0.32464,0.32464,1.20037,90,90,90 close-packed structure - 7.62 X 1765
Ag-Zr AgZr3 CuTi3,tP4,123 P4/mmm 0.4566,0.4566,0.3986,90,90,90 close-packed structure - 7.62 X 433
Al-As AlAs hp NiAs,hP4,194 P63 /mmc 0.36,0.36,0.574,90,90,120 AlB2 family - 5.25 X 29379
Al-As AlAs rt ZnS,cF8,216 F-43m 0.56605,0.56605,0.56605,90,90,90 adamantane structure gray 3.73 X 5304
Al-Au AuAl tf CsCl,cP2,221 Pm-3m 0.314,0.314,0.314,90,90,90 b.c.c. family - 12.01 X 6284
Al-Au AuAl AuAl,mP8,11 P121/m1 0.63254,0.33286,0.63998,90,93.14,90 AlB2 family gray 11.06 X 23531
Al-Au AuAl1.9 CaF2,cF12,225 Fm-3m 0.59988,0.59988,0.59988,90,90,90 fluorite family blue 7.64 X 23531
Al-Au AuAl2 hp PbCl2,oP12,62 Pnma 0.7414,0.3529,0.8155,90,90,90 - - 7.81 X 50736
Al-Au Au0.8 Al0.2 ht W,cI2,229 Im-3m 0.324,0.324,0.324,90,90,90 b.c.c. family - 15.91 X 2751
Al-Au Au0.8 Al0.2 m Pa,tI2,139 I4/mmm 0.3108,0.3108,0.3418,90,90,90 b.c.c. family - 16.39 X 18697
Al-Au Au0.862 Al0.138 Cu,cF4,225 Fm-3m 0.40585,0.40585,0.40585,90,90,90 close-packed structure - 17.24 X 24851
Al-Au Au2 Al ht MoSi2,tI6,139 I4/mmm 0.3349,0.3349,0.8893,90,90,90 b.c.c. family - 14.02 A 8285
Al-Au Au2 Al rt Al+ Au2 Al,oP30,58 Pnnm 0.8801,1.6772,0.3219,90,90,90 - - 14.71 X 8285
Al-Au Au2 Al rt Al- Au2 Al,oP12,62 Pnma 0.6715,0.3219,0.8815,90,90,90 b.c.c. family - 14.67 X 8285
Al-Au Au4 Al rt Au4 Al,cP20,198 P213 0.69227,0.69227,0.69227,90,90,90 - - 16.31 X 23556
Al-Au Au8 Al3 Yb8In3,hR132,167 R-3c 0.7724,0.7724,4.2083,90,90,120 - gray silver 15.18 X 22411
Al-B AlB12 ht *,tP52,* - 0.882,0.882,0.509,90,90,90 - - 2.63 N 8493
Al-B Al0.57 B8 ht Al0.57 B8,oP396,19 P212121 1.0144,1.6573,1.7510,90,90,90 - - 2.53 X 16277
Al-B Al0.61 B6.50 ht Al0.38 (Al0.31 B0.69 )0.73 B6,oS88,63 Cmcm 0.5690,0.8881,0.9100,90,90,90 - - 2.51 X 3358
Al-B Al0.9 B2 AlB2,hP3,191 P6/mmm 0.3005,0.3005,0.32537,90,90,120 AlB2 family golden 3.00 X 43484
Al-B Al1.67 B22 rt Al1.67 B22,tP216,92 P41212 1.0161,1.0161,1.4283,90,90,90 - - 2.55 X 10801
Al-B Al2.3 B103 Cr1.5 B104.9 ,hR375,166 R-3m 1.09014,1.09014,2.37225,90,90,120 β-boron family black 2.40 X 58964
Al-B Al3.32 B103 Al3.3 B103.1 ,hR411,166 R-3m 1.0965,1.0965,2.3868,90,90,120 β-boron family black 2.41 X 22611
Al-Ba BaAl2 hp-ht MgCu2,cF24,227 Fd-3m 0.8702,0.8702,0.8702,90,90,90 Friauf-Laves phase gray 3.86 X 17719
Al-Ba BaAl4 BaAl4,tI10,139 I4/mmm 0.453,0.453,1.114,90,90,90 - - 3.56 X 103
Al-Ba Ba21Al40 Ba21Al40,hP61,157 P31m 1.05646,1.05646,1.7269,90,90,120 - gray silver 3.94 X 42995
Al-Ba Ba3Al5 Ba3Al5,hP16,194 P63 /mmc 0.60655,0.60655,1.4618,90,90,120 - gray silver 3.90 X 52840
Al-Ba Ba4Al5 Ba4Al5,hP18,194 P63 /mmc 0.60921,0.60921,1.7758,90,90,120 - gray silver 3.98 X 52840
Al-Ba Ba7Al10 Ba7Al10,hR51,166 R-3m 0.60423,0.60423,4.879,90,90,120 - gray silver 3.98 X 52840
Al-Be Be0.0003 Al0.9997 Cu,cF4,225 Fm-3m 0.40391,0.40391,0.40391,90,90,90 close-packed structure - 2.72 X 182
Al-Be Be0.997 Al0.003 rt Mg,hP2,194 P63 /mmc 0.22838,0.22838,0.3575,90,90,120 close-packed structure - 1.86 X 139
Al-Br AlBr3 AlBr3,mP16,14 P121/c1 0.7525,0.7095,1.0301,90,96.45,90 - - 3.24 X 32730
Al-C Al4C3 Al4C3,hR21,166 R-3m 0.3335,0.3335,2.4967,90,90,120 - yellow 2.98 X 31251
Al-Ca CaAl2 MgCu2,cF24,227 Fd-3m 0.80414,0.80414,0.80414,90,90,90 Friauf-Laves phase gray silver 2.40 X 50917
Al-Ca CaAl4 mart *,m*20,* - 0.4354,0.4366,1.118,90,91.1,90 - - - N 12483
Al-Ca CaAl4 rt BaAl4,tI10,139 I4/mmm 0.4353,0.4353,1.107,90,90,90 - - 2.34 A 189
Al-Ca Ca13Al14 Ca13Al14,mS54,12 C12/m1 1.5551,0.9873,0.9726,90,108.09,90 - - 2.10 X 34365
Al-Ca Ca8Al3 Ca8In3,aP22,2 P-1 0.9484,0.9592,0.9671,99.02,101.13,119.55 - - 1.86 X 34365
Al-Ce CeAl m1 CsCl,cP2,221 Pm-3m 0.385,0.385,0.385,90,90,90 b.c.c. family - 4.86 X 12728
Al-Ce CeAl m2 *,hP*,* - 0.365,0.365,2.087,90,90,120 - - - N 12728
Al-Ce CeAl CeAl,oS16,63 Cmcm 0.927,0.768,0.576,90,90,90 - - 5.41 X 3390
Handbook of Inorganic Substances – Edition 2015 : Data 13

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ce CeAl2 MgCu2,cF24,227 Fd-3m 0.8065,0.8065,0.8065,90,90,90 Friauf-Laves phase - 4.92 X 34785


Al-Ce CeAl3 rt Mg3 Cd,hP8,194 P63/mmc 0.6541,0.6541,0.461,90,90,120 close-packed structure - 4.30 X 2596
Al-Ce CeAl4 ht BaAl4,tI10,139 I4/mmm 0.4374,0.4374,1.012,90,90,90 - - 4.25 X 1504
Al-Ce Ce0.75 Al0.25 hp Cu,cF4,225 Fm-3m 0.46494,0.46494,0.46494,90,90,90 close-packed structure - 7.39 X 53156
Al-Ce Ce3Al ht Cu3Au,cP4,221 Pm-3m 0.4985,0.4985,0.4985,90,90,90 close-packed structure - 6.00 X 1504
Al-Ce Ce3Al lt Ce3Al,mP16,11 P121/m1 0.6824,0.5336,1.2458,90,90.31,90 close-packed structure - 6.55 X 23906
Al-Ce Ce3Al rt Mg3 Cd,hP8,194 P63/mmc 0.7043,0.7043,0.5451,90,90,120 close-packed structure - 6.34 X 9098
Al-Ce Ce3Al11 rt La3Al11,oI28,71 Immm 0.4395,1.0092,1.3025,90,90,90 - - 4.12 X 30455
Al-Cl AlCl3 rt AlCl3,mS16,12 C12/m1 0.5914,1.0234,0.6148,90,108.25,90 - white 2.51 X 26640
Al-Co CoAl rt CsCl,cP2,221 Pm-3m 0.2863,0.2863,0.2863,90,90,90 b.c.c. family - 6.08 X 26257
Al-Co Co0.0001 Al0.9999 Cu,cF4,225 Fm-3m 0.4049,0.4049,0.4049,90,90,90 close-packed structure - 2.70 X 5293
Al-Co Co0.5 Al0.5 ht W,cI2,229 Im-3m 0.2856,0.2856,0.2856,90,90,90 b.c.c. family - 6.12 X 56818
Al-Co Co0.87 Al0.13 ht Cu,cF4,225 Fm-3m 0.35684,0.35684,0.35684,90,90,90 close-packed structure - 8.01 X 24851
Al-Co Co12.5 Al37.04 Co12.5 Al37.0 ,oP240,62 Pnma 2.889,0.8138,1.2346,90,90,90 - - 3.97 X 54564
Al-Co Co2 Al5 Co2Al5,hP28,194 P63/mmc 0.7664,0.7664,0.7605,90,90,120 - - 4.34 X 35977
Al-Co Co2 Al9 Co2Al9,mP22,14 P121/c1 0.62163,0.62883,0.85587,90,94.772,90 - gray 3.59 X 45740
Al-Co Co3 Al (O) Cu3Au,cP4,221 Pm-3m 0.36552,0.36552,0.36552,90,90,90 close-packed structure - 6.93 X 26170
Al-Co Co4 Al12.2 ht (Co 0.88 Ni0.12)4Al12.1 ,mS36,12 C12/m1 1.7076,0.41059,0.75047,90,116.171,90 - - 3.97 X 54544
Al-Co Co4 Al13 rt Co4Al13,oP102,31 Pmn21 0.8158,1.2342,1.4452,90,90,90 - - 4.02 X 28782
Al-Co Co6 Al19 rt Co6Al19,mS100,12 C12/m1 1.5173,0.8109,1.2349,90,107.84,90 - - 3.98 X 42909
Al-Cr Cr0.05 Al0.95 Cu,cF4,225 Fm-3m 0.4008,0.4008,0.4008,90,90,90 close-packed structure - 2.91 X 10079
Al-Cr Cr0.87 Al0.13 W,cI2,229 Im-3m 0.2915,0.2915,0.2915,90,90,90 b.c.c. family - 6.54 X 3748
Al-Cr Cr2Al rt MoSi2,tI6,139 I4/mmm 0.3004,0.3004,0.8646,90,90,90 b.c.c. family - 5.58 X 4517
Al-Cr Cr2Al11 (O) *,mS*,15 C12/c1 1.76,3.05,1.76,90,90.,90 - - - N 25220
Al-Cr Cr25 Al129 Cr19(Cr0.5Al0.5 )12Al123 ,mS732,15 C12/c1 1.77348,3.04555,1.77344,90,91.052,90 - - 3.32 X 50625
Al-Cr Cr28.58 Al112.28 Cr23.76(Cr0.23 Al0.77 )21 Al96.10 ,oS584,63 Cmcm 1.2521,3.4705,2.0223,90,90,90 - - 3.41 X 33875
Al-Cr Cr4Al11 rt Mn4 Al11,aP15,2 P-1 0.5044,0.5089,0.8928,74.678,82.01,79.23 - - 3.88 A 48665
Al-Cr Cr4Al9 rt *,hR*,* - 1.291,1.291,1.5677,90,90,120 - - - N 33134
Al-Cr Cr5Al8 ht Cu5Zn8,cI52,217 I-43m 0.909,0.909,0.909,90,90,90 γ-brass - 4.21 X 26102
Al-Cr Cr55 Al226.58 Mn55 Al226.58 ,hP574,194 P63/mmc 2.01911,2.01911,2.4854,90,90,120 - - 3.40 X 50625
Al-Cr Cr7Al45 V7 Al45,mS104,12 C12/m1 2.0594,0.7574,1.0949,90,107.339,90 - - 3.22 X 1185
Al-Cr Cr9.5 Al16 ht Cr4.5(Cr0.56 Al0.44 )9Al12,hR78,160 R3m 1.27284,1.27284,0.79416,90,90,120 γ-brass - 4.14 X 10342
Al-Cu CuAl rt CuAl,mS20,12 C12/m1 1.2065,0.4105,0.6913,90,124.95,90 cupalite - 5.36 X 6750
Al-Cu CuAl tf LiRh,hP2,187 P-6m2 0.256,0.256,0.419,90,90,120 close-packed structure - 6.32 X 48377
Al-Cu CuAl2 m CuAl2,mP12,10 P12/m1 0.496,0.848,0.496,90,120.,90 - - 4.32 X 19410
Al-Cu CuAl2 prec CuAl2,oF24,69 Fmmm 0.496,0.848,0.859,90,90,90 - - 4.32 X 21068
Al-Cu CuAl2 CuAl2,tI12,140 I4/mcm 0.60637,0.60637,0.48736,90,90,90 khatyrkite - 4.36 X 46974
Al-Cu Cu0.749 Al0.251 mart *,hP*,* - 0.257,0.257,0.421,90,90,120 - - - N 1388
Al-Cu Cu0.75 Al0.25 ht W,cI2,229 Im-3m 0.294,0.294,0.294,90,90,90 b.c.c. family - 7.11 X 509
Al-Cu Cu0.78 Al0.22 mart *,o**,* - 0.263,0.446,1.91,90,90,90 - - - N 3652
Al-Cu Cu0.848 Al0.152 rt Cu,cF4,225 Fm-3m 0.36536,0.36536,0.36536,90,90,90 close-packed structure - 7.90 X 24851
Al-Cu Cu0.94 Al0.94 ht Cu0.94 Al0.94 ,oS32,65 Cmmm 0.4145,1.23004,0.872,90,90,90 - - 5.09 X 56217
Al-Cu Cu1.7 Al ht Co1.75 Ge,hP6,194 P63/mmc 0.4146,0.4146,0.5063,90,90,120 AlB2 family - 5.95 X 6750
Al-Cu Cu11.2 Al8.88 ht2 Cu11.2 Al8.88 ,oF88,42 Fmm2 0.81267,1.41985,0.99928,90,90,90 - - 5.48 X 43099
Al-Cu Cu2Al3 m Ni2Al3,hP5,164 P-3m1 0.4106,0.4106,0.5094,90,90,120 - - 4.64 X 8329
Al-Cu Cu3Al rt BiF3 ,cF16,225 Fm-3m 0.5819,0.5819,0.5819,90,90,90 b.c.c. family - 7.34 X 14521
Al-Cu Cu32.97 Al17.30 rt Cu31.27 (Cu0.57 Al0.43 )3 Al16,hR156,160 R3m 1.2285,1.2285,1.51486,90,90,120 γ-brass - 6.45 X 24528
Al-Cu Cu4Al rt Au4 Al,cP20,198 P213 0.626,0.626,0.626,90,90,90 - - 7.61 A 1933
Al-Cu Cu5.75 Al4.5 ht1 Cu4.25(Cu0.75 Al0.25 )2Al4,oI24,44 Imm2 0.40972,0.70313,0.99793,90,90,90 - - 5.62 X 42384
Al-Cu Cu9Al4 ht Cu5Zn8,cI52,217 I-43m 0.87158,0.87158,0.87158,90,90,90 γ-brass - 6.82 A 35796
Al-Cu Cu9Al4 rt Cu9Al4,cP52,215 P-43m 0.8707,0.8707,0.8707,90,90,90 γ-brass golden 6.84 X 11133
Al-Cu CuxAl Cu,cF4,225 Fm-3m 0.4056,0.4056,0.4056,90,90,90 close-packed structure - 2.69 X 42931
Al-D AlD3 cub H0.5(Ta0.5 W0.5)O3,cF64,227 Fd-3m 0.90037,0.90037,0.90037,90,90,90 pyrochlore family - 1.20 X 48606
Al-D AlD3 hp *,mP4,14 P121/c1 0.35503,0.4074,0.52097,90,90.243,90 - - 2.91 P 57196
Al-D AlD3 orth1 AlF3 ,oS48,63 Cmcm 0.647,1.1117,0.6562,90,90,90 - - 1.39 X 46911
Al-D AlD3 orth2 AlH3,oP24,58 Pnnm 0.53672,0.7336,0.57562,90,90,90 - - 1.45 X 48660
Al-D AlD3 rhom FeF3 ,hR24,167 R-3c 0.44364,0.44364,1.17963,90,90,120 - white 1.64 X 46911
Al-Dy DyAl ht CsCl,cP2,221 Pm-3m 0.36826,0.36826,0.36826,90,90,90 b.c.c. family - 6.30 X 1398
Al-Dy DyAl rt DyAl,oP16,57 Pbcm 0.580,1.140,0.562,90,90,90 - - 6.77 X 3390
Al-Dy DyAl2 rt MgCu2,cF24,227 Fd-3m 0.7838,0.7838,0.7838,90,90,90 Friauf-Laves phase - 5.97 X 21331
Al-Dy DyAl3 hp-ht1 HoAl3,hR60,166 R-3m 0.6074,0.6074,3.587,90,90,120 close-packed structure - 5.29 A 9091
Al-Dy DyAl3 hp-ht2 Cu3Au,cP4,221 Pm-3m 0.4236,0.4236,0.4236,90,90,90 close-packed structure - 5.32 X 49461
Al-Dy DyAl3 ht *,t**,* - 0.99,0.99,1.266,90,90,90 - - - N 3578
Al-Dy DyAl3 rt TiNi3,hP16,194 P63/mmc 0.6095,0.6095,0.9531,90,90,120 close-packed structure - 5.27 A 56511
Al-Dy Dy2 Al Co2Si-b,oP12,62 Pnma 0.6507,0.5084,0.9382,90,90,90 - - 7.53 A 59024
Al-Dy Dy2 Al17 Th2Ni17,hP38,194 P63/mmc 1.1788,1.1788,1.1322,90,90,120 CaCu5-Zr4Al3 - 1.91 A 21793
Al-Dy Dy3 Al2 Gd3Al2,tP20,102 P42nm 0.8168,0.8168,0.7515,90,90,90 - - 7.17 A 59024
Al-Er ErAl DyAl,oP16,57 Pbcm 0.5791,1.1277,0.5574,90,90,90 - - 7.09 A 51924
Al-Er ErAl2 MgCu2,cF24,227 Fd-3m 0.77967,0.77967,0.77967,90,90,90 Friauf-Laves phase - 6.20 X 21331
Al-Er ErAl3 lt HoAl3,hR60,166 R-3m 0.6025,0.6025,3.5675,90,90,120 close-packed structure - 5.51 A 3706
Al-Er ErAl3 rt Cu3Au,cP4,221 Pm-3m 0.4215,0.4215,0.4215,90,90,90 close-packed structure - 5.50 X 56798
Al-Er Er2Al Co2Si-b,oP12,62 Pnma 0.6523,0.5024,0.9263,90,90,90 - - 7.91 A 51924
Al-Er Er2Al17 Th2Ni17,hP38,194 P63/mmc 0.972,0.972,0.8707,90,90,120 CaCu5-Zr4Al3 - 3.70 A 26488
Al-Er Er3Al2 Zr3Al2,tP20,136 P42/mnm 0.81323,0.81323,0.75039,90,90,90 - - 7.44 X 19846
Al-Eu EuAl EuAl,oP20,59 Pmmn 0.5806,0.9652,1.0088,90,90,90 - - 5.26 X 18525
Al-Eu EuAl2 MgCu2,cF24,227 Fd-3m 0.81305,0.81305,0.81305,90,90,90 Friauf-Laves phase - 5.09 X 29387
Al-Eu EuAl4 BaAl4,tI10,139 I4/mmm 0.4396,0.4396,1.117,90,90,90 - - 4.00 X 2597
Al-F AlF3 ht2 *,tP8,* - 0.354,0.354,0.6,90,90,90 - - - N 3072
14 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-F AlF3 m AlF3,oS48,63 Cmcm 0.6931,1.2002,0.7134,90,90,90 - - 2.82 X 21577


Al-F AlF3 rt FeF3,hR24,167 R-3c 0.49254,0.49254,1.24477,90,90,120 oskarssonite colorless 3.20 X 17162
Al-F AlF3 tet1 AlF3,tP40,127 P4/mbm 1.14033,1.14033,0.35436,90,90,90 - white 3.03 X 29968
Al-F AlF3 tet2 AlF3,tP64,129 P4/nmm 1.01843,1.01843,0.71738,90,90,90 - white 3.00 X 26316
Al-Fe FeAl rt CsCl,cP2,221 Pm-3m 0.291,0.291,0.291,90,90,90 b.c.c. family - 5.58 X 27485
Al-Fe FeAl2.8 FeAl2.8 ,oS24,63 Cmcm 0.76559,0.64154,0.42184,90,90,90 - - 4.21 X 28513
Al-Fe FeAl6 m FeAl6,oS28,36 Cmc21 0.744,0.6464,0.8779,90,90,90 - - 3.43 X 2453
Al-Fe Fe0.002 Al0.998 Cu,cF4,225 Fm-3m 0.40486,0.40486,0.40486,90,90,90 close-packed structure - 2.71 X 5293
Al-Fe Fe0.1 Al0.9 tf Cu,cF4,225 Fm-3m 0.404,0.404,0.404,90,90,90 close-packed structure - 3.01 X 23810
Al-Fe Fe0.4 Al0.6 rt W,cI2,229 Im-3m 0.2957,0.2957,0.2957,90,90,90 b.c.c. family - 4.95 X 23810
Al-Fe Fe3Al ht BiF3,cF16,225 Fm-3m 0.5805,0.5805,0.5805,90,90,90 b.c.c. family - 6.61 X 16223
Al-Fe Fe4Al13 Fe4Al13,mS102,12 C12/m1 1.5495,0.8089,1.2485,90,107.7,90 - - 3.84 X 59146
Al-Fe Fe5Al8 ht Cu5Zn8,cI52,217 I-43m 0.89718,0.89718,0.89718,90,90,90 γ-brass - 4.55 X 53825
Al-Fe Fe6.5 Al11.5 rt Fe5(Fe0.5 Al0.5)3Al10,aP18,1 P1 0.4878,0.6461,0.87476,87.927,74.452,83.11 - gray silver 4.24 X 7169
Al-Ga Al0.95 Ga0.05 Cu,cF4,225 Fm-3m 0.4055,0.4055,0.4055,90,90,90 close-packed structure - 2.90 X 4693
Al-Gd GdAl orth1 CeAl,oS16,63 Cmcm 0.92741,0.76791,0.5584,90,90,90 - - 6.15 A 2444
Al-Gd GdAl orth2 DyAl,oP16,57 Pbcm 0.58819,1.1523,0.5653,90,90,90 - - 6.39 A 56179
Al-Gd GdAl stab CsCl,cP2,221 Pm-3m 0.37208,0.37208,0.37208,90,90,90 b.c.c. family - 5.94 X 1398
Al-Gd GdAl2 rt MgCu2,cF24,227 Fd-3m 0.7885,0.7885,0.7885,90,90,90 Friauf-Laves phase - 5.72 X 56179
Al-Gd GdAl3 hp-ht BaPb3,hR36,166 R-3m 0.6231,0.6231,2.1173,90,90,120 close-packed structure - 5.00 A 9091
Al-Gd GdAl3 Mg3Cd,hP8,194 P63 /mmc 0.6332,0.6332,0.46,90,90,120 close-packed structure - 4.95 X 9098
Al-Gd GdAl4 UAl4,oI20,74 Imma 0.4442,0.6316,1.3739,90,90,90 - - 4.57 A 3594
Al-Gd Gd2Al Co2Si-b,oP12,62 Pnma 0.6612,0.515,0.9578,90,90,90 - - 6.95 A 38287
Al-Gd Gd2Al17 Th2Ni17,hP38,194 P63 /mmc 0.8869,0.8869,0.9711,90,90,120 CaCu5-Zr4Al3 - 3.88 A 12441
Al-Gd Gd3Al2 Gd3Al2,tP20,102 P42nm 0.8344,0.8344,0.7656,90,90,90 - - 6.55 X 2101
Al-Ge AlGe m *,tP104,* - 1.059,1.059,1.603,90,90,90 - - - N 5201
Al-Ge Al0.004 Ge0.996 C,cF8,227 Fd-3m 0.5658,0.5658,0.5658,90,90,90 - - 5.31 X 22282
Al-Ge Al0.30 Ge0.70 hp1 (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.276,0.276,0.255,90,90,120 - - 5.81 X 32268
Al-Ge Al0.30 Ge0.70 hp2 Mg,hP2,194 P63 /mmc 0.2617,0.2617,0.4394,90,90,120 close-packed structure - 7.51 X 32268
Al-Ge Al0.4 Ge0.6 m *,t**,* - 1.498,1.498,1.003,90,90,90 - - - N 6808
Al-Ge Al0.6 Ge0.4 m *,cP*,* - 1.3805,1.3805,1.3805,90,90,90 - - - N 5270
Al-Ge Al0.7 Ge0.3 m hex *,hP*,191 P6/mmm 1.42,1.42,0.74,90,90,120 - - - N 16395
Al-Ge Al0.75 Ge0.25 m cub *,cP*,* - 1.2868,1.2868,1.2868,90,90,90 - - - N 5270
Al-Ge Al0.75 Ge0.25 m tet *,t**,* - 1.303,1.303,1.204,90,90,90 - - - N 6808
Al-Ge Al0.8 Ge0.2 m tet *,tP*,* - 1.295,1.295,1.208,90,90,90 - - - N 5378
Al-Ge Al0.85 Ge0.15 m Cu,cF4,225 Fm-3m 0.4064,0.4064,0.4064,90,90,90 close-packed structure - 3.35 X 18431
Al-Ge Al0.99 Ge0.01 Cu,cF4,225 Fm-3m 0.4051,0.4051,0.4051,90,90,90 close-packed structure - 2.74 X 22282
Al-Ge Al2.7 Ge0.3 m CuAl2,tI12,140 I4/mcm 0.613,0.613,0.492,90,90,90 - - 3.40 X 27949
Al-Ge Al6Ge5 m Zn5.38 Sb5,hR66,167 R-3c 1.145,1.145,1.167,90,90,120 - - 3.95 X 29741
Al-H AlH3 hp1 *,aP24,1 P1 0.383,0.43925,0.6374,74.469,78.016,76.686 - - 3.01 N 51301
Al-H AlH3 hp2 Cr3Si,cP8,223 Pm-3n 0.308,0.308,0.308,90,90,90 Frank-Kasper phase - 3.41 X 51301
Al-H AlH3 orth AlH3,oP24,58 Pnnm 0.53806,0.73555,0.57751,90,90,90 - white 1.31 X 48383
Al-H AlH3 rhom FeF3,hR24,167 R-3c 0.44512,0.44512,1.18179,90,90,120 - white 1.47 X 57062
Al-Hf HfAl TlI,oS8,63 Cmcm 0.3253,1.0831,0.4282,90,90,90 CrB(TlI)-FeB - 9.05 X 1405
Al-Hf HfAl2 MgZn2,hP12,194 P63 /mmc 0.525,0.525,0.868,90,90,120 Friauf-Laves phase - 7.45 A 17460
Al-Hf HfAl3 ht TiAl3,tI8,139 I4/mmm 0.3893,0.3893,0.8925,90,90,90 close-packed structure - 6.37 X 1285
Al-Hf HfAl3 rt ZrAl3,tI16,139 I4/mmm 0.3989,0.3989,1.7155,90,90,90 close-packed structure - 6.31 A 16741
Al-Hf Hf2Al rt CuAl2,tI12,140 I4/mcm 0.6776,0.6776,0.5372,90,90,90 - - 10.34 A 1477
Al-Hf Hf2Al3 Zr2Al3,oF40,43 Fdd2 0.9529,1.3763,0.5522,90,90,90 - - 8.03 X 1216
Al-Hf Hf3Al2 rt Zr3Al2,tP20,136 P42 /mnm 0.7535,0.7535,0.6906,90,90,90 - - 9.99 X 1207
Al-Hf Hf4Al3 rt Zr4Al3,hP7,191 P6/mmm 0.5334,0.5334,0.5429,90,90,120 Frank-Kasper phase - 9.87 A 13850
Al-Hf Hf5Al3 stab Mn5Si3,hP16,193 P63 /mcm 0.8052,0.8052,0.569,90,90,120 - - 10.12 X 1272
Al-Ho HoAl DyAl,oP16,57 Pbcm 0.5801,1.1339,0.5621,90,90,90 - - 6.90 A 3390
Al-Ho HoAl2 rt MgCu2,cF24,227 Fd-3m 0.7834,0.7834,0.7834,90,90,90 Friauf-Laves phase - 6.05 X 18384
Al-Ho HoAl3 hp TiNi3,hP16,194 P63 /mmc 0.606,0.606,0.953,90,90,120 close-packed structure - 5.39 A 9091
Al-Ho HoAl3 ht Cu3Au,cP4,221 Pm-3m 0.4231,0.4231,0.4231,90,90,90 close-packed structure - 5.39 X 49461
Al-Ho HoAl3 rt HoAl3,hR60,166 R-3m 0.6059,0.6059,3.586,90,90,120 close-packed structure - 5.37 X 9098
Al-Ho Ho2Al Co2Si-b,oP12,62 Pnma 0.6528,0.5053,0.9347,90,90,90 - - 7.69 X 6013
Al-Ho Ho3Al2 Gd3Al2,tP20,102 P42nm 0.8182,0.8182,0.7525,90,90,90 - - 7.24 A 2669
Al-I AlI3 InI3,mP16,14 P121/c1 0.9591,0.6069,1.1902,90,108.05,90 - - 4.11 X 44054
Al-Ir IrAl CsCl,cP2,221 Pm-3m 0.29771,0.29771,0.29771,90,90,90 b.c.c. family - 13.80 X 55413
Al-Ir IrAl2.75 IrAl2.75,cP60,195 P23 0.7674,0.7674,0.7674,90,90,90 - - 7.83 X 33859
Al-Ir IrAl3 Na3As,hP8,194 P63 /mmc 0.4246,0.4246,0.7756,90,90,120 - - 7.49 X 3396
Al-Ir Ir0.80 Al0.20 Cu,cF4,225 Fm-3m 0.3838,0.3838,0.3838,90,90,90 close-packed structure - 18.70 X 34603
Al-Ir Ir13Al45 Ir13Al45,oP236,62 Pnma 1.676,1.2321,1.7425,90,90,90 - gray silver 6.85 X 45224
Al-Ir Ir2Al9 Co2Al9,mP22,14 P121/c1 0.63779,0.64318,0.87337,90,94.776,90 - gray 5.84 X 45740
Al-Ir Ir9Al28 Ir9Al28,hP236,159 P31c 1.22864,1.22864,2.7341,90,90,120 - - 6.93 X 46577
Al-La LaAl CeAl,oS16,63 Cmcm 0.9455,0.7753,0.5791,90,90,90 - gray silver 5.19 X 34582
Al-La LaAl2 MgCu2,cF24,227 Fd-3m 0.8148,0.8148,0.8148,90,90,90 Friauf-Laves phase - 4.74 X 21331
Al-La LaAl3 rt Mg3Cd,hP8,194 P63 /mmc 0.6667,0.6667,0.4616,90,90,120 close-packed structure - 4.11 X 9098
Al-La LaAl4 ht BaAl4,tI10,139 I4/mmm 0.448,0.448,1.042,90,90,90 - - 3.92 A 2770
Al-La La0.88 Al2.12 ht AlB2,hP3,191 P6/mmm 0.4478,0.4478,0.4347,90,90,120 AlB2 family - 3.95 X 2770
Al-La La16Al13 La16.25 Al12.75 ,hP29,189 P-62m 0.9166,0.9166,1.1224,90,90,120 - - 5.23 X 45757
Al-La La3Al ht Mg3Cd,hP8,194 P63 /mmc 0.7192,0.7192,0.5528,90,90,120 close-packed structure - 5.95 A 27429
Al-La La3Al rt Cu3Au,cP4,221 Pm-3m 0.51001,0.51001,0.51001,90,90,90 close-packed structure - 5.55 X 54598
Al-La La3Al11 rt La3Al11,oI28,71 Immm 0.4431,1.0132,1.3142,90,90,90 - - 4.02 X 3331
Al-Li LiAl lt LiIn,tI8,141 I41/amd 0.44783,0.44783,0.63443,90,90,90 - - 1.77 X 43399
Al-Li LiAl rt NaTl,cF16,227 Fd-3m 0.63597,0.63597,0.63597,90,90,90 b.c.c. family gray bluish 1.75 X 43399
Handbook of Inorganic Substances – Edition 2015 : Data 15

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Li LiAl3 rt Cu3Au,cP4,221 Pm-3m 0.401,0.401,0.401,90,90,90 close-packed structure - 2.26 X 4172


Al-Li Li0.045 Al0.955 Cu,cF4,225 Fm-3m 0.40459,0.40459,0.40459,90,90,90 close-packed structure - 2.62 X 4488
Al-Li Li0.95 Al lt Li0.95 Al,tI40,82 I-4 1.0051,1.0051,0.6357,90,90,90 - - 1.74 X 16605
Al-Li Li2Al Li2Ga,oS12,63 Cmcm 0.46579,0.9767,0.44901,90,90,90 b.c.c. family - 1.33 X 54972
Al-Li Li3Al2 rt Li3Al2,hR15,166 R-3m 0.4508,0.4508,1.4259,90,90,120 b.c.c. family gray 1.48 X 7859
Al-Li Li9Al4 rt Li9Al4,mS26,12 C12/m1 1.8916,0.45041,0.54249,90,105.19,90 - - 1.27 X 54972
Al-Lu LuAl DyAl,oP16,57 Pbcm 0.5798,1.124,0.552,90,90,90 - - 7.46 X 22219
Al-Lu LuAl2 MgCu2,cF24,227 Fd-3m 0.7735,0.7735,0.7735,90,90,90 Friauf-Laves phase - 6.57 X 15303
Al-Lu LuAl3 Cu3Au,cP4,221 Pm-3m 0.41918,0.41918,0.41918,90,90,90 close-packed structure - 5.77 X 51283
Al-Lu Lu2Al Co2Si-b,oP12,62 Pnma 0.6456,0.4969,0.9184,90,90,90 - - 8.50 X 26683
Al-Lu Lu3Al2 Zr3Al2,tP20,136 P42/mnm 0.8051,0.8051,0.7363,90,90,90 - - 8.06 X 22219
Al-Mg MgAl2 m HfGa2,tI24,141 I41/amd 0.4132,0.4132,2.6602,90,90,90 close-packed structure - 2.29 A 11997
Al-Mg Mg0.17 Al0.83 Cu,cF4,225 Fm-3m 0.41013,0.41013,0.41013,90,90,90 close-packed structure - 2.55 X 54230
Al-Mg Mg0.96 Al0.04 Mg,hP2,194 P63/mmc 0.3187,0.3187,0.5179,90,90,120 close-packed structure - 1.78 X 52502
Al-Mg Mg1.2 Al1.8 m1 MgNi2,hP24,194 P63/mmc 0.573,0.573,1.908,90,90,120 Friauf-Laves phase - 1.90 A 20895
Al-Mg Mg1.2 Al1.8 m2 MgZn2,hP12,194 P63/mmc 0.573,0.573,0.954,90,90,120 Friauf-Laves phase - 1.90 A 20895
Al-Mg Mg112.8 Al180.2 rt Mg112.8 Al180.2 ,hR879,160 R3m 1.9968,1.9968,4.89114,90,90,120 - - 2.24 X 49665
Al-Mg Mg17 Al12 Mg17 Al12,cI58,217 I-43m 1.05492,1.05492,1.05492,90,90,90 - - 2.08 X 48366
Al-Mg Mg23 Al30 ht Mg23 Al30,hR159,148 R-3 1.28254,1.28254,2.17478,90,90,120 - - 2.20 X 3799
Al-Mg Mg28 Al45 Mg28 Al45,cF1832,227 Fd-3m 2.82435,2.82435,2.82435,90,90,90 - - 2.23 X 49665
Al-Mn MnAl12 WAl12,cI26,204 Im-3 0.747,0.747,0.747,90,90,90 - - 3.02 A 9450
Al-Mn MnAl3 m *,cP*,* - 0.9323,0.9323,0.9323,90,90,90 - - - N 10975
Al-Mn MnAl4 rt *,oP60,48 Pnnn 0.6795,0.9343,1.3897,90,90,90 - - 3.68 N 9197
Al-Mn MnAl6 MnAl6,oS28,63 Cmcm 0.7545,0.649,0.8681,90,90,90 - gray silver 3.39 X 37449
Al-Mn Mn0.06 Al0.94 Cu,cF4,225 Fm-3m 0.4025,0.4025,0.4025,90,90,90 close-packed structure - 2.92 X 8328
Al-Mn Mn0.5 Al0.5 ht1 W,cI2,229 Im-3m 0.3063,0.3063,0.3063,90,90,90 b.c.c. family - 4.73 X 52432
Al-Mn Mn0.56 Al0.44 ht2 Mg,hP2,194 P63/mmc 0.27009,0.27009,0.43741,90,90,120 close-packed structure - 5.12 X 46682
Al-Mn Mn0.7 Al0.3 ht1 Mn,cP20,213 P4132 0.6413,0.6413,0.6413,90,90,90 - - 5.86 A 1334
Al-Mn Mn1.39 Al0.61 m CuAu,tP2,123 P4/mmm 0.278,0.278,0.3592,90,90,90 close-packed structure - 5.55 X 21265
Al-Mn Mn3 Al10 Mn3 Al10,hP26,194 P63/mmc 0.7546,0.7546,0.7895,90,90,120 - - 3.71 X 35977
Al-Mn Mn3.85 Al11 rt Mn4 Al11,aP15,2 P-1 0.5051,0.5095,0.8879,74.92,89.35,79.53 - - 3.89 X 13065
Al-Mn Mn53.3 Al230.8 rt Mn52 (Mn0.1Al0.9 )14Al218 ,hP586,176 P63/m 2.8382,2.8382,1.2389,90,90,120 - - 3.52 X 33273
Al-Mn Mn55 Al226.58 rt Mn55 Al226.58 ,hP574,194 P63/mmc 1.998,1.998,2.4673,90,90,120 - black 3.56 X 22155
Al-Mn Mn8 Al39 Mn8 Al39,cP564,198 P213 2.0516,2.0516,2.0516,90,90,90 - - 3.44 X 31286
Al-Mn Mn8.97 Al30.03 ht Mn6 (Mn0.5 Al0.5)8Al25 ,oP156,62 Pnma 1.4883,1.2447,1.256,90,90,90 - gray silver 3.72 X 29831
Al-Mn Mn9.82 Al15.68 rt Cr4.5(Cr0.56 Al0.44 )9Al12,hR78,160 R3m 1.2667,1.2667,0.7942,90,90,120 γ-brass - 4.35 A 23881
Al-Mo MoAl12 WAl12,cI26,204 Im-3 0.75815,0.75815,0.75815,90,90,90 - - 3.20 X 2098
Al-Mo MoAl3 ht MoAl3,mS32,12 C12/m1 1.6396,0.3594,0.8386,90,101.88,90 close-packed structure - 4.86 X 25219
Al-Mo MoAl4 ht WAl4,mS30,8 C1m1 0.5255,1.7768,0.5225,90,100.88,90 - - 4.24 X 2116
Al-Mo MoAl5 ht1 MoAl5,hP60,150 P321 0.4933,0.4933,4.398,90,90,120 close-packed structure - 4.14 X 25219
Al-Mo MoAl5 ht2 WAl5,hP12,182 P6322 0.4912,0.4912,0.886,90,90,120 close-packed structure - 4.14 X 25219
Al-Mo MoAl5 rt MoAl5,hR36,167 R-3c 0.4951,0.4951,2.623,90,90,120 close-packed structure - 4.13 X 25219
Al-Mo MoAl7 *,m**,* - 0.512,1.3,1.35,90,95.,90 - - - N 1251
Al-Mo Mo0.01 Al0.99 Cu,cF4,225 Fm-3m 0.4043,0.4043,0.4043,90,90,90 close-packed structure - 2.78 X 4825
Al-Mo Mo0.9Al3.1 ht Cr3Si,cP8,223 Pm-3n 0.4945,0.4945,0.4945,90,90,90 Frank-Kasper phase - 4.67 X 25219
Al-Mo Mo3 Al Cr3Si,cP8,223 Pm-3n 0.4939,0.4939,0.4939,90,90,90 Frank-Kasper phase - 8.68 X 46392
Al-Mo Mo3 Al8 Mo3 Al8,mS22,12 C12/m1 0.9164,0.3639,1.004,90,100.5,90 close-packed structure - 5.08 X 1786
Al-Mo Mo4 Al17 Mo4 Al17,mS84,5 C121 0.9158,0.49323,2.8935,90,96.71,90 - - 4.31 X 31205
Al-Mo Mo5 Al22 ht Mo5 Al22,oF216,43 Fdd2 0.9161,7.382,0.4933,90,90,90 - - 4.27 X 31205
Al-N AlN 165R *,hR*,* - 0.307,0.307,41.415,90,90,120 - - - N 14615
Al-N AlN hp NaCl,cF8,225 Fm-3m 0.3956,0.3956,0.3956,90,90,90 rocksalt family black 4.40 X 27503
Al-N AlN rt ZnO,hP4,186 P63mc 0.311,0.311,0.498,90,90,120 adamantane structure white 3.26 X 11020
Al-Nb NbAl3 TiAl3,tI8,139 I4/mmm 0.38,0.38,0.875,90,90,90 close-packed structure - 4.57 X 47352
Al-Nb Nb0.82 Al0.18 W,cI2,229 Im-3m 0.3282,0.3282,0.3282,90,90,90 b.c.c. family - 7.61 X 6718
Al-Nb Nb2 Al Ta2Al,tP30,136 P42/mnm 0.9957,0.9957,0.5167,90,90,90 Frank-Kasper phase - 6.90 X 1467
Al-Nb Nb3.16 Al0.84 Cr3Si,cP8,223 Pm-3n 0.51907,0.51907,0.51907,90,90,90 Frank-Kasper phase - 7.51 X 37369
Al-Nd NdAl DyAl,oP16,57 Pbcm 0.5943,1.1744,0.5731,90,90,90 - - 5.69 A 56977
Al-Nd NdAl2 MgCu2,cF24,227 Fd-3m 0.8,0.8,0.8,90,90,90 Friauf-Laves phase - 5.14 X 14331
Al-Nd NdAl3 rt Mg3 Cd,hP8,194 P63/mmc 0.647,0.647,0.4603,90,90,120 close-packed structure - 4.48 X 3739
Al-Nd NdAl4 ht BaAl4,tI10,139 I4/mmm 0.433,0.433,1.003,90,90,90 - - 4.45 A 1523
Al-Nd Nd2 Al Co2Si-b,oP12,62 Pnma 0.66825,0.52342,0.97321,90,90,90 - - 6.16 X 56791
Al-Nd Nd3 Al rt Mg3 Cd,hP8,194 P63/mmc 0.6968,0.6968,0.5407,90,90,120 close-packed structure - 6.72 A 56977
Al-Nd Nd3 Al11 rt La3Al11,oI28,71 Immm 0.4362,1.001,1.295,90,90,90 - - 4.28 A 28319
Al-Ni NiAl3 m *,oP32,53 Pmna 0.64,0.756,0.956,90,90,90 - - - N 5752
Al-Ni NiAl3 Fe3C-b,oP16,62 Pnma 0.65982,0.73515,0.48021,90,90,90 - - 3.98 X 135
Al-Ni Ni0.077 Al0.923 Cu,cF4,225 Fm-3m 0.4025,0.4025,0.4025,90,90,90 close-packed structure - 3.00 X 5752
Al-Ni Ni0.4 Al0.6 ht W,cI2,229 Im-3m 0.286,0.286,0.286,90,90,90 b.c.c. family - 5.63 X 24836
Al-Ni Ni0.67 Al tf CsCl,cP2,221 Pm-3m 0.284,0.284,0.284,90,90,90 b.c.c. family - 4.81 X 24836
Al-Ni Ni0.67 Al0.33 m Cu,cF4,225 Fm-3m 0.355,0.355,0.355,90,90,90 close-packed structure - 7.16 X 48506
Al-Ni Ni0.82 Al rt CsCl,cP2,221 Pm-3m 0.2866,0.2866,0.2866,90,90,90 b.c.c. family blue gray 5.30 X 5995
Al-Ni Ni0.88 Al0.12 Cu,cF4,225 Fm-3m 0.354,0.354,0.354,90,90,90 close-packed structure - 8.22 X 44595
Al-Ni Ni1.3 Al0.7 m CuAu,tP2,123 P4/mmm 0.26941,0.26941,0.3227,90,90,90 close-packed structure - 6.75 X 54229
Al-Ni Ni2Al3 Ni2Al3,hP5,164 P-3m1 0.40533,0.40533,0.49038,90,90,120 - - 4.72 X 58175
Al-Ni Ni3Al rt Cu3Au,cP4,221 Pm-3m 0.3567,0.3567,0.3567,90,90,90 close-packed structure - 7.43 X 55186
Al-Ni Ni3Al4 Ni3Ga4,cI112,230 Ia-3d 1.1408,1.1408,1.1408,90,90,90 - - 5.08 X 22406
Al-Ni Ni5Al3 rt Pt5Ga3,oS16,65 Cmmm 0.6727,0.7475,0.3732,90,90,90 close-packed structure - 6.63 X 20296
Al-Np NpAl2 MgCu2,cF24,227 Fd-3m 0.779,0.779,0.779,90,90,90 Friauf-Laves phase - 8.18 X 19137
Al-Np NpAl3 Cu3Au,cP4,221 Pm-3m 0.4269,0.4269,0.4269,90,90,90 close-packed structure - 6.79 X 28977
16 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Np NpAl4 UAl4,oI20,74 Imma 0.44036,0.6226,1.37219,90,90,90 - - 6.09 X 53014


Al-O AlO ht *,cP*,* - 0.567,0.567,0.567,90,90,90 - - - N 615
Al-O Al2O ht *,cP*,* - 0.498,0.498,0.498,90,90,90 - - - N 615
Al-O Al2O2.67 Al2O2.67 ,hP6,194 P63 /mmc 0.3112,0.3112,0.4988,90,90,120 - - 3.84 X 50221
Al-O Al2O3 hex1 *,h**,* - 0.5569,0.5569,2.2751,90,90,120 - - - N 917
Al-O Al2O3 hex2 *,hP90,194 P63 /mmc 0.84,0.84,1.365,90,90,120 - - - N 342
Al-O Al2O3 hex3 *,hP*,* - 0.523,0.523,0.706,90,90,120 - - - N 494
Al-O Al2O3 hex4 *,hP*,* - 0.56,0.56,1.367,90,90,120 - - - N 494
Al-O Al2O3 hex5 *,hP*,* - 0.498,0.498,1.352,90,90,120 - - - N 494
Al-O Al2O3 hp1 Rh2S3,oP20,60 Pbcn 0.6393,0.4362,0.4543,90,90,90 - - 5.35 X 43668
Al-O Al2O3 ht Al2O3,tP112,115 P-4m2 0.5611,0.5611,2.445,90,90,90 - - 3.52 X 42808
Al-O Al2O3 mon Ga2O3,mS20,12 C12/m1 1.1795,0.291,0.5621,90,103.79,90 - - 3.61 X 31566
Al-O Al2O3 orth Fe2O3,oP40,33 Pna21 0.48437,0.833,0.89547,90,90,90 - - 3.75 X 33340
Al-O Al2O3 rhom Al2O3,hR30,167 R-3c 0.47617,0.47617,1.2999,90,90,120 corundum colorless 3.98 X 50785
Al-O Al2O3 tet *,hP*,* - 0.553,0.553,0.716,90,90,120 - - - N 494
Al-O Al2.67 O4 cub Fe3O4,cF56,227 Fd-3m 0.7948,0.7948,0.7948,90,90,90 spinel family - 3.60 X 23892
Al-O Al2.67 O4 hex Al2.67 O4,hP44,186 P63 mc 0.5544,0.5544,0.9024,90,90,120 - - 3.76 X 5779
Al-O Al2.67 O4 ht Al2.67 O4,cF128,227 Fd-3m 0.7914,0.7914,0.7914,90,90,90 - colorless 3.65 X 24519
Al-O Al2.67 O4 rt Al2.67 O4,tI36,141 I41/amd 0.5616,0.5616,0.7836,90,90,90 - - 3.66 X 42808
Al-O Al2.67 O4 tet Al2.67 O4,tP84,115 P-4m2 0.5599,0.5599,2.3657,90,90,90 - - 3.66 X 23868
Al-Os OsAl CsCl,cP2,221 Pm-3m 0.3005,0.3005,0.3005,90,90,90 b.c.c. family golden 13.29 X 1282
Al-Os OsAl2 MoSi2,tI6,139 I4/mmm 0.3162,0.3162,0.8302,90,90,90 b.c.c. family grayish 9.77 X 2524
Al-Os Os2Al3 Os2Al3,tI10,139 I4/mmm 0.3106,0.3106,1.4184,90,90,90 b.c.c. family grayish 11.20 X 2524
Al-Os Os4Al13 Os4Al13,mS34,12 C12/m1 1.764,0.4228,0.7773,90,115.15,90 - gray 7.03 X 2124
Al-P AlP hp1 NiAs,hP4,194 P63 /mmc 0.3466,0.3466,0.5571,90,90,120 AlB2 family - 3.32 X 28886
Al-P AlP rt ZnS,cF8,216 F-43m 0.5467,0.5467,0.5467,90,90,90 adamantane structure green pea 2.36 X 1935
Al-Pd PdAl ht CsCl,cP2,221 Pm-3m 0.30532,0.30532,0.30532,90,90,90 b.c.c. family - 7.78 X 6192
Al-Pd PdAl rt Al+ FeSi,cP8,198 P213 0.4859,0.4859,0.4859,90,90,90 - - 7.72 X 2058
Al-Pd PdAl rt PdAl,hR78,148 R-3 1.5659,1.5659,0.5251,90,90,120 - - 7.75 X 10755
Al-Pd PdAl2 m CaF2,cF12,225 Fm-3m 0.58,0.58,0.58,90,90,90 fluorite family - 5.46 X 12436
Al-Pd PdAl4 m *,o**,* - 1.184,1.7729,2.2505,90,90,90 - - - N 14499
Al-Pd PdAl4 rt *,hP*,182 P6322 1.3086,1.3086,0.9631,90,90,120 - - - N 38907
Al-Pd Pd0.85 Al0.15 Cu,cF4,225 Fm-3m 0.3871,0.3871,0.3871,90,90,90 close-packed structure - 10.82 X 11627
Al-Pd Pd0.98 Al3.02 ht *,oP*,33 Pna21 2.3402,1.6612,1.23,90,90,90 - - - N 43161
Al-Pd Pd1.1 Al2.9 ht *,oS*,38 Amm2 5.7,1.68,2.35,90,90,90 - - - N 38907
Al-Pd Pd2Al Co2Si-b,oP12,62 Pnma 0.5407,0.4061,0.7769,90,90,90 - - 9.34 X 1843
Al-Pd Pd2Al3 Ni2Al3,hP5,164 P-3m1 0.4219,0.4219,0.5161,90,90,120 - - 6.13 X 15276
Al-Pd Pd3Al rt *,oP24,26 Pmc21 0.40281,1.5804,0.54048,90,90,90 - - 10.02 N 55007
Al-Pd Pd5Al rt Pd5Al,oP24,62 Pnma 1.0718,0.39991,0.80839,90,90,90 - gray 10.72 X 49570
Al-Pd Pd5Al3 ht Rh5Ge3,oP16,55 Pbam 0.535,1.041,0.403,90,90,90 - - 9.07 X 996
Al-Pd Pd8Al21 rt Pt8Al21,tI116,88 I41/a 1.2962,1.2962,1.0684,90,90,90 - - 5.25 X 21293
Al-Pr PrAl cub CsCl,cP2,221 Pm-3m 0.382,0.382,0.382,90,90,90 b.c.c. family - 5.00 X 2051
Al-Pr PrAl ht DyAl,oP16,57 Pbcm 0.597,1.177,0.573,90,90,90 - - 5.54 A 3390
Al-Pr PrAl rt CeAl,oS16,63 Cmcm 0.9238,0.7652,0.5681,90,90,90 - - 5.55 A 50560
Al-Pr PrAl2 MgCu2,cF24,227 Fd-3m 0.80323,0.80323,0.80323,90,90,90 Friauf-Laves phase - 5.00 X 43109
Al-Pr PrAl3 rt Mg3Cd,hP8,194 P63 /mmc 0.6511,0.6511,0.4605,90,90,120 close-packed structure - 4.36 X 3739
Al-Pr PrAl4 ht BaAl4,tI10,139 I4/mmm 0.437,0.437,1.014,90,90,90 - - 4.27 A 2051
Al-Pr Pr2Al Co2Si-b,oP12,62 Pnma 0.677,0.5259,0.9659,90,90,90 - - 5.96 A 50560
Al-Pr Pr3Al ht Cu3Au,cP4,221 Pm-3m 0.4962,0.4962,0.4962,90,90,90 close-packed structure - 6.11 X 3292
Al-Pr Pr3Al rt Mg3Cd,hP8,194 P63 /mmc 0.7039,0.7039,0.5454,90,90,120 close-packed structure - 6.38 A 50560
Al-Pr Pr3Al11 rt La3Al11,oI28,71 Immm 0.4376,1.0023,1.2966,90,90,90 - - 4.20 A 50560
Al-Pt PtAl ht CsCl,cP2,221 Pm-3m 0.304,0.304,0.304,90,90,90 b.c.c. family - 13.13 X 19044
Al-Pt PtAl rt FeSi,cP8,198 P213 0.4866,0.4866,0.4866,90,90,90 - gray violet 12.80 X 1799
Al-Pt PtAl2 hp PbCl2,oP12,62 Pnma 0.7493,0.3216,0.7999,90,90,90 - - 8.58 A 58558
Al-Pt PtAl2 CaF2,cF12,225 Fm-3m 0.591,0.591,0.591,90,90,90 fluorite family brass 8.01 X 15281
Al-Pt PtAl4 m *,hP*,* - 1.3067,1.3067,0.9618,90,90,120 - - - N 15281
Al-Pt PtAl4 PtAl4,hP102,158 P3c1 1.3077,1.3077,0.96342,90,90,120 - - 6.35 X 50599
Al-Pt PtAl6 m *,oP*,* - 0.8318,1.2103,1.5762,90,90,90 - - - N 12629
Al-Pt Pt0.02 Al0.98 m Cu,cF4,225 Fm-3m 0.4044,0.4044,0.4044,90,90,90 close-packed structure - 3.05 X 8330
Al-Pt Pt0.91 Al0.09 Cu,cF4,225 Fm-3m 0.3906,0.3906,0.3906,90,90,90 close-packed structure - 20.06 X 11627
Al-Pt Pt2Al ht Co2Si-b,oP12,62 Pnma 0.54007,0.40547,0.78985,90,90,90 - - 16.02 X 9096
Al-Pt Pt2Al rt Pt2Ga,oP24,51 Pmma 1.6306,0.3919,0.5433,90,90,90 - - 15.96 A 9096
Al-Pt Pt2Al3 Ni2Al3,hP5,164 P-3m1 0.4208,0.4208,0.5172,90,90,120 - brass 9.86 X 1799
Al-Pt Pt2.84 Al1.16 ht2 Cu3Au,cP4,221 Pm-3m 0.3868,0.3868,0.3868,90,90,90 close-packed structure gray silver 16.80 X 33801
Al-Pt Pt3Al ht1 Ir3Si,tI16,140 I4/mcm 0.54713,0.54713,0.77747,90,90,90 close-packed structure - 17.47 A 20896
Al-Pt Pt3Al rt Pt3Ga,tP16,127 P4/mbm 0.54524,0.54524,0.782,90,90,90 close-packed structure - 17.49 X 33801
Al-Pt Pt3Al tet SrPb3,tP4,123 P4/mmm 0.3832,0.3832,0.3894,90,90,90 close-packed structure - 17.78 X 1560
Al-Pt Pt5Al21 Li21Si5,cF416,216 F-43m 1.923,1.923,1.923,90,90,90 γ-brass gray silver 5.76 A 2403
Al-Pt Pt5Al3 Rh5Ge3,oP16,55 Pbam 0.5402,1.0711,0.3949,90,90,90 - - 15.35 X 31804
Al-Pt Pt8Al21 Pt8Al21,tI116,88 I41/a 1.2949,1.2949,1.0659,90,90,90 - - 7.91 X 21293
Al-Pu PuAl2 MgCu2,cF24,227 Fd-3m 0.7874,0.7874,0.7874,90,90,90 Friauf-Laves phase - 8.11 X 1694
Al-Pu PuAl3 ht1 BaPb3,hR36,166 R-3m 0.615,0.615,2.1102,90,90,120 close-packed structure - 7.03 X 2480
Al-Pu PuAl3 ht2 PuAl3,hP24,194 P63 /mmc 0.610,0.610,1.447,90,90,120 close-packed structure - 6.94 X 839
Al-Pu PuAl3 ht3 Cu3Au,cP4,221 Pm-3m 0.4262,0.4262,0.4262,90,90,90 close-packed structure - 6.97 X 3304
Al-Pu PuAl3 rt BaPb3,hR36,166 R-3m 0.61502,0.61502,2.11744,90,90,120 close-packed structure - 7.00 A 3304
Al-Pu Pu0.5 Al0.5 ht Mn,cI58,217 I-43m 1.0769,1.0769,1.0769,90,90,90 - - 10.45 A 1694
Al-Pu Pu0.75 Al0.25 ht Cu,cF4,225 Fm-3m 0.45,0.45,0.45,90,90,90 close-packed structure - 13.83 X 1694
Al-Pu Pu0.89 Al0.11 ht3 Cu,cF4,225 Fm-3m 0.4559,0.4559,0.4559,90,90,90 close-packed structure - 15.43 X 1694
Handbook of Inorganic Substances – Edition 2015 : Data 17

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Pu Pu0.9 Al4 UAl4,oI20,74 Imma 0.4396,0.6266,1.3708,90,90,90 - - 5.76 X 3304


Al-Pu Pu0.9515 Al0.0485 ht5 W,cI2,229 Im-3m 0.36493,0.36493,0.36493,90,90,90 b.c.c. family - 15.96 X 2277
Al-Pu Pu3Al ht SrPb3,tP4,123 P4/mmm 0.4499,0.4499,0.4538,90,90,90 close-packed structure - 13.72 X 1694
Al-Re ReAl rt CsCl,cP2,221 Pm-3m 0.288,0.288,0.288,90,90,90 b.c.c. family - 14.82 X 1282
Al-Re ReAl12 WAl12,cI26,204 Im-3 0.7527,0.7527,0.7527,90,90,90 - - 3.97 X 2098
Al-Re ReAl3 *,mP*,* - 0.4955,3.9764,0.518,90,99.55,90 - - - N 43719
Al-Re ReAl6 MnAl6,oS28,63 Cmcm 0.7599,0.6606,0.9029,90,90,90 - - 5.10 X 28341
Al-Re Re1.8 Al2.2 Re(Re0.4 Al0.6 )2Al,tP4,123 P4/mmm 0.30785,0.30785,0.59515,90,90,90 b.c.c. family - 11.62 X 17138
Al-Re Re14 Al54.75 Re14 Al54.75 ,aP71,2 P-1 0.5159,0.9106,2.3755,100.94,90.30,93.00 - - 6.20 X 19908
Al-Re Re2Al CuZr2,tI6,139 I4/mmm 0.29802,0.29802,0.95796,90,90,90 close-packed structure - 15.59 X 17138
Al-Re Re24 Al5 Ti5Re24,cI58,217 I-43m 0.958,0.958,0.958,90,90,90 - - 17.39 A 1751
Al-Re Re4Al11 Mn4 Al11,aP15,2 P-1 0.5172,0.5154,0.8959,74.83,90.43,80.24 - - 7.63 X 28341
Al-Re Re8Al32.07 rt Re8Al32.07 ,aP43,2 P-1 0.5153,0.90782,1.3727,96.852,95.521,92.392 - gray silver 6.17 X 49719
Al-Rh RhAl CsCl,cP2,221 Pm-3m 0.29806,0.29806,0.29806,90,90,90 b.c.c. family - 8.15 X 16441
Al-Rh RhAl2.63 ht RhAl2.63 ,cP54,195 P23 0.76692,0.76692,0.76692,90,90,90 - - 5.12 X 33859
Al-Rh RhAl3 orth1 *,o**,* - 1.64,2.38,3.28,90,90,90 - - - N 37355
Al-Rh RhAl3 orth2 *,oP*,62 Pnma 2.35,1.68,1.23,90,90,90 - - - N 53839
Al-Rh Rh0.925 Al0.075 Cu,cF4,225 Fm-3m 0.38017,0.38017,0.38017,90,90,90 close-packed structure - 11.75 X 24851
Al-Rh Rh2Al5 rt Co2Al5,hP28,194 P63/mmc 0.7893,0.7893,0.7854,90,90,120 - - 5.34 X 3419
Al-Rh Rh2Al9 Co2Al9,mP22,14 P121/c1 0.63501,0.64266,0.87181,90,94.809,90 - gray 4.20 X 45740
Al-Rh Rh3Al7 ht *,mP*,* - 0.6595,0.3808,1.0309,90,102.42,90 - - - N 36695
Al-Rh Rh4Al13 Fe4Al13,mS102,12 C12/m1 1.636,0.805,1.279,90,107.77,90 - - 4.74 A 16149
Al-Rh Rh99 Al343 Rh99 Al343,oS884,38 Amm2 1.68,3.24,2.35,90,90,90 - - 5.05 X 53839
Al-Ru RuAl CsCl,cP2,221 Pm-3m 0.29916,0.29916,0.29916,90,90,90 b.c.c. family - 7.94 X 27072
Al-Ru RuAl12 *,cP*,* - 0.812,0.812,0.812,90,90,90 - - - N 1974
Al-Ru RuAl2 rt orth TiSi2,oF24,70 Fddd 0.4717,0.8012,0.8785,90,90,90 - - 6.20 X 2978
Al-Ru RuAl2 rt tet MoSi2,tI6,139 I4/mmm 0.311,0.311,0.638,90,90,90 b.c.c. family - 8.34 A 1974
Al-Ru RuAl2.5 ht FeAl2.8 ,oS24,63 Cmcm 0.78,0.66,0.42,90,90,90 - - 5.18 A 41499
Al-Ru RuAl3 TiNi3,hP16,194 P63/mmc 0.481,0.481,0.784,90,90,120 close-packed structure - 7.70 A 1974
Al-Ru RuAl6 MnAl6,oS28,63 Cmcm 0.74882,0.65559,0.89605,90,90,90 - - 3.97 X 3872
Al-Ru Ru0.1 Al0.9 Cu,cF4,225 Fm-3m 0.402,0.402,0.402,90,90,90 close-packed structure - 3.52 X 7747
Al-Ru Ru2Al3 ht tet Os2Al3,tI10,139 I4/mmm 0.3079,0.3079,1.433,90,90,90 b.c.c. family - 6.92 A 2978
Al-Ru Ru2Al3 ht trig Ni2Al3,hP5,164 P-3m1 0.405,0.405,0.494,90,90,120 - - 6.70 A 1974
Al-Ru Ru4Al13 Fe4Al13,mS102,12 C12/m1 1.586,0.8192,1.2742,90,107.77,90 - - 4.77 X 57060
Al-S Al0.67 S ht ZnO,hP4,186 P63mc 0.3579,0.3579,0.5829,90,90,120 adamantane structure - 2.58 A 378
Al-S Al2S3 hex In2Se3,hP30,169 P61 0.6491,0.6491,1.7169,90,90,120 - - 2.39 X 28213
Al-S Al2S3 hp-ht In2S3,tI80,141 I41/amd 0.7026,0.7026,2.9811,90,90,90 - orange 2.71 X 5446
Al-S Al2S3 ht Al2O3,hR30,167 R-3c 0.647,0.647,1.727,90,90,120 - - 2.39 A 434
Al-S Al2S3 rt Al2S3,hP30,169 P61 0.6438,0.6438,1.7898,90,90,120 - colorless 2.33 X 28213
Al-S Al2.67 S4 hp2-ht Fe3O4,cF56,227 Fd-3m 0.994,0.994,0.994,90,90,90 spinel family yellow 2.71 X 7855
Al-Sb AlSb hp1 TlF,oF8,69 Fmmm 0.5142,0.5391,0.5894,90,90,90 - - 6.05 X 16111
Al-Sb AlSb ZnS,cF8,216 F-43m 0.6135,0.6135,0.6135,90,90,90 adamantane structure - 4.28 X 13630
Al-Sb Al0.5 Sb0.5 hp2 Sn,tI4,141 I41/amd 0.5375,0.5375,0.2892,90,90,90 - - 5.91 X 1998
Al-Sc ScAl rt *,oP*,* - 0.31263,0.50299,0.98945,90,90,90 - - - N 18093
Al-Sc ScAl stab CsCl,cP2,221 Pm-3m 0.3388,0.3388,0.3388,90,90,90 b.c.c. family - 3.07 X 18093
Al-Sc ScAl2 MgCu2,cF24,227 Fd-3m 0.76,0.76,0.76,90,90,90 Friauf-Laves phase yellowish 2.99 X 17170
Al-Sc ScAl3 rt Cu3Au,cP4,221 Pm-3m 0.4101,0.4101,0.4101,90,90,90 close-packed structure gray 3.03 X 18093
Al-Sc Sc0.03 Al0.97 Cu,cF4,225 Fm-3m 0.40653,0.40653,0.40653,90,90,90 close-packed structure - 2.72 X 10200
Al-Sc Sc2Al Co1.75 Ge,hP6,194 P63/mmc 0.4888,0.4888,0.6166,90,90,120 AlB2 family - 3.04 X 4723
Al-Se Al0.67 Se rt ZnO,hP4,186 P63mc 0.389,0.389,0.63,90,90,120 adamantane structure white 3.90 X 648
Al-Se Al2Se 3 Ga2S3,mS20,9 C1c1 1.168,0.6733,0.7329,90,121.12,90 - - 3.92 A 2907
Al-Se Al2.67 Se4 hp-ht Fe3O4,cF56,227 Fd-3m 1.045,1.045,1.045,90,90,90 spinel family - 4.52 X 7855
Al-Si Al0.82 Si0.18 Cu,cF4,225 Fm-3m 0.4009,0.4009,0.4009,90,90,90 close-packed structure - 2.80 X 18431
Al-Sm SmAl cub CsCl,cP2,221 Pm-3m 0.3739,0.3739,0.3739,90,90,90 b.c.c. family - 5.64 X 2672
Al-Sm SmAl orth DyAl,oP16,57 Pbcm 0.5891,1.1596,0.5684,90,90,90 - - 6.07 A 48267
Al-Sm SmAl2 MgCu2,cF24,227 Fd-3m 0.79441,0.79441,0.79441,90,90,90 Friauf-Laves phase - 5.42 X 29387
Al-Sm SmAl3 rt Mg3 Cd,hP8,194 P63/mmc 0.6388,0.6388,0.4607,90,90,120 close-packed structure - 4.72 A 48900
Al-Sm SmAl3.67 ht BaAl4,tI10,139 I4/mmm 0.4281,0.4281,0.9906,90,90,90 - - 4.56 A 48900
Al-Sm SmAl4 m UAl4,oI20,74 Imma 0.444,0.638,1.362,90,90,90 - - 4.45 A 3636
Al-Sm Sm2 Al Co2Si-b,oP12,62 Pnma 0.6662,0.519,0.9625,90,90,90 - - 6.54 A 34323
Al-Sm Sm3 Al Cu3Au,cP4,221 Pm-3m 0.48571,0.48571,0.48571,90,90,90 close-packed structure - 6.93 X 48267
Al-Sm Sm3 Al11 rt La3Al11,oI28,71 Immm 0.4333,0.997,1.281,90,90,90 - - 4.49 A 3706
Al-Sn Al0.5 Sn0.5 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3181,0.3181,0.298,90,90,120 - - 4.63 X 2985
Al-Sn Al0.977 Sn0.023 Cu,cF4,225 Fm-3m 0.4041,0.4041,0.4041,90,90,90 close-packed structure - 2.93 X 14530
Al-Sr SrAl2 hp-ht MgCu2,cF24,227 Fd-3m 0.8325,0.8325,0.8325,90,90,90 Friauf-Laves phase - 3.26 X 15755
Al-Sr SrAl2 KHg2,oI12,74 Imma 0.4801,0.7905,0.7974,90,90,90 AlB2 family white silver3.11 X 15755
Al-Sr SrAl4 BaAl4,tI10,139 I4/mmm 0.4461,0.4461,1.1209,90,90,90 - - 2.91 X 32514
Al-Sr Sr5Al9 Sr5Al9,hR42,166 R-3m 0.5881,0.5881,3.571,90,90,120 - - 3.17 X 20705
Al-Sr Sr8Al7 Ba8Ga7,cP60,198 P213 1.2753,1.2753,1.2753,90,90,90 - - 2.85 X 15896
Al-Ta TaAl1.4 rt *,hP*,* - 3.214,3.214,1.341,90,90,120 - - - N 30172
Al-Ta TaAl1.5 rt *,aP69,* - 1.0433,1.0748,1.1078,63.19,89.55,82.4 - - - N 30172
Al-Ta TaAl3 TiAl3,tI8,139 I4/mmm 0.38437,0.38437,0.8546,90,90,90 close-packed structure gray silver 6.89 X 41585
Al-Ta Ta0.74 Al0.26 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9957,0.9957,0.5199,90,90,90 Frank-Kasper phase - 13.62 X 47058
Al-Ta Ta17 Al12 ht Mg17 Al12,cI58,217 I-43m 0.988,0.988,0.988,90,90,90 - - 11.71 A 2526
Al-Ta Ta22.4 Al20.6 Ta22 Al21,mP86,14 P121/c1 0.98786,0.99012,1.63873,90,116.465,90 - - 10.67 X 49290
Al-Ta Ta39 Al69 ht Ta39 Al69,cF444,216 F-43m 1.9153,1.9153,1.9153,90,90,90 - - 8.43 X 28741
Al-Ta Ta5Al3 stab Mn5 Si3,hP16,193 P63/mcm 0.77337,0.77337,0.52446,90,90,120 - - 12.05 A 13850
Al-Tb TbAl DyAl,oP16,57 Pbcm 0.583,1.137,0.562,90,90,90 - - 6.63 X 4272
18 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Tb TbAl2 MgCu2,cF24,227 Fd-3m 0.7889,0.7889,0.7889,90,90,90 Friauf-Laves phase - 5.76 X 7020


Al-Tb TbAl3 ht HoAl3,hR60,166 R-3m 0.6095,0.6095,3.596,90,90,120 close-packed structure - 5.16 A 49461
Al-Tb TbAl3 rt BaPb3,hR36,166 R-3m 0.6176,0.6176,2.1165,90,90,120 close-packed structure - 5.13 X 3594
Al-Tb TbAl4 UAl4,oI20,74 Imma 0.443,0.6261,1.3706,90,90,90 - - 4.66 A 3594
Al-Tb Tb2Al Co2Si-b,oP12,62 Pnma 0.6592,0.5113,0.944,90,90,90 - - 7.20 A 6013
Al-Tb Tb3Al stab Cu3Au,cP4,221 Pm-3m 0.4794,0.4794,0.4794,90,90,90 close-packed structure - 7.59 X 3665
Al-Tb Tb3Al2 Gd3Al2,tP20,102 P42nm 0.8255,0.8255,0.7568,90,90,90 - - 6.84 A 2669
Al-Tc TcAl12 WAl12,cI26,204 Im-3 0.75255,0.75255,0.75255,90,90,90 - - 3.29 X 2098
Al-Tc TcAl4 WAl4,mS30,8 C1m1 0.51,1.7,0.51,90,100.02,90 - - 4.71 A 1980
Al-Tc TcAl6 MnAl6,oS28,63 Cmcm 0.7629,0.65944,0.90011,90,90,90 - - 3.81 X 3354
Al-Tc Tc2Al CuZr2,tI6,139 I4/mmm 0.2977,0.2977,0.9476,90,90,90 close-packed structure - 8.82 A 2668
Al-Tc Tc2Al3 Ni2Al3,hP5,164 P-3m1 0.416,0.416,0.513,90,90,120 - - 5.98 A 1980
Al-Te Al0.67 Te m1 ZnS,cF8,216 F-43m 0.5949,0.5949,0.5949,90,90,90 adamantane structure brown red 4.60 X 22024
Al-Te Al2Te3 ht Al2Te3,mP40,14 P121/c1 0.7181,1.2848,1.4167,90,90.04,90 - yellow 4.44 X 33727
Al-Te Al2Te5 ht Al2Te5,mS14,12 C12/m1 1.35929,0.41527,0.98392,90,126.97,90 - black 5.18 X 32503
Al-Te Al2.67 Te4 rt *,mP8,4 P1211 0.4246,0.7189,1.3855,90,90.21,90 - orange red 4.57 P 22024
Al-Te Al5Te4 rt *,cP*,* - 0.6147,0.6147,0.6147,90,90,90 - - - N 21381
Al-Te Al7Te10 m Al7Te10,hR102,155 R32 1.4395,1.4395,1.7932,90,90,120 - red ruby 4.54 X 20924
Al-Th ThAl TlI,oS8,63 Cmcm 0.442,1.145,0.419,90,90,90 CrB(TlI)-FeB - 8.11 X 1504
Al-Th ThAl2 hp MgCu2,cF24,227 Fd-3m 0.797,0.797,0.797,90,90,90 Friauf-Laves phase - 7.50 X 19229
Al-Th ThAl2 AlB2,hP3,191 P6/mmm 0.4412,0.4412,0.4173,90,90,120 AlB2 family - 6.75 X 19229
Al-Th ThAl3 Mg3Cd,hP8,194 P63 /mmc 0.6499,0.6499,0.4626,90,90,120 close-packed structure - 6.14 X 9098
Al-Th Th0.0023 Al0.9977 Cu,cF4,225 Fm-3m 0.40493,0.40493,0.40493,90,90,90 close-packed structure - 2.75 X 226
Al-Th Th2Al CuAl2,tI12,140 I4/mcm 0.7618,0.7618,0.5862,90,90,90 - - 9.59 X 6743
Al-Th Th2Al3 ht *,tP20,* - 0.986,0.986,0.781,90,90,90 - - - N 1504
Al-Th Th2Al7 Th2Al7,oP18,55 Pbam 0.5874,1.1479,0.553,90,90,90 - - 5.82 X 4331
Al-Th Th3Al2 ht U3Si2,tP10,127 P4/mbm 0.8125,0.8125,0.4217,90,90,90 - - 8.95 X 693
Al-Ti TiAl prec TiAl,tP8,129 P4/nmm 0.4,0.4,0.76,90,90,90 - - 4.09 X 15953
Al-Ti TiAl rt CuAu,tP2,123 P4/mmm 0.28373,0.28373,0.40591,90,90,90 close-packed structure - 3.81 X 43649
Al-Ti TiAl2 ht ZrGa2,oS12,65 Cmmm 0.39591,1.20944,0.40315,90,90,90 close-packed structure - 3.51 X 24293
Al-Ti TiAl2 rt HfGa2,tI24,141 I41/amd 0.3971,0.3971,2.4313,90,90,90 close-packed structure - 3.53 X 37397
Al-Ti TiAl3 ht TiAl3,tI8,139 I4/mmm 0.38537,0.38537,0.85839,90,90,90 close-packed structure - 3.36 X 18752
Al-Ti TiAl3 m Cu3Au,cP4,221 Pm-3m 0.401,0.401,0.401,90,90,90 close-packed structure - 3.32 X 48368
Al-Ti TiAl3 rt TiAl3,tI32,139 I4/mmm 0.3875,0.3875,3.384,90,90,90 - - 3.37 X 41496
Al-Ti Ti0.12 Al0.88 Cu,cF4,225 Fm-3m 0.40397,0.40397,0.40397,90,90,90 close-packed structure - 2.97 X 49806
Al-Ti Ti0.4 Al0.6 m Cu,cF4,225 Fm-3m 0.4022,0.4022,0.4022,90,90,90 close-packed structure - 3.61 X 28469
Al-Ti Ti0.5 Al0.5 ht Mg,hP2,194 P63 /mmc 0.29064,0.29064,0.46667,90,90,120 close-packed structure - 3.64 X 43649
Al-Ti Ti0.72 Al1.28 ht CuAu,tP2,123 P4/mmm 0.28496,0.28496,0.3955,90,90,90 close-packed structure - 3.57 X 39267
Al-Ti Ti0.9 Al1.1 prec *,oP16,* - 0.4,0.57,1.13,90,90,90 - - - N 15953
Al-Ti Ti1.14 Al2.86 ht Ti(Ti0.14 Al0.86)Al2,tP28,123 P4/mmm 0.39053,0.39053,2.91963,90,90,90 - - 3.44 X 24293
Al-Ti Ti1.25 Al2.75 ht Ti(Ti0.25 Al0.75)Al2,tI16,139 I4/mmm 0.3923,0.3923,1.65349,90,90,90 - - 3.50 X 24293
Al-Ti Ti1.5 Al2.5 ht Ti(Ti0.5 Al0.5)Al2,oP4,47 Pmmm 0.39617,0.40262,0.40262,90,90,90 close-packed structure - 3.60 X 24293
Al-Ti Ti2Al prec *,h**,* - 0.298,0.298,1.895,90,90,120 - - - N 15953
Al-Ti Ti3Al5 rt *,tP32,127 P4/mbm 1.1293,1.1293,0.4038,90,90,90 - - 3.59 N 39267
Al-Ti Ti3.25 Al0.75 rt Mg3Cd,hP8,194 P63 /mmc 0.58193,0.58193,0.46639,90,90,120 close-packed structure - 4.27 X 44856
Al-Ti Ti83.5 Al16.5 ht *,hP*,* - 1.152,1.152,0.465,90,90,120 - - - N 1533
Al-Ti Ti9Al23 rt (Si) *,tI32,* - 0.3843,0.3843,3.3465,90,90,90 - - 3.53 N 2857
Al-Tm TmAl DyAl,oP16,57 Pbcm 0.577,1.124,0.556,90,90,90 - - 7.22 X 4341
Al-Tm TmAl2 MgCu2,cF24,227 Fd-3m 0.77757,0.77757,0.77757,90,90,90 Friauf-Laves phase - 6.30 X 2676
Al-Tm TmAl3 Cu3Au,cP4,221 Pm-3m 0.42,0.42,0.42,90,90,90 close-packed structure - 5.60 X 49461
Al-Tm Tm3 Al2 Zr3Al2,tP20,136 P42 /mnm 0.8094,0.8094,0.7452,90,90,90 - - 7.63 A 22219
Al-U UAl2 hp MgNi2,hP24,194 P63 /mmc 0.5165,0.5165,1.6083,90,90,120 Friauf-Laves phase - 10.44 A 30222
Al-U UAl2 rt MgCu2,cF24,227 Fd-3m 0.778,0.778,0.778,90,90,90 Friauf-Laves phase - 8.24 X 14224
Al-U UAl3 Cu3Au,cP4,221 Pm-3m 0.4266,0.4266,0.4266,90,90,90 close-packed structure - 6.82 X 42931
Al-U UAl4 rt UAl4,oI20,74 Imma 0.44014,0.62552,1.37279,90,90,90 - black 6.08 X 42931
Al-V VAl10 VAl10,cF176,227 Fd-3m 1.4492,1.4492,1.4492,90,90,90 - - 2.80 X 829
Al-V VAl3 TiAl3,tI8,139 I4/mmm 0.378,0.378,0.8322,90,90,90 close-packed structure - 3.68 X 16741
Al-V V0.68 Al0.32 W,cI2,229 Im-3m 0.3053,0.3053,0.3053,90,90,90 b.c.c. family - 5.05 X 44980
Al-V V3 Al hp1-ht *,t**,* - 0.6167,0.6167,0.9481,90,90,90 - - - N 7482
Al-V V3 Al hp2-ht *,hP*,* - 0.707,0.707,0.9565,90,90,120 - - - N 7482
Al-V V3 Al Cr3Si,cP8,223 Pm-3n 0.481,0.481,0.481,90,90,90 Frank-Kasper phase - 5.37 X 5578
Al-V V4 Al23 V4 Al23,hP54,194 P63 /mmc 0.7692,0.7692,1.704,90,90,120 - blue dark 3.14 X 1202
Al-V V5 Al8 Cu5Zn8,cI52,217 I-43m 0.9234,0.9234,0.9234,90,90,90 γ-brass - 3.97 X 10342
Al-V V7 Al45 V7 Al45,mS104,12 C12/m1 2.0827,0.76213,1.1081,90,106.97,90 - - 3.10 X 1077
Al-W WAl12 WAl12,cI26,204 Im-3 0.75803,0.75803,0.75803,90,90,90 - - 3.87 X 584
Al-W WAl2 hp CrSi2,hP9,180 P6222 0.47422,0.47422,0.66057,90,90,120 - black 9.21 X 50963
Al-W WAl4 WAl4,mS30,8 C1m1 0.52614,1.77457,0.52241,90,100.225,90 - - 6.06 X 54059
Al-W WAl5 WAl5,hP12,182 P6322 0.49020,0.49020,0.88570,90,90,120 close-packed structure - 5.74 X 657
Al-W W0.5 Al0.5 m W,cI2,229 Im-3m 0.3165,0.3165,0.3165,90,90,90 b.c.c. family - 11.04 X 45358
Al-W WxAl Cu,cF4,225 Fm-3m 0.40504,0.40504,0.40504,90,90,90 close-packed structure - 2.70 X 54059
Al-Y YAl ht CsCl,cP2,221 Pm-3m 0.3754,0.3754,0.3754,90,90,90 b.c.c. family - 3.64 X 3436
Al-Y YAl rt TlI,oS8,63 Cmcm 0.3884,1.1522,0.4385,90,90,90 CrB(TlI)-FeB - 3.92 X 3436
Al-Y YAl2 MgCu2,cF24,227 Fd-3m 0.78611,0.78611,0.78611,90,90,90 Friauf-Laves phase - 3.91 X 20229
Al-Y YAl3 ht1 BaPb3,hR36,166 R-3m 0.6204,0.6204,2.1184,90,90,120 close-packed structure - 3.59 X 3383
Al-Y YAl3 ht2 Cu3Au,cP4,221 Pm-3m 0.4323,0.4323,0.4323,90,90,90 close-packed structure - 3.49 X 3436
Al-Y YAl3 rt Mg3Cd,hP8,194 P63 /mmc 0.6276,0.6276,0.4582,90,90,120 close-packed structure - 3.61 X 3383
Al-Y YAlx rt Mg,hP2,194 P63 /mmc 0.363,0.363,0.5732,90,90,120 close-packed structure - 4.51 X 2815
Al-Y Y2 Al Co2Si-b,oP12,62 Pnma 0.6642,0.5084,0.9469,90,90,90 - - 4.25 X 3436
Handbook of Inorganic Substances – Edition 2015 : Data 19

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Y Y3 Al stab Cu3Au,cP4,221 Pm-3m 0.47845,0.47845,0.47845,90,90,90 close-packed structure - 4.45 X 41647


Al-Y Y3 Al2 Zr3Al2,tP20,136 P42/mnm 0.8239,0.8239,0.7648,90,90,90 - - 4.10 X 3436
Al-Y Y5 Al3 m Mn5 Si3,hP16,193 P63/mcm 0.8787,0.8787,0.6435,90,90,120 - - 4.06 X 20302
Al-Yb YbAl2 MgCu2,cF24,227 Fd-3m 0.785,0.785,0.785,90,90,90 Friauf-Laves phase - 6.23 X 13631
Al-Yb YbAl3 Cu3Au,cP4,221 Pm-3m 0.4202,0.4202,0.4202,90,90,90 close-packed structure - 5.68 X 37458
Al-Zn ZnAl2 prec ZnAl2,hP3,164 P-3m1 0.286,0.286,0.699,90,90,120 close-packed structure - 4.00 X 26487
Al-Zn Zn0.29 Al0.71 m (Zn0.29 Al0.71),hR3,166 R-3m 0.2852,0.2852,0.6785,90,90,120 close-packed structure - 3.97 X 3210
Al-Zn Zn0.4 Al0.6 Cu,cF4,225 Fm-3m 0.4012,0.4012,0.4012,90,90,90 close-packed structure - 4.36 X 26621
Al-Zr ZrAl rt TlI,oS8,63 Cmcm 0.3353,1.0866,0.4266,90,90,90 CrB(TlI)-FeB - 5.05 X 1721
Al-Zr ZrAl2 MgZn2,hP12,194 P63/mmc 0.5281,0.5281,0.8742,90,90,120 Friauf-Laves phase - 4.57 X 33161
Al-Zr ZrAl3 m Cu3Au,cP4,221 Pm-3m 0.4093,0.4093,0.4093,90,90,90 close-packed structure - 4.17 X 24835
Al-Zr ZrAl3 rt ZrAl3,tI16,139 I4/mmm 0.39993,0.39993,1.7283,90,90,90 close-packed structure - 4.14 X 25848
Al-Zr Zr0.022 Al0.978 Cu,cF4,225 Fm-3m 0.40508,0.40508,0.40508,90,90,90 close-packed structure - 2.84 X 4824
Al-Zr Zr0.94 Al0.06 rt m Mg,hP2,194 P63/mmc 0.3207,0.3207,0.5123,90,90,120 close-packed structure - 6.36 X 5380
Al-Zr Zr2Al rt hex Co1.75 Ge,hP6,194 P63/mmc 0.4913,0.4913,0.5914,90,90,120 AlB2 family - 5.63 X 54606
Al-Zr Zr2Al rt tet CuAl2,tI12,140 I4/mcm 0.684,0.684,0.55,90,90,90 - - 5.41 A 27326
Al-Zr Zr2Al3 Zr2Al3,oF40,43 Fdd2 0.9601,1.3906,0.5574,90,90,90 - - 4.70 X 1378
Al-Zr Zr3Al rt Cu3Au,cP4,221 Pm-3m 0.43917,0.43917,0.43917,90,90,90 close-packed structure - 5.89 X 23450
Al-Zr Zr3Al2 Zr3Al2,tP20,136 P42/mnm 0.763,0.763,0.6998,90,90,90 - - 5.34 X 1187
Al-Zr Zr4Al3 rt Zr4Al3,hP7,191 P6/mmm 0.5433,0.5433,0.539,90,90,120 Frank-Kasper phase - 5.37 X 1192
Al-Zr Zr5Al3 ht W5Si3,tI32,140 I4/mcm 1.1049,1.1049,0.5396,90,90,90 - - 5.42 X 1215
Al-Zr Zr5Al3 stab Mn5 Si3,hP16,193 P63/mcm 0.8184,0.8184,0.5702,90,90,120 - - 5.39 X 15493
Al-Zr Zr5Al4 ht Ti5Ga4,hP18,193 P63/mcm 0.8447,0.8447,0.581,90,90,120 AlB2 family - 5.22 X 15493
Am-As AmAs NaCl,cF8,225 Fm-3m 0.5876,0.5876,0.5876,90,90,90 rocksalt family - 10.41 X 9305
Am-B AmB4 UB4 ,tP20,127 P4/mbm 0.71085,0.71085,0.40101,90,90,90 - - 9.38 A 4754
Am-B AmB6 CaB6,cP7,221 Pm-3m 0.41154,0.41154,0.41154,90,90,90 - - 7.33 A 4754
Am-Be Be13 Am NaZn13,cF112,226 Fm-3c 1.0291,1.0291,1.0291,90,90,90 - - 4.39 A 9103
Am-Bi AmBi rt NaCl,cF8,225 Fm-3m 0.6334,0.6334,0.6334,90,90,90 rocksalt family - 11.81 X 20198
Am-Br AmBr2 SrBr2,tP30,85 P4/n 1.1592,1.1592,0.7121,90,90,90 - black 6.99 A 7524
Am-Br AmBr3 PuBr3,oS16,63 Cmcm 0.4064,1.2661,0.9144,90,90,90 - - 6.81 A 2624
Am-C Am2 C3 Pu2C3,cI40,220 I-43d 0.82757,0.82757,0.82757,90,90,90 - - 12.24 A 5384
Am-Cl AmCl2 PbCl2,oP12,62 Pnma 0.7573,0.4532,0.8963,90,90,90 - black 6.78 A 7524
Am-Cl AmCl3 UCl3,hP8,176 P63/m 0.7382,0.7382,0.4214,90,90,120 - pink 5.83 X 4995
Am-Cu Cu5Am CaCu5,hP6,191 P6/mmm 0.4958,0.4958,0.4175,90,90,120 - - 10.48 X 47403
Am-F AmF3 HoH3,hP24,165 P-3c1 0.7038,0.7038,0.722,90,90,120 - - 9.65 A 16438
Am-F AmF4 ZrF4 ,mS60,15 C12/c1 1.25,1.047,0.82,90,126.,90 - brown tan 7.32 A 614
Am-Fe AmFe 2 MgCu2,cF24,227 Fd-3m 0.7298,0.7298,0.7298,90,90,90 Friauf-Laves phase - 12.12 X 12480
Am-H AmH2 CaF2 ,cF12,225 Fm-3m 0.5348,0.5348,0.5348,90,90,90 fluorite family - 10.64 X 3168
Am-H AmH2.67 rt BiF3 ,cF16,225 Fm-3m 0.5338,0.5338,0.5338,90,90,90 b.c.c. family - 10.73 X 3168
Am-H AmH3 Na3As,hP8,194 P63/mmc 0.377,0.377,0.675,90,90,120 - - 9.83 A 3168
Am-I AmI2 EuI2 ,mP12,14 P121/c1 0.7677,0.8311,0.7925,90,98.46,90 - black 6.60 A 6782
Am-I AmI3 ht BiI3,hR24,148 R-3 0.7637,0.7637,2.091,90,90,120 - - 5.88 A 16170
Am-I AmI3 rt PuBr3,oS16,63 Cmcm 0.428,1.394,0.9974,90,90,90 - - 6.96 A 16170
Am-Ir AmIr2 MgCu2,cF24,227 Fd-3m 0.75655,0.75655,0.75655,90,90,90 Friauf-Laves phase - 19.25 X 26761
Am-Ir Amx Ir Cu,cF4,225 Fm-3m 0.38394,0.38394,0.38394,90,90,90 close-packed structure - 22.56 X 26761
Am-La La0.97 Am0.03 ht1 Cu,cF4,225 Fm-3m 0.52932,0.52932,0.52932,90,90,90 close-packed structure - 6.36 X 6011
Am-N AmN NaCl,cF8,225 Fm-3m 0.50225,0.50225,0.50225,90,90,90 rocksalt family - 13.47 X 50833
Am-Ni AmNi2 MgCu2,cF24,227 Fd-3m 0.699,0.699,0.699,90,90,90 Friauf-Laves phase - 14.02 X 6793
Am-O AmO NaCl,cF8,225 Fm-3m 0.5045,0.5045,0.5045,90,90,90 rocksalt family - 13.40 X 3626
Am-O AmO2 rt CaF2 ,cF12,225 Fm-3m 0.53736,0.53736,0.53736,90,90,90 fluorite family black 11.77 X 13607
Am-O Am2 O3 ht mon Sm2 O3,mS30,12 C12/m1 1.438,0.352,0.892,90,100.4,90 - - 11.98 A 4133
Am-O Am2 O3 ht trig La2O3,hP5,164 P-3m1 0.3818,0.3818,0.5975,90,90,120 - - 11.76 A 19190
Am-O Am2 O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.103,1.103,1.103,90,90,90 - - 10.57 X 513
Am-O Am2 O3.3 ht *,c**,* - 1.09,1.09,1.09,90,90,90 - - - N 4133
Am-Os AmOs2 MgZn2,hP12,194 P63/mmc 0.532,0.532,0.8849,90,90,120 Friauf-Laves phase - 19.09 A 6793
Am-P AmP NaCl,cF8,225 Fm-3m 0.57114,0.57114,0.57114,90,90,90 rocksalt family - 9.77 X 9305
Am-Pd Am0.05 Pd0.95 Cu,cF4,225 Fm-3m 0.393,0.393,0.393,90,90,90 close-packed structure - 12.39 X 22944
Am-Pd Am0.92 Pd3.08 Cu3Au,cP4,221 Pm-3m 0.4119,0.4119,0.4119,90,90,90 close-packed structure - 13.10 X 22944
Am-Pt AmPt2 MgCu2,cF24,227 Fd-3m 0.766,0.766,0.766,90,90,90 Friauf-Laves phase - 18.72 X 6793
Am-Pt AmPt5 hex CaCu5,hP6,191 P6/mmm 0.5307,0.5307,0.4407,90,90,120 - - 18.82 X 17550
Am-Pt AmPt5 orth *,oP72,* - 0.5319,0.909,2.642,90,90,90 - - 19.01 N 9952
Am-Pu Pu0.92 Am0.08 ht2 Pu,oF8,70 Fddd 0.31701,0.57225,1.0065,90,90,90 - - 17.75 X 50730
Am-Pu Pu0.92 Am0.08 rt Pu,mP16,11 P121/m1 0.613,0.4783,1.0891,90,101.87,90 - - 20.74 A 50730
Am-Pu Pu0.92 Am0.08 Cu,cF4,225 Fm-3m 0.46547,0.46547,0.46547,90,90,90 close-packed structure - 16.07 X 50730
Am-Rh AmRh2 MgCu2,cF24,227 Fd-3m 0.7548,0.7548,0.7548,90,90,90 Friauf-Laves phase - 13.87 X 9952
Am-Rh AmRh3 Cu3Au,cP4,221 Pm-3m 0.4098,0.4098,0.4098,90,90,90 close-packed structure - 13.31 X 9952
Am-S AmS NaCl,cF8,225 Fm-3m 0.5592,0.5592,0.5592,90,90,90 rocksalt family - 10.45 X 5983
Am-S AmS2 UAs2,tP6,129 P4/nmm 0.3938,0.3938,0.7982,90,90,90 - - 8.24 A 5985
Am-S Am2 S3 Cr3C2-b,oP20,62 Pnma 0.739,0.398,1.536,90,90,90 - black 8.56 A 5983
Am-S Am2.67 S4 Th3P 4,cI28,220 I-43d 0.84344,0.84344,0.84344,90,90,90 - - 8.60 A 5983
Am-Sb AmSb NaCl,cF8,225 Fm-3m 0.6241,0.6241,0.6241,90,90,90 rocksalt family - 9.97 X 8322
Am-Sb AmSb2 SmSb2,oS24,64 Cmce 0.618,0.605,1.759,90,90,90 - - 9.83 A 10957
Am-Sb Am4 Sb3 Th3P 4,cI28,220 I-43d 0.92392,0.92392,0.92392,90,90,90 - - 11.26 A 9305
Am-Se AmSe 2 UAs2,tP6,129 P4/nmm 0.4063,0.4063,0.8331,90,90,90 - - 9.68 A 8322
Am-Se Am3 Se4 Th3P 4,cI28,220 I-43d 0.8783,0.8783,0.8783,90,90,90 - - 10.24 A 8322
Am-Si AmSi FeB-b,oP8,62 Pnma 0.84,0.4064,0.6036,90,90,90 CrB(TlI)-FeB black 8.74 X 17105
Am-Si AmSi1.67 AlB2 ,hP3,191 P6/mmm 0.3871,0.3871,0.412,90,90,120 AlB2 family - 9.00 X 17105
Am-Si AmSi2 ThSi2,tI12,141 I41/amd 0.4015,0.4015,1.3733,90,90,90 - gray silver 8.98 X 17105
20 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Am-Si Am5Si3 W5Si3,tI32,140 I4/mcm 1.1419,1.1419,0.5538,90,90,90 - - 11.95 A 17105


Am-Te AmTe NaCl,cF8,225 Fm-3m 0.6176,0.6176,0.6176,90,90,90 rocksalt family - 10.45 X 30189
Am-Te AmTe1.73 UAs2,tP6,129 P4/nmm 0.4358,0.4358,0.9027,90,90,90 - black 8.98 X 12084
Am-Te AmTe3 NdTe3,oS16,63 Cmcm 0.4339,2.557,0.4339,90,90,90 - - 8.63 A 6707
Am-Te Am3 Te4 Th3P 4,cI28,220 I-43d 0.9392,0.9392,0.9392,90,90,90 - - 9.94 A 5387
Ar-H Ar[H2]2 hp calc MgZn2,hP12,194 P63 /mmc 0.5211,0.5211,0.8482,90,90,120 Friauf-Laves phase - 1.46 A 29378
Ar-Kr Kr0.5 Ar0.5 lt Cu,cF4,225 Fm-3m 0.5579,0.5579,0.5579,90,90,90 close-packed structure - 2.37 X 6948
Ar-O Ar[O2] hp2 Ar[O2],cP72,223 Pm-3n 0.57828,0.57828,0.57828,90,90,90 - - 2.47 X 55262
Ar-O Ar[O2] hp3 *,tI*,122 I-42d 1.16606,1.16606,1.1197,90,90,90 - - - N 55262
Ar-Xe Xe0.1 Ar0.9 tf Cu,cF4,225 Fm-3m 0.536,0.536,0.536,90,90,90 close-packed structure - 2.12 X 6948
Ar-Xe Xe0.78 Ar0.22 tf Cu,cF4,225 Fm-3m 0.608,0.608,0.608,90,90,90 close-packed structure - 3.29 X 6948
As-B BAs rt ZnS,cF8,216 F-43m 0.4777,0.4777,0.4777,90,90,90 adamantane structure - 5.22 X 2349
As-B B6As B6P,hR42,166 R-3m 0.6149,0.6149,1.1914,90,90,120 - colorless 3.57 X 20552
As-Ba BaAs2 BaAs2,mP18,7 P1c1 0.655,1.2532,0.8038,90,127.75,90 - black 5.48 X 43991
As-Ba BaAs3 SrAs3,mS16,12 C12/m1 1.0162,0.776,0.6015,90,113.55,90 - black 5.53 X 14353
As-Ba Ba2As La2Sb,tI12,139 I4/mmm 0.513,0.513,1.736,90,90,90 - black 5.08 X 10261
As-Ba Ba3As14 Sr3P14,mP34,14 P121/c1 0.6854,1.3639,1.21655,90,124.441,90 - black 5.17 X 10536
As-Ba Ba4As2.60 Th3P 4,cI28,220 I-43d 0.9973,0.9973,0.9973,90,90,90 - - 4.98 X 41566
As-Ba Ba5As3 Mn5Si3,hP16,193 P63 /mcm 0.949,0.949,0.79,90,90,120 - black 4.91 X 10261
As-Be BeAs2 ht *,tP48,92 P41212 0.7531,0.7531,1.5812,90,90,90 - - - N 10556
As-Be BeAs2 rt *,tP96,* - 0.753,0.753,3.165,90,90,90 - black - N 9974
As-Bk BkAs NaCl,cF8,225 Fm-3m 0.5826,0.5826,0.5826,90,90,90 rocksalt family - 10.81 X 13380
As-Br AsBr3 AsBr3,oP16,19 P212121 0.4331,1.024,1.22,90,90,90 - colorless 3.86 X 2878
As-Ca CaAs3 CaP 3,aP8,2 P-1 0.5866,0.5838,0.5921,70.04,80.16,75.85 - black 4.78 X 14353
As-Ca Ca16As11 Ca16Sb11,tP56,113 P-42 1m 1.1686,1.1686,1.0511,90,90,90 - - 3.39 A 33066
As-Ca Ca2As La2Sb,tI12,139 I4/mmm 0.463,0.463,1.556,90,90,90 - black 3.09 X 8649
As-Ca Ca2As2 Na2[O2],hP12,189 P-62m 0.7844,0.7844,0.5917,90,90,120 - black 3.63 X 10136
As-Ca Ca2As3 Ca2As3,mP40,13 P12/c1 1.1985,0.5806,1.8075,90,130.77,90 - gray 4.25 X 10286
As-Ca Ca5As3 Mn5Si3,hP16,193 P63 /mcm 0.843,0.843,0.675,90,90,120 - - 3.40 X 9443
As-Cd CdAs hp-ht CdSb,oP16,61 Pbca 0.5993,0.7819,0.8011,90,90,90 - - 6.63 X 10300
As-Cd CdAs2 m ZnAs2,mP24,14 P121/c1 0.9496,0.7769,0.8141,90,102.38,90 - - 5.94 A 17989
As-Cd CdAs2 rt CdAs2,tI12,98 I4122 0.7956,0.7956,0.4674,90,90,90 - - 5.89 X 5015
As-Cd Cd1.5 As ht3 CaF2,cF12,225 Fm-3m 0.64033,0.64033,0.64033,90,90,90 fluorite family - 6.16 X 7729
As-Cd Cd3As2 hp1 *,hP30,* - 0.794,0.794,1.282,90,90,120 - - - N 4613
As-Cd Cd3As2 ht1 Zn3As2,tP160,133 P42 /nbc 1.2707,1.2707,2.5634,90,90,90 - - 6.25 A 3902
As-Cd Cd3As2 ht2 Zn3P 2,tP40,137 P42 /nmc 0.8963,0.8963,1.268,90,90,90 fluorite family - 6.35 X 4447
As-Cd Cd3As2 rt Cd3As2,tI160,110 I41cd 1.267,1.267,2.548,90,90,90 - - 6.33 X 3801
As-Ce CeAs rt NaCl,cF8,225 Fm-3m 0.6054,0.6054,0.6054,90,90,90 rocksalt family - 6.44 X 58729
As-Ce CeAs2 NdAs2,mP12,14 P121/c1 0.4165,0.6871,1.0561,90,106.72,90 - - 6.65 A 5335
As-Ce Ce4As3 Th3P 4,cI28,220 I-43d 0.9053,0.9053,0.9053,90,90,90 - - 7.03 X 5335
As-Cf CfAs NaCl,cF8,225 Fm-3m 0.5809,0.5809,0.5809,90,90,90 rocksalt family - 11.04 X 13272
As-Cl AsCl3 AsBr3,oP16,19 P212121 0.4289,0.9466,1.1335,90,90,90 - - 2.62 X 15367
As-Cl AsCl5 AsCl5,oP12,59 Pmmn 0.7062,0.7603,0.6233,90,90,90 - yellow 2.50 X 40969
As-Cm CmAs NaCl,cF8,225 Fm-3m 0.5901,0.5901,0.5901,90,90,90 rocksalt family - 10.41 X 9305
As-Co CoAs ht NiAs,hP4,194 P63 /mmc 0.3562,0.3562,0.523,90,90,120 AlB2 family - 7.74 X 7221
As-Co CoAs rt FeAs,oP8,62 Pnma 0.52675,0.34623,0.5815,90,90,90 langisite gray silver 8.38 X 16897
As-Co CoAs2 rt CoSb2,mP12,14 P121/c1 0.59106,0.5868,0.59587,90,116.432,90 pyrite-marcasite family - 7.49 X 5748
As-Co CoAs3 CoAs3,cI32,204 Im-3 0.8195,0.8195,0.8195,90,90,90 skutterudite - 6.85 X 5683
As-Co Co2As ht Fe2P,hP9,189 P-62m 0.603,0.603,0.35325,90,90,120 Fe2P family - 8.63 X 24575
As-Co Co2As rt Co2As,hP36,189 P-62m 1.19867,1.19867,0.35875,90,90,120 - - 8.61 X 24575
As-Co Co2As3 ht *,hP*,* - 0.616,0.616,1.54,90,90,120 - - - N 895
As-Co Co3As ht *,hP*,* - 0.531,0.531,0.566,90,90,120 - - - N 895
As-Co Co5As2 ht Pd5Sb2,hP42,185 P63 cm 0.6797,0.6797,1.2423,90,90,120 - - 8.91 A 19095
As-Cr CrAs ht NiAs,hP4,194 P63 /mmc 0.3625,0.3625,0.5795,90,90,120 AlB2 family - 6.39 X 7221
As-Cr CrAs rt FeAs,oP8,62 Pnma 0.5649,0.3463,0.6212,90,90,90 AlB2 family - 6.94 X 5730
As-Cr CrAs2 hp OsGe2,mS12,12 C12/m1 0.8893,0.3273,0.7389,90,119.88,90 - - 7.19 A 7193
As-Cr Cr2As rt Cu2Sb,tP6,129 P4/nmm 0.3603,0.3603,0.6338,90,90,90 - - 7.22 X 2729
As-Cr Cr2As0.93 ht Fe2P,hP9,189 P-62m 0.6307,0.6307,0.3446,90,90,120 Fe2P family - 7.29 X 6167
As-Cr Cr3As2 *,tP*,* - 0.765,0.765,0.905,90,90,90 - - - N 1267
As-Cr Cr3.2 As0.8 Cr3Si,cP8,223 Pm-3n 0.4617,0.4617,0.4617,90,90,90 Frank-Kasper phase - 7.64 X 3662
As-Cr Cr4As3 rt Cr4As3,mS28,8 C1m1 1.3168,0.3542,0.9302,90,102.19,90 - - 6.78 X 5463
As-Cr Cr5As3 ht Yb5Sb3,oP32,62 Pnma 0.9263,0.7446,0.6393,90,90,90 - - 7.30 A 8708
As-Cs CsAs CsAs,hP36,189 P-62m 1.2197,1.2197,1.0463,90,90,120 - black 4.61 X 41106
As-Cs Cs2As3 Rb2P 3,oF40,69 Fmmm 0.9764,1.0373,1.5577,90,90,90 - blue steel 4.13 X 36726
As-Cs Cs3As Cu3P,hP24,185 P63 cm 1.0783,1.0783,1.1147,90,90,120 - gray dark 4.20 X 42489
As-Cs Cs3As11 Cs3As11,mS112,15 C12/c1 1.3245,1.5245,1.9372,90,95.29,90 - red 4.17 X 42385
As-Cs Cs3As7 ht Rb3P 7,cF284,225 Fm-3m 1.1692,1.1692,1.1692,90,90,90 - brown red 3.84 A 23091
As-Cs Cs3As7 rt Cs3As7,oP80,61 Pbca 1.0228,1.3176,2.1952,90,90,90 - black 4.15 X 41106
As-Cu Cu0.9 As0.1 rt Mg,hP2,194 P63 /mmc 0.259,0.259,0.424,90,90,120 algodonite - 8.72 X 892
As-Cu Cu0.935 As0.065 Cu,cF4,225 Fm-3m 0.3652,0.3652,0.3652,90,90,90 close-packed structure - 8.77 X 12635
As-Cu Cu2As rt Cu2Sb,tP6,129 P4/nmm 0.3788,0.3788,0.5942,90,90,90 - - 7.87 X 6907
As-Cu Cu2As3 *,o*50,* - 0.7654,1.15,1.284,90,90,90 paxite - - N 1416
As-Cu Cu2.5 As ht BiF3,cF16,225 Fm-3m 0.582,0.582,0.582,90,90,90 b.c.c. family - 7.88 X 6002
As-Cu Cu3As dom cub Cu3As,cI64,220 I-43d 0.9619,0.9619,0.9619,90,90,90 domeykite black 7.93 X 11082
As-Cu Cu3As dom trig HoH3,hP24,165 P-3c1 0.7143,0.7143,0.7324,90,90,120 domeykite-beta gray silver 8.18 X 2880
As-Cu Cu3As4 *,oI28,71 Immm 0.354,1.345,1.377,90,90,90 - gray - N 15708
As-Cu Cu5As2 rt Mg5Ga2,oI28,72 Ibam 0.5977,1.1577,0.5491,90,90,90 koutekite - 8.17 X 6002
As-Dy DyAs lt CoO,tI4,139 I4/mmm 0.4098,0.4098,0.5776,90,90,90 rocksalt family - 8.13 X 4826
Handbook of Inorganic Substances – Edition 2015 : Data 21

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Dy DyAs rt NaCl,cF8,225 Fm-3m 0.58165,0.58165,0.58165,90,90,90 rocksalt family gray 8.01 X 38931
As-Er ErAs rt NaCl,cF8,225 Fm-3m 0.57427,0.57427,0.57427,90,90,90 rocksalt family gray 8.49 X 27481
As-Eu EuAs2 *,oP12,62 Pnma 0.71433,0.69195,0.60486,90,90,90 - gray - N 6028
As-Eu EuAs3 SrAs3,mS16,12 C12/m1 0.9471,0.7598,0.5778,90,112.53,90 - black 6.52 X 14353
As-Eu Eu11 As10 *,oI*,* - 1.1255,1.1715,1.7394,90,90,90 - - - N 11597
As-Eu Eu16 As11 Ca16 Sb11,tP56,113 P-421m 1.20885,1.20885,1.104,90,90,90 - - 6.70 A 33066
As-Eu Eu2As2 rt Na2[O2],hP12,189 P-62m 0.8154,0.8154,0.6137,90,90,120 - black 6.40 X 10351
As-Eu Eu2As3 rt Ca2As3,mP40,13 P12/c1 1.2325,0.59559,1.86109,90,130.723,90 - gray 6.78 A 6028
As-Eu Eu3As2 Eu+ *,tI*,142 I41/acd 1.6464,1.6464,2.2246,90,90,90 - - - N 11597
As-Eu Eu3As4 Sr3As4,oF56,43 Fdd2 1.46419,1.76357,0.58866,90,90,90 - gray 6.60 X 12139
As-Eu Eu4As3 lt *,hR84,146 R3 1.30733,1.30733,1.56544,90,90,120 - - - N 12611
As-Eu Eu4As3 rt Th3P 4,cI28,220 I-43d 0.9214,0.9214,0.9214,90,90,90 - - 7.07 X 13003
As-Eu Eu5As3 ht Eu5As3,hP72,186 P63mc 1.5243,1.5243,0.72517,90,90,120 - - 6.72 X 11221
As-Eu Eu5As3 rt Mn5 Si3,hP16,193 P63/mcm 0.88646,0.88646,0.70811,90,90,120 - - 6.79 X 11221
As-Eu Eu5As4 Eu5As4,oS36,64 Cmce 1.5802,0.8021,0.8058,90,90,90 - - 6.89 X 11209
As-F AsF3 AsF3 ,oP16,33 Pna21 0.7018,0.5205,0.7315,90,90,90 - - 3.28 X 15367
As-F AsF5 SbCl5,hP12,194 P63/mmc 0.5771,0.5771,0.6414,90,90,120 - - 3.05 X 23012
As-Fe FeAs rt FeAs,oP8,62 Pnma 0.54401,0.33712,0.60259,90,90,90 westerveldite - 7.86 X 16897
As-Fe FeAs2 FeAs2,oP6,58 Pnnm 0.53001,0.59838,0.28821,90,90,90 löllingite - 7.47 X 20857
As-Fe Fe0.92 As0.08 rt W,cI2,229 Im-3m 0.2883,0.2883,0.2883,90,90,90 b.c.c. family - 7.95 X 1001
As-Fe Fe12 As5 hp Fe5(Fe 0.82 Ru0.18)7As5 ,hR51,146 R3 0.67855,0.67855,1.6301,90,90,120 - - 8.01 A 16383
As-Fe Fe2As Cu2Sb,tP6,129 P4/nmm 0.36379,0.36379,0.5983,90,90,90 - - 7.83 X 47707
As-Ga GaAs hp1 InSb,oP2,25 Pmm2 0.2482,0.483,0.2618,90,90,90 - - 7.65 A 22739
As-Ga GaAs hp2 GaAs,oI4,44 Imm2 0.479,0.492,0.2635,90,90,90 - - 7.74 X 22739
As-Ga GaAs hp3 *,oS*,63 Cmcm 0.5017,0.5325,0.4862,90,90,90 - - - N 35064
As-Ga GaAs ht-hp CuCl,cP16,205 Pa-3 0.6594,0.6594,0.6594,90,90,90 - - 6.70 X 35064
As-Ga GaAs rt ZnS,cF8,216 F-43m 0.5653,0.5653,0.5653,90,90,90 adamantane structure gray dark 5.32 X 18897
As-Ga GaAs trig CdTe,hP6,152 P3121 0.3883,0.3883,0.8657,90,90,120 rocksalt family - 6.37 X 33679
As-Gd GdAs rt NaCl,cF8,225 Fm-3m 0.58789,0.58789,0.58789,90,90,90 rocksalt family gray 7.59 X 38931
As-Ge GeAs hp GeP,tI4,107 I4mm 0.3712,0.3712,0.5832,90,90,90 - black 6.10 A 5397
As-Ge GeAs rt SiAs,mS24,12 C12/m1 1.5517,0.3775,0.9455,90,101.03,90 - - 5.41 X 14107
As-Ge GeAs2 GeAs2,oP24,55 Pbam 1.016,1.476,0.3728,90,90,90 - gray 5.29 X 1584
As-Ge Ge0.11 As0.89 As,hR6,166 R-3m 0.3608,0.3608,1.109,90,90,120 - - 5.95 A 18463
As-Hf HfAs TiP,hP8,194 P63/mmc 0.3765,0.3765,1.2681,90,90,120 - - 10.81 X 1715
As-Hf HfAs2 PbCl2,oP12,62 Pnma 0.6771,0.3673,0.8941,90,90,90 - - 9.81 X 1715
As-Hf Hf2As Ta2P,oP36,58 Pnnm 1.24892,1.53606,0.36498,90,90,90 - - 12.29 A 3873
As-Hf Hf3As Ta3As,mS64,15 C12/c1 1.53898,0.53795,1.5333,90,90.291,90 - - 12.78 X 13426
As-Hf Hf3As2 Th2S3,oP20,62 Pnma 1.04362,0.36521,1.01465,90,90,90 - - 11.77 A 3873
As-Hf Hf5As3 Nb5P 3,oP64,62 Pnma 2.73884,0.36114,1.23049,90,90,90 - - 12.19 A 3873
As-Hf Hf7As4 Nb7P 4,mS44,12 C12/m1 1.6115,0.35912,1.49283,90,104.24,90 - - 12.29 A 16804
As-Hg Hg0.5 As0.5 As,hR6,166 R-3m 0.3771,0.3771,1.061,90,90,120 - - 10.50 X 8293
As-Hg Hg0.99 As0.01 Ti,hP3,191 P6/mmm 0.454,0.454,0.387,90,90,120 - - 14.38 X 8293
As-Ho HoAs lt CoO,tI4,139 I4/mmm 0.4072,0.4072,0.5759,90,90,90 rocksalt family - 8.34 X 4826
As-Ho HoAs rt NaCl,cF8,225 Fm-3m 0.58093,0.58093,0.58093,90,90,90 rocksalt family gray 8.13 X 38931
As-I AsI3 BiI3,hR24,148 R-3 0.7193,0.7193,2.1372,90,90,120 - orange red 4.74 X 13091
As-In InAs hp1 NaCl,cF8,225 Fm-3m 0.54785,0.54785,0.54785,90,90,90 rocksalt family - 7.66 X 52643
As-In InAs hp2 ZnTe,oS8,63 Cmcm 0.53468,0.54088,0.53424,90,90,90 - - 8.16 X 52643
As-In InAs rt ZnS,cF8,216 F-43m 0.59821,0.59821,0.59821,90,90,90 adamantane structure - 5.89 X 52643
As-In In0.5 As0.5 hp2 Sn,tI4,141 I41/amd 0.5226,0.5226,0.273,90,90,90 - - 8.45 X 18410
As-Ir IrAs2 CoSb2,mP12,14 P121/c1 0.60549,0.60717,0.61587,90,113.197,90 iridarsenite - 10.92 X 5748
As-Ir IrAs3 CoAs3,cI32,204 Im-3 0.84673,0.84673,0.84673,90,90,90 - - 9.13 X 7891
As-K KAs NaP,oP16,19 P212121 0.6425,0.6681,1.1602,90,90,90 - black 3.04 X 41065
As-K K3As Na3As,hP8,194 P63/mmc 0.5782,0.5782,1.0222,90,90,120 - - 2.16 X 145
As-K K3As11 rt Na3P 11,oP56,60 Pbcn 1.0914,1.4525,1.0596,90,90,90 - black red 3.72 X 25545
As-K K3As7 rt K3As7,oP160,61 Pbca 1.2919,2.5441,1.5377,90,90,90 - black 3.37 X 41106
As-K K5As4 Rb5As4,mS20,12 C12/m1 1.1592,0.52114,1.0383,90,113.42,90 - - 2.86 X 38697
As-La LaAs hp CuTi,tP2,123 P4/mmm 0.3625,0.3625,0.306,90,90,90 b.c.c. family - 8.83 X 42225
As-La LaAs NaCl,cF8,225 Fm-3m 0.6137,0.6137,0.6137,90,90,90 rocksalt family - 6.14 X 42225
As-La LaAs2 ht LaP 2 ,mS48,9 C1c1 1.28835,1.4422,0.9083,90,134.917,90 - black 6.42 X 36829
As-La LaAs2 rt NdAs2,mP12,14 P121/c1 0.4212,0.6935,1.0647,90,106.6,90 - - 6.44 A 5335
As-La La4As3 Th3P 4,cI28,220 I-43d 0.9203,0.9203,0.9203,90,90,90 - - 6.65 A 10750
As-Li LiAs LiAs,mP16,14 P121/c1 0.579,0.524,1.070,90,117.4,90 - - 3.77 X 1049
As-Li Li3As rt Na3As,hP8,194 P63/mmc 0.4387,0.4387,0.781,90,90,120 - brown red 2.44 X 145
As-Li Li3As7 rt Li3As7,oP160,61 Pbca 1.2466,2.2489,1.2592,90,90,90 - gray light 4.10 X 41066
As-Lu LuAs NaCl,cF8,225 Fm-3m 0.56802,0.56802,0.56802,90,90,90 rocksalt family - 9.06 X 7788
As-Mg MgAs4 MgAs4,tP20,92 P41212 0.5385,0.5385,1.5798,90,90,90 - black 4.70 X 10393
As-Mg Mg3 As2 ht La2O3,hP5,164 P-3m1 0.4264,0.4264,0.6738,90,90,120 - black gray 3.49 X 2408
As-Mg Mg3 As2 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.233,1.233,1.233,90,90,90 - brown red 3.16 X 67
As-Mn MnAs ht1 FeAs,oP8,62 Pnma 0.5495,0.3414,0.6103,90,90,90 AlB2 family - 7.53 X 41418
As-Mn MnAs ht2 NiAs,hP4,194 P63/mmc 0.37214,0.37214,0.57066,90,90,120 AlB2 family - 6.30 X 59399
As-Mn MnAs rt NiAs,hP4,194 P63/mmc 0.3721,0.3721,0.5703,90,90,120 AlB2 family - 6.31 X 17167
As-Mn Mn2 As hp-ht Fe2P,hP9,189 P-62m 0.63627,0.63627,0.36784,90,90,120 Fe2P family - 7.14 X 6409
As-Mn Mn2 As Cu2Sb,tP6,129 P4/nmm 0.37831,0.37831,0.6266,90,90,90 - - 6.84 X 47707
As-Mn Mn2.90 As2 ht2 Mn2.9 As2,mS40,12 C12/m1 1.3856,0.3777,1.3622,90,107.79,90 - gray 6.05 X 24242
As-Mn Mn3 As Mn3 As,oS16,63 Cmcm 0.3788,1.629,0.3788,90,90,90 - - 6.81 X 393
As-Mn Mn3 As2 ht Mn3 As2,oS40,36 Cmc21 0.3761,1.3760,1.3190,90,90,90 - black 6.12 X 28250
As-Mn Mn3 As2 rt Mn3 As2,mS20,12 C12/m1 1.3247,0.3695,0.9046,90,132.23,90 - gray 6.37 X 29173
As-Mn Mn4 As3 rt V4 As3,mS28,12 C12/m1 1.3411,0.36934,0.9628,90,101.97,90 - - 6.33 X 30692
22 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Mn Mn5As4 Mn5As4,oS36,36 Cmc21 0.3761,1.3760,1.2123,90,90,90 - black 6.08 X 28250


As-Mo MoAs FeAs,oP8,62 Pnma 0.5978,0.336,0.6415,90,90,90 AlB2 family - 8.81 X 3298
As-Mo MoAs2 OsGe2,mS12,12 C12/m1 0.9071,0.32994,0.7719,90,119.37,90 - - 8.11 A 2977
As-Mo Mo0.4As2 FeAs2,oP6,58 Pnnm 0.5299,0.5983,0.2885,90,90,90 pyrite-marcasite family - 6.83 X 2754
As-Mo Mo2As3 Mo2As3,mS20,12 C12/m1 1.3361,0.32337,0.96385,90,124.57,90 - - 8.07 X 19289
As-Mo Mo5As4 Ti5 Te4,tI18,87 I4/m 0.96005,0.96005,0.32781,90,90,90 Chevrel phase - 8.57 X 2962
As-N As[N3]3 As[N3]3,mP40,14 P121/c1 0.73263,1.1716,0.69865,90,107.219,90 - - 2.33 X 42775
As-Na NaAs mon LiAs,mP16,14 P121/c1 0.6242,0.5849,1.155,90,117.1,90 - black 3.47 X 55455
As-Na NaAs orth NaP,oP16,19 P212121 0.591,0.624,1.051,90,90,90 - - 3.36 A 11142
As-Na Na3As hp BiF3,cF16,225 Fm-3m 0.6835,0.6835,0.6835,90,90,90 b.c.c. family gray 2.99 X 24311
As-Na Na3As Cu3P,hP24,185 P63 cm 0.87727,0.87727,0.89876,90,90,120 - violet dark 2.39 X 31765
As-Na Na3As7 rt Na3As7,mP80,14 P121/c1 1.5554,1.0898,1.428,90,115.83,90 - brown red 3.62 X 41067
As-Nb NbAs NbAs,tI8,109 I41md 0.3452,0.3452,1.1679,90,90,90 - - 8.01 X 1805
As-Nb NbAs2 OsGe2,mS12,12 C12/m1 0.9368,0.3396,0.7799,90,119.42,90 - black 7.46 X 29797
As-Nb Nb2As Nb2P,oP54,51 Pmma 1.8493,0.35066,1.41649,90,90,90 - - 8.48 X 59110
As-Nb Nb3As Ti3P,tP32,86 P42 /n 1.0294,1.0294,0.5199,90,90,90 - - 8.53 X 8823
As-Nb Nb4As3 Nb4As3,oS56,63 Cmcm 0.35161,1.46605,1.88303,90,90,90 - - 8.16 X 5733
As-Nb Nb5As3 Nb5P 3,oP64,62 Pnma 2.60701,0.35198,1.17869,90,90,90 - - 8.47 X 14012
As-Nb Nb7As4 Nb7P 4,mS44,12 C12/m1 1.53172,0.35242,1.4192,90,104.742,90 - - 8.52 A 4457
As-Nd NdAs hp CuTi,tP2,123 P4/mmm 0.3536,0.3536,0.289,90,90,90 b.c.c. family - 10.07 X 38931
As-Nd NdAs NaCl,cF8,225 Fm-3m 0.5962,0.5962,0.5962,90,90,90 rocksalt family - 6.87 X 7547
As-Nd NdAs2 NdAs2,mP12,14 P121/c1 0.41081,0.68201,1.04431,90,106.718,90 - - 6.97 X 11208
As-Ni NiAs lt NiAs,oS24,36 Cmc21 1.08568,0.62682,0.5034,90,90,90 AlB2 family - 7.77 X 22703
As-Ni NiAs rt NiAs,hP4,194 P63 /mmc 0.36184,0.36184,0.50326,90,90,120 nickeline brownish 7.78 X 59399
As-Ni NiAs2 hp-ht FeS2,cP12,205 Pa-3 0.57634,0.57634,0.57634,90,90,90 krutovite black 7.24 A 4040
As-Ni NiAs2 ht FeAs2,oP6,58 Pnnm 0.47583,0.57954,0.35449,90,90,90 rammelsbergite white tin 7.09 X 3878
As-Ni NiAs2 rt NiAs2,oP24,61 Pbca 0.57718,0.58342,1.14214,90,90,90 pararammelsbergite white tin 7.20 X 12050
As-Ni Ni11As8 mon Ni11As8,mS76,15 C12/c1 0.9718,0.9718,1.1177,90,102.55,90 maucherite MDO2 - 8.03 X 52157
As-Ni Ni11As8 tet Ni11As8,tP76,92 P41212 0.68724,0.68724,2.1821,90,90,90 maucherite MDO1 - 8.02 X 7234
As-Ni Ni5As2 rt As+ Pd5Sb2,hP42,185 P63 cm 0.6825,0.6825,1.2513,90,90,120 orcelite - 8.75 X 5334
As-Ni Ni5As2 rt Ni+ *,hR*,* - 0.6824,0.6824,7.566,90,90,120 - - - N 5334
As-Np NpAs hp CsCl,cP2,221 Pm-3m 0.331,0.331,0.331,90,90,90 b.c.c. family - 14.29 X 19442
As-Np NpAs lt CoO,tI4,139 I4/mmm 0.41237,0.41237,0.58278,90,90,90 rocksalt family - 10.46 X 8484
As-Np NpAs rt NaCl,cF8,225 Fm-3m 0.58366,0.58366,0.58366,90,90,90 rocksalt family - 10.42 X 22509
As-Np NpAs2 UAs2,tP6,129 P4/nmm 0.393,0.393,0.8137,90,90,90 - golden 10.22 X 15310
As-Np Np3As4 Th3P 4,cI28,220 I-43d 0.85,0.85,0.85,90,90,90 - black 10.93 A 30189
As-O AsO2 AsO2,oP24,62 Pnma 0.8597,0.5235,0.7269,90,90,90 - colorless 4.34 X 13066
As-O As2O3 ars As2O3,cF80,227 Fd-3m 1.10772,1.10772,1.10772,90,90,90 arsenolite white 3.87 X 46100
As-O As2O3 cla I As2O3-a,mP20,14 P121/c1 0.453,1.299,0.670,90,128.56,90 claudetite I - 4.26 X 11757
As-O As2O3 cla II As2O3-b,mP20,14 P121/c1 0.80131,0.45717,1.08328,90,124.554,90 claudetite II colorless 4.02 X 57875
As-O As2O5 ht As2O5,tP28,92 P41212 0.8572,0.8572,0.4636,90,90,90 - - 4.48 X 12850
As-O As2O5 rt As2O5,oP28,19 P212121 0.4626,0.8449,0.8646,90,90,90 - colorless 4.52 X 11956
As-Os OsAs2 FeAs2,oP6,58 Pnnm 0.54129,0.6191,0.30126,90,90,90 omeiite - 11.19 X 3878
As-P As0.06P 0.94 bla P,oS8,64 Cmce 0.33279,1.0527,0.43867,90,90,90 - black 2.91 X 57548
As-P As0.5 P0.5 hp1 As,hR6,166 R-3m 0.35,0.35,0.911,90,90,120 - - 5.46 A 27907
As-Pa PaAs NaCl,cF8,225 Fm-3m 0.5756,0.5756,0.5756,90,90,90 rocksalt family - 10.66 X 12463
As-Pa PaAs2 UAs2,tP6,129 P4/nmm 0.39748,0.39748,0.8159,90,90,90 - - 9.81 A 12463
As-Pa Pa3As4 Th3P 4,cI28,220 I-43d 0.85224,0.85224,0.85224,90,90,90 - - 10.65 A 12463
As-Pd PdAs2 FeS2,cP12,205 Pa-3 0.5979,0.5979,0.5979,90,90,90 pyrite-marcasite family - 7.96 X 29567
As-Pd Pd0.83 As0.17 m W,cI2,229 Im-3m 0.3093,0.3093,0.3093,90,90,90 b.c.c. family - 11.34 X 16720
As-Pd Pd1.667 As0.333 m CsCl,cP2,221 Pm-3m 0.3093,0.3093,0.3093,90,90,90 b.c.c. family - 11.35 X 15119
As-Pd Pd2As ht Fe2P,hP9,189 P-62m 0.6645,0.6645,0.358,90,90,120 Fe2P family - 10.47 A 37884
As-Pd Pd2As rt Pd2As,oS24,36 Cmc21 0.3245,1.6844,0.6576,90,90,90 - - 10.63 X 4719
As-Pd Pd3As orth *,oP*,* - 0.333,0.607,1.083,90,90,90 isomertieite - - N 8587
As-Pd Pd3As tet Ni3P,tI32,82 I-4 0.9974,0.9974,0.4822,90,90,90 - - 10.91 A 2156
As-Pd Pd5As Pd5As,mS24,5 C121 0.5520,0.7739,0.8426,90,98.99,90 - - 11.34 X 11609
As-Pd Pd5As2 hex Pd5Sb2,hP42,185 P63 cm 0.732,0.732,1.37,90,90,120 - - 10.69 A 2155
As-Pd Pd5As2 trig1 *,hP84,164 P-3m1 0.732,0.732,2.7523,90,90,120 - - - N 2155
As-Pd Pd5As2 trig2 *,hP*,164 P-3m1 0.732,0.732,1.034,90,90,120 - - - N 2155
As-Pd Pd8As3 rt *,hP33,147 P-3 0.7399,0.7399,1.0311,90,90,120 stillwaterite gray - N 8922
As-Pr PrAs hp CuTi,tP2,123 P4/mmm 0.3524,0.3524,0.2961,90,90,90 b.c.c. family - 9.75 X 38931
As-Pr PrAs NaCl,cF8,225 Fm-3m 0.6036,0.6036,0.6036,90,90,90 rocksalt family - 6.52 X 11574
As-Pr PrAs2 NdAs2,mP12,14 P121/c1 0.4139,0.6844,1.0509,90,106.69,90 - - 6.77 A 5335
As-Pr Pr4As3 Th3P 4,cI28,220 I-43d 0.8994,0.8994,0.8994,90,90,90 - - 7.20 X 5335
As-Pt PtAs2 FeS2,cP12,205 Pa-3 0.59681,0.59681,0.59681,90,90,90 sperrylite - 10.78 X 12258
As-Pu PuAs hp CsCl,cP2,221 Pm-3m 0.322,0.322,0.322,90,90,90 b.c.c. family - 15.86 X 22390
As-Pu PuAs NaCl,cF8,225 Fm-3m 0.58565,0.58565,0.58565,90,90,90 rocksalt family - 10.55 X 22390
As-Rb RbAs NaP,oP16,19 P212121 0.6581,0.6916,1.2047,90,90,90 - black 3.89 X 41106
As-Rb Rb2As3 Rb2P 3,oF40,69 Fmmm 0.917,1.0078,1.5186,90,90,90 - blue steel 3.75 X 36726
As-Rb Rb3As Na3As,hP8,194 P63 /mmc 0.6052,0.6052,1.073,90,90,120 - violet 3.23 X 1546
As-Rb Rb3As11 rt Na3P 11,oP56,60 Pbcn 1.1082,1.5335,1.0601,90,90,90 - red 3.98 X 42385
As-Rb Rb3As7 ht Rb3As7,mP80,14 P121/c1 0.7573,1.3102,2.6927,90,91.972,90 - black 3.88 X 41106
As-Rb Rb3As7 rt K3As7,oP160,61 Pbca 1.3194,2.5878,1.5881,90,90,90 - red 3.83 X 41068
As-Rb Rb5As4 Rb5As4,mS20,12 C12/m1 1.192,0.5533,1.0755,90,117.228,90 - - 3.83 X 23031
As-Re Re3As7 Ru3Sn7,cI40,229 Im-3m 0.87162,0.87162,0.87162,90,90,90 - - 10.86 X 4694
As-Rh RhAs FeAs,oP8,62 Pnma 0.5603,0.35861,0.60708,90,90,90 cherepanovite - 9.68 A 24986
As-Rh RhAs2 CoSb2,mP12,14 P121/c1 0.60629,0.60816,0.61498,90,114.707,90 pyrite-marcasite family - 8.15 X 5748
As-Rh RhAs3 CoAs3,cI32,204 Im-3 0.84507,0.84507,0.84507,90,90,90 - - 7.21 X 7891
Handbook of Inorganic Substances – Edition 2015 : Data 23

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Rh Rh10.5 As7 V12P 7,hP26,176 P63/m 0.9219,0.9219,0.3532,90,90,120 - - 10.25 X 21370


As-Rh Rh12 As7 Rh12 As7-a,hP22,176 P63/m 0.9297,0.9297,0.3657,90,90,120 polkanovite - 10.67 X 18066
As-Rh Rh2As ht Co2Si-b,oP12,62 Pnma 0.5904,0.3918,0.7352,90,90,90 rhodarsenide - 10.96 A 19180
As-Rh Rh2As rt CaF2 ,cF12,225 Fm-3m 0.56753,0.56753,0.56753,90,90,90 fluorite family - 10.20 X 19180
As-Ru RuAs FeAs,oP8,62 Pnma 0.57168,0.33379,0.63129,90,90,90 ruthenarsenite - 9.70 A 59399
As-Ru RuAs2 FeAs2,oP6,58 Pnnm 0.54302,0.61834,0.29714,90,90,90 anduoite - 8.35 X 3878
As-S AsS hp AsS,oP68,29 Pca21 1.027,0.74537,1.8258,90,90,90 - - 4.07 X 56005
As-S AsS ht1 AsS,mS32,15 C12/c1 0.99723,0.93213,0.88801,90,102.514,90 - orange 3.53 X 59108
As-S AsS ht2 AsS-b,mP32,14 P121/c1 0.7153,0.9994,1.2986,90,120.6,90 - orange 3.56 X 10217
As-S AsS par AsS-c,mP32,14 P121/c1 0.9909,0.9655,0.8502,90,97.29,90 pararealgar yellow 3.52 X 29850
As-S AsS rea AsS-a,mP32,14 P121/c1 0.659,1.3563,0.9777,90,113.811,90 realgar orange 3.56 X 44337
As-S AsS1.04 m AsS1.04 ,mS56,15 C12/c1 0.9881,0.9397,0.893,90,101.64,90 - - 3.54 X 46063
As-S As2S3 mon As2S3,mP20,14 P121/c1 0.4256,0.9577,1.2191,90,109.75,90 orpiment yellow 3.49 X 7092
As-S As2S3 orth Sb2S3,oP20,62 Pnma 1.148,0.426,0.96,90,90,90 - - 3.48 A 32298
As-S As2S3 tricl As2S3,aP20,2 P-1 0.57577,0.87169,1.02682,78.152,75.817,89.861 anorpiment yellow 3.35 X 57027
As-S As2S5 *,o**,* - 0.866,0.99,1.037,90,90,90 - - - N 5204
As-S As4S *,oP10,* - 0.3576,0.6759,1.0074,90,90,90 duranusite - - N 7270
As-S As4S3 ht1 As4S3-a,oP28,62 Pnma 0.912,0.799,1.010,90,90,90 dimorphite high orange 3.57 X 5350
As-S As4S3 ht2 *,tP*,* - 1.691,1.691,2.175,90,90,90 - - - N 13783
As-S As4S3 rt As4S3-b,oP28,62 Pnma 1.121,0.990,0.658,90,90,90 dimorphite low yellow 3.60 X 7449
As-S As4S5 mon As4S5,mP18,11 P121/m1 0.7148,0.8096,0.7973,90,101.01,90 uzonite - 3.37 X 41307
As-S As4S5 orth As4S5,oP72,56 Pccn 1.0166,1.9352,0.8697,90,90,90 - - 3.57 X 48046
As-S As8S9 As8S9,mP34,13 P12/c1 0.9942,0.9601,0.9178,90,101.94,90 alacranite - 3.44 X 41256
As-Sb Sb0.99 As0.01 As,hR6,166 R-3m 0.4305,0.4305,1.1263,90,90,120 stibarsen white 6.68 A 17008
As-Sb Sb2.93 As1.07 lt *,mS4,5 C121 0.7252,0.4172,0.4431,90,123.05,90 paradocrasite yellowish - N 5753
As-Sc ScAs NaCl,cF8,225 Fm-3m 0.5464,0.5464,0.5464,90,90,90 rocksalt family gray 4.88 X 59399
As-Sc Sc3As2 orth1 Th2S3,oP20,62 Pnma 1.03754,0.38063,1.03754,90,90,90 - - 4.62 X 12927
As-Sc Sc3As2 orth2 Cr3C2-b,oP20,62 Pnma 0.71423,0.38698,1.47073,90,90,90 - - 4.65 A 12925
As-Sc Sc5As3 Yb5Sb3,oP32,62 Pnma 1.07038,0.81418,0.72272,90,90,90 - - 4.74 A 12925
As-Sc Sc7As3 Sc7As3,tI84,140 I4/mcm 1.43751,1.43751,0.80281,90,90,90 - - 4.32 X 13943
As-Se AsSe AsS-a,mP32,14 P121/c1 0.67368,1.38187,1.00076,90,113.603,90 - black 4.79 X 51831
As-Se As2Se 3 hp As2Te3,mS20,12 C12/m1 1.337,0.373,0.934,90,95.,90 - - 5.54 A 24013
As-Se As2Se 3 As2S3,mP20,14 P121/c1 0.42835,0.99037,1.27822,90,109.121,90 - red cherry 5.01 X 18687
As-Se As4Se 3 mon *,mS112,15 C12/c1 2.562,0.652,2.301,90,123.6,90 - - - N 10727
As-Se As4Se 3 rt As4S3-a,oP28,62 Pnma 0.946,0.791,1.041,90,90,90 - red 4.58 A 10727
As-Si SiAs prec *,oP24,* - 0.695,0.77,0.925,90,90,90 - - 4.15 N 3131
As-Si SiAs rt SiAs,mS24,12 C12/m1 1.5979,0.3668,0.9529,90,106.00,90 - gray 3.82 X 2509
As-Si SiAs2 hp FeS2 ,cP12,205 Pa-3 0.60232,0.60232,0.60232,90,90,90 pyrite-marcasite family - 5.41 X 4156
As-Si SiAs2 GeAs2,oP24,55 Pbam 1.0393,1.4545,0.3636,90,90,90 - - 4.30 A 13321
As-Sm SmAs hp CuTi,tP2,123 P4/mmm 0.3445,0.3445,0.2847,90,90,90 b.c.c. family - 11.07 X 38931
As-Sm SmAs NaCl,cF8,225 Fm-3m 0.592,0.592,0.592,90,90,90 rocksalt family gray silver 7.21 X 14228
As-Sm Sm4 As3 Th3P 4,cI28,220 I-43d 0.88361,0.88361,0.88361,90,90,90 - - 7.96 A 46240
As-Sn SnAs NaCl,cF8,225 Fm-3m 0.5716,0.5716,0.5716,90,90,90 rocksalt family - 6.89 X 8510
As-Sn Sn4As3 Sn4As3,hR21,160 R3m 0.4089,0.4089,3.6059,90,90,120 - gray silver 6.67 X 52976
As-Sr SrAs3 SrAs3,mS16,12 C12/m1 0.961,0.763,0.588,90,112.9,90 - gray 5.22 X 10299
As-Sr Sr16 As11 Ca16 Sb11,tP56,113 P-421m 1.22954,1.22954,1.11598,90,90,90 - - 4.38 A 33066
As-Sr Sr2As La2Sb,tI12,139 I4/mmm 0.483,0.483,1.613,90,90,90 - orange red 4.42 X 10261
As-Sr Sr2As2 Na2[O2],hP12,189 P-62m 0.8271,0.8271,0.6203,90,90,120 - black 4.41 X 32602
As-Sr Sr3As4 Sr3As4,oF56,43 Fdd2 1.484,1.789,0.597,90,90,90 - gray dark 4.72 X 11106
As-Sr Sr4As3 Ba4P 3,oP56,55 Pbam 1.2185,1.2775,1.0958,90,90,90 - gray dark 4.48 X 31192
As-Sr Sr5As3 Mn5 Si3,hP16,193 P63/mcm 0.893,0.893,0.732,90,90,120 - - 4.35 X 10261
As-Ta TaAs NbAs,tI8,109 I41md 0.34348,0.34348,1.1641,90,90,90 - - 12.38 X 2525
As-Ta TaAs2 OsGe 2,mS12,12 C12/m1 0.9331,0.3383,0.7752,90,119.71,90 - - 10.34 X 14104
As-Ta Ta2As Ta2P,oP36,58 Pnnm 1.18373,1.4768,0.34696,90,90,90 - - 14.35 A 4457
As-Ta Ta3As Ta3As,mS64,15 C12/c1 1.46773,0.50954,1.45505,90,90.572,90 - - 15.08 X 12092
As-Ta Ta5As4 Ti5 Te4,tI18,87 I4/m 0.97975,0.97975,0.34296,90,90,90 Chevrel phase - 12.15 X 26876
As-Tb TbAs lt NiO,hR6,166 R-3m 0.41486,0.41486,0.94981,90,90,120 rocksalt family - 8.23 X 4826
As-Tb TbAs rt NaCl,cF8,225 Fm-3m 0.5824,0.5824,0.5824,90,90,90 rocksalt family gray 7.86 X 4826
As-Tc Tc2As3 Tc2As3,aP20,2 P-1 0.6574,0.6632,0.8023,95.69,102.03,104.31 - - 8.54 X 18238
As-Te AsTe NaCl,cF8,225 Fm-3m 0.5778,0.5778,0.5778,90,90,90 rocksalt family - 6.97 X 8468
As-Te As2Te 3 m Bi2Te3,hR15,166 R-3m 0.406,0.406,2.959,90,90,120 - - 6.28 X 19387
As-Te As2Te 3 rt As2Te3,mS20,12 C12/m1 1.43573,0.40199,0.98990,90,95.107,90 - gray 6.22 X 18674
As-Th ThAs hp CsCl,cP2,221 Pm-3m 0.345,0.345,0.345,90,90,90 b.c.c. family - 12.41 X 21157
As-Th ThAs rt NaCl,cF8,225 Fm-3m 0.5978,0.5978,0.5978,90,90,90 rocksalt family black gray 9.54 X 21157
As-Th ThAs2 ht UAs2,tP6,129 P4/nmm 0.4086,0.4086,0.8575,90,90,90 - - 8.86 X 658
As-Th ThAs2 rt PbCl2,oP12,62 Pnma 0.7287,0.4002,0.9784,90,90,90 - - 8.89 A 3212
As-Th Th3As4 Th3P 4,cI28,220 I-43d 0.8843,0.8843,0.8843,90,90,90 - - 9.57 X 658
As-Ti TiAs ht NiAs,hP4,194 P63/mmc 0.3645,0.3645,0.6109,90,90,120 AlB2 family - 5.80 X 2746
As-Ti TiAs rt TiP,hP8,194 P63/mmc 0.364,0.364,1.228,90,90,120 - - 5.79 X 700
As-Ti TiAs2 TiAs2,oP24,58 Pnnm 0.896,1.327,0.350,90,90,90 - - 6.31 X 2287
As-Ti Ti3As Ti3P,tP32,86 P42/n 1.01618,1.01618,0.51098,90,90,90 - - 5.50 A 10332
As-Ti Ti4As3 Th3P 4,cI28,220 I-43d 0.76795,0.76795,0.76795,90,90,90 - - 6.11 A 10332
As-Ti Ti5As3 hex Mn5 Si3,hP16,193 P63/mcm 0.74,0.74,0.5215,90,90,120 - - 6.23 X 2742
As-Ti Ti5As3 orth Yb5Sb3,oP32,62 Pnma 0.9866,0.7769,0.674,90,90,90 - - 5.97 A 40193
As-Tm TmAs NaCl,cF8,225 Fm-3m 0.5772,0.5772,0.5772,90,90,90 rocksalt family gray 8.42 X 9500
As-U UAs hp CsCl,cP2,221 Pm-3m 0.331,0.331,0.331,90,90,90 b.c.c. family - 14.33 X 19442
As-U UAs NaCl,cF8,225 Fm-3m 0.57767,0.57767,0.57767,90,90,90 rocksalt family - 10.78 X 19441
As-U UAs0.1 stab fil Cu,cF4,225 Fm-3m 0.489,0.489,0.489,90,90,90 close-packed structure - 13.95 F 7286
24 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-U UAs2 hp PbCl2,oP12,62 Pnma 0.64,0.356,0.853,90,90,90 - - 13.26 A 23348


As-U UAs2 UAs2,tP6,129 P4/nmm 0.3954,0.3954,0.8116,90,90,90 - - 10.15 X 2704
As-U U3As4 lt *,hR84,* - 1.20109,1.20109,1.47373,90,90,120 - - - N 9958
As-U U3As4 rt Th3P 4,cI28,220 I-43d 0.8497,0.8497,0.8497,90,90,90 - - 10.98 X 8505
As-V VAs FeAs,oP8,33 Pna21 0.585,0.62923,0.33618,90,90,90 - - 6.76 X 6514
As-V VAs2 OsGe2,mS12,12 C12/m1 0.905,0.327,0.746,90,120.,90 - - 6.98 A 2860
As-V V2 As *,hP12,* - 0.76519,0.76519,0.33584,90,90,120 - - - N 8708
As-V V3 As Cr3Si,cP8,223 Pm-3n 0.47425,0.47425,0.47425,90,90,90 Frank-Kasper phase - 7.09 X 5616
As-V V3 As2 V3 As2,tP20,83 P4/m 0.94128,0.94128,0.33361,90,90,90 - - 6.80 X 10327
As-V V4 As3 ht V4 As3,mS28,12 C12/m1 1.37251,0.33928,0.92297,90,100.521,90 - - 6.74 X 7889
As-V V4 As3 rt Nb4As3,oS56,63 Cmcm 0.342,1.373,1.812,90,90,90 - - 6.69 X 6881
As-V V5 As2.74 rt W5Si3,tI32,140 I4/mcm 0.95031,0.95031,0.48255,90,90,90 - - 7.01 X 10324
As-V V5 As3 ht1 Yb5Sb3,oP32,62 Pnma 0.9463,0.7519,0.6471,90,90,90 - - 6.92 A 8708
As-V V5 As3 ht2 Y5Bi3,oP32,62 Pnma 0.64402,0.76767,0.92846,90,90,90 - - 6.94 X 9508
As-W WAs2 OsGe2,mS12,12 C12/m1 0.9078,0.33177,0.7686,90,119.42,90 - - 10.99 A 2977
As-W W2As3 Mo2As3,mS20,12 C12/m1 1.33308,0.32791,0.9599,90,124.697,90 - - 11.41 X 2958
As-Y YAs NaCl,cF8,225 Fm-3m 0.57819,0.57819,0.57819,90,90,90 rocksalt family gray 5.63 X 59411
As-Yb YbAs rt NaCl,cF8,225 Fm-3m 0.5694,0.5694,0.5694,90,90,90 rocksalt family gray 8.92 X 30409
As-Yb Yb4 As3 ht Th3P 4,cI28,220 I-43d 0.87914,0.87914,0.87914,90,90,90 - - 8.96 X 45457
As-Yb Yb4 As3 lt Yb4 As3,hR42,161 R3c 1.25112,1.25112,0.7502,90,90,120 - - 8.98 X 45457
As-Yb Yb5 As3 Mn5Si3,hP16,193 P63 /mcm 0.848,0.848,0.6671,90,90,120 - - 8.71 X 5335
As-Zn ZnAs hp-ht CdSb,oP16,61 Pbca 0.5679,0.7277,0.7559,90,90,90 - - 5.97 X 10300
As-Zn ZnAs2 rt ZnAs2,mP24,14 P121/c1 0.9287,0.7691,0.8010,90,102.47,90 - - 5.12 X 7904
As-Zn Zn1.5 As ht2 CaF2,cF12,225 Fm-3m 0.59481,0.59481,0.59481,90,90,90 fluorite family gray 5.46 X 7729
As-Zn Zn3As2 hp1 *,cF*,* - 1.182,1.182,1.182,90,90,90 - - - N 4613
As-Zn Zn3As2 hp2 *,hP30,* - 0.727,0.727,1.208,90,90,120 - - - N 4613
As-Zn Zn3As2 ht-hp Zn3P 2,tP40,137 P42 /nmc 0.8316,0.8316,1.176,90,90,90 fluorite family gray silver 5.65 X 107
As-Zn Zn3As2 ht1 Zn3As2,tP160,133 P42 /nbc 1.1789,1.1789,2.3635,90,90,90 - - 5.60 X 9704
As-Zn Zn3As2 rt Cd3As2,tI160,110 I41cd 1.17823,1.17823,2.36385,90,90,90 - - 5.60 X 22708
As-Zr ZrAs ht NaCl,cF8,225 Fm-3m 0.54335,0.54335,0.54335,90,90,90 rocksalt family - 6.88 X 16804
As-Zr ZrAs rt TiP,hP8,194 P63 /mmc 0.38,0.38,1.287,90,90,120 - - 6.86 X 862
As-Zr ZrAs2 PbCl2,oP12,62 Pnma 0.68006,0.36883,0.90328,90,90,90 - - 7.07 X 54584
As-Zr Zr14As9 Zr14P 9,oP92,58 Pnnm 1.70987,2.82588,0.37661,90,90,90 - - 7.12 A 16804
As-Zr Zr2As *,oP*,* - 0.36613,1.50782,1.95317,90,90,90 - - - N 16804
As-Zr Zr3As Ti3P,tP32,86 P42 /n 1.09734,1.09734,0.54499,90,90,90 - - 7.06 A 2965
As-Zr Zr3As2 Th2S3,oP20,62 Pnma 1.05278,0.37276,1.02142,90,90,90 - - 7.02 A 16804
As-Zr Zr7As4 Nb7P 4,mS44,12 C12/m1 1.6202,0.36778,1.50394,90,104.656,90 - - 7.19 A 16804
As-Zr Zr8As5 Nb8P 5,oP54,55 Pbam 1.02052,2.83335,0.37743,90,90,90 - - 6.72 X 9509
Au-B AuB2 AlB2,hP3,191 P6/mmm 0.314,0.314,0.352,90,90,120 AlB2 family - 12.08 X 1491
Au-B Au0.01 B rhom1 B,hR423,166 R-3m 1.09324,1.09324,2.38238,90,90,120 β-boron family - 2.76 F 14249
Au-Ba BaAu FeB-b,oP8,62 Pnma 0.8331,0.49309,0.63928,90,90,90 CrB(TlI)-FeB - 8.46 X 53491
Au-Ba BaAu2 AlB2,hP3,191 P6/mmm 0.4804,0.4804,0.4119,90,90,120 AlB2 family - 10.72 X 4947
Au-Ba BaAu5 CaCu5,hP6,191 P6/mmm 0.569,0.569,0.4542,90,90,120 - - 14.63 X 3308
Au-Ba Ba3Au2 Er3Ni2,hR45,148 R-3 1.0001,1.0001,1.9143,90,90,120 - - 7.26 A 18510
Au-Be BeAu rt FeSi,cP8,198 P213 0.4668,0.4668,0.4668,90,90,90 - - 13.45 X 277
Au-Be Be12Au ThMn12,tI26,139 I4/mmm 0.7243,0.7243,0.4252,90,90,90 CaCu5-Zr4Al3 - 4.54 A 928
Au-Be Be5Au Be5Au,cF24,216 F-43m 0.6097,0.6097,0.6097,90,90,90 Friauf-Laves phase - 7.09 X 97
Au-Bi Au0.3 Bi0.7 m Po,cP1,221 Pm-3m 0.3115,0.3115,0.3115,90,90,90 - - 11.28 X 4280
Au-Bi Au0.4 Bi0.6 m Po,hR3,166 R-3m 0.42527,0.42527,0.53317,90,90,120 - - 12.18 X 4280
Au-Bi Au2Bi ht MgCu2,cF24,227 Fd-3m 0.796,0.796,0.796,90,90,90 maldonite - 15.88 X 54458
Au-Br AuBr ht1 AuI,tP8,138 P42 /ncm 0.4296,0.4296,1.2146,90,90,90 - - 8.20 X 11600
Au-Br AuBr ht2 AuCl,tI16,141 I41/amd 0.694,0.694,0.9252,90,90,90 - - 8.25 X 11600
Au-Br AuBr3 AuBr3,mP32,14 P121/c1 0.6831,2.041,0.8105,90,119.74,90 - red dark 5.91 X 9487
Au-Ca CaAu rt TlI,oS8,63 Cmcm 0.3961,1.1075,0.4576,90,90,90 CrB(TlI)-FeB - 7.84 X 15269
Au-Ca CaAu2 rt KHg2,oI12,74 Imma 0.4611,0.7067,0.8079,90,90,90 AlB2 family gray green 10.95 X 31724
Au-Ca CaAu5 Be5Au,cF24,216 F-43m 0.7747,0.7747,0.7747,90,90,90 Friauf-Laves phase - 14.64 X 2234
Au-Ca Ca3Au Fe3C-b,oP16,62 Pnma 0.7795,1.,0.678,90,90,90 - - 3.99 X 18510
Au-Ca Ca3Au4 hp Pu3Pd4,hR42,148 R-3 1.37351,1.37351,0.59084,90,90,120 b.c.c. family - 9.37 X 35950
Au-Ca Ca5Au2 Mn5C2,mS28,15 C12/c1 1.6857,0.6809,0.7746,90,97.26,90 - - 4.48 X 18510
Au-Ca Ca5Au3 Cr5B3,tI32,140 I4/mcm 0.7867,0.7867,1.439,90,90,90 - - 5.90 X 17470
Au-Ca Ca5Au4 Ca5Au4,mP18,14 P121/c1 0.8028,0.8019,0.7727,90,109.16,90 - - 6.99 X 18262
Au-Ca Ca7Au3 Ca7Au3,oP80,61 Pbca 0.6665,2.0742,1.8036,90,90,90 - - 4.64 X 18262
Au-Cd AuCd3 rt Cu3P,hP24,185 P63 cm 0.8147,0.8147,0.8511,90,90,120 - - 10.88 X 10730
Au-Cd Au0.5 Cd1.5 ht CuTi,tP2,123 P4/mmm 0.33478,0.33478,0.28729,90,90,90 b.c.c. family - 13.78 X 15420
Au-Cd Au0.5 Cd1.5 rt CuTi,tP2,123 P4/mmm 0.33645,0.33645,0.2735,90,90,90 b.c.c. family - 14.33 X 15420
Au-Cd Au1.01 Cd0.99 ht CsCl,cP2,221 Pm-3m 0.3342,0.3342,0.3342,90,90,90 b.c.c. family - 13.80 X 47833
Au-Cd Au1.01 Cd0.99 rt Au1.01 Cd0.99 ,hP18,143 P3 0.8095,0.8095,0.5794,90,90,120 b.c.c. family - 14.10 X 26531
Au-Cd Au1.05 Cd0.95 mart AuCd,oP4,51 Pmma 0.4766,0.3151,0.4859,90,90,90 close-packed structure - 14.27 X 23880
Au-Cd Au1.1 Cd0.9 rt LiSn,mP6,10 P12/m1 0.491,0.3089,0.7431,90,105.38,90 close-packed structure - 14.57 X 11991
Au-Cd Au3Cd rt ZrAl3,tI16,139 I4/mmm 0.4109,0.4109,1.6552,90,90,90 close-packed structure - 16.72 X 2733
Au-Cd Au3Cd tet SrPb3,tP4,123 P4/mmm 0.4117,0.4117,0.4131,90,90,90 close-packed structure - 16.68 X 723
Au-Cd Au3Cd5 rt W5Si3,tI32,140 I4/mcm 1.0728,1.0728,0.5352,90,90,90 - - 12.43 X 12450
Au-Cd Au32.7 Cd16.3 ht Au12(Au0.58 Cd0.42)36Cd,hP98,194 P63 /mmc 2.0433,2.0433,0.4818,90,90,120 - - 15.77 X 15191
Au-Cd Au5Cd8 ht2 Cu5Zn8,cI52,217 I-43m 0.9998,0.9998,0.9998,90,90,90 γ-brass - 12.52 A 12450
Au-Cd Au5Cd8 ht3 Cu5Zn8,cI52,217 I-43m 1.003,1.003,1.003,90,90,90 γ-brass - 12.40 A 12450
Au-Ce AuCe ht TlI,oS8,63 Cmcm 0.39,1.114,0.475,90,90,90 CrB(TlI)-FeB - 10.85 X 6023
Au-Ce AuCe rt FeB-b,oP8,62 Pnma 0.743,0.466,0.593,90,90,90 CrB(TlI)-FeB - 10.91 X 6023
Au-Ce AuCe2 Co2Si-b,oP12,62 Pnma 0.7271,0.5073,0.932,90,90,90 - - 9.22 X 6023
Handbook of Inorganic Substances – Edition 2015 : Data 25

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Ce Au2Ce KHg2,oI12,74 Imma 0.4528,0.7203,0.8068,90,90,90 AlB2 family - 13.48 A 4094


Au-Ce Au51 Ce14 Ag51 Gd14,hP68,175 P6/m 1.2808,1.2808,0.9327,90,90,120 - - 15.05 X 6023
Au-Ce Au6Ce Au6Pr,mS28,15 C12/c1 0.7822,0.7779,0.9079,90,100.8,90 - - 16.18 A 52500
Au-Cl AuCl ht AuCl,tI16,141 I41/amd 0.6734,0.6734,0.8674,90,90,90 - - 7.85 X 8304
Au-Cl AuCl rt NaCl,cF8,225 Fm-3m 0.632,0.632,0.632,90,90,90 rocksalt family - 6.12 X 52792
Au-Cl AuCl2 AuCl2,aP12,2 P-1 0.6684,0.6830,0.7015,88.4,72.5,85.6 - black 5.84 X 15225
Au-Cl AuCl3 AuCl3,mP16,14 P121/c1 0.657,1.104,0.644,90,113.3,90 - orange 4.70 X 935
Au-Co Au0.025 Co0.975 ht Cu,cF4,225 Fm-3m 0.3559,0.3559,0.3559,90,90,90 close-packed structure - 9.19 X 356
Au-Co Au0.5 Co0.5 Cu,cF4,225 Fm-3m 0.378,0.378,0.378,90,90,90 close-packed structure - 15.74 X 40355
Au-Co Au3Co Cu3Au,cP4,221 Pm-3m 0.4,0.4,0.4,90,90,90 close-packed structure - 16.86 X 50507
Au-Cr Au0.5 Cr0.5 Cu,cF4,225 Fm-3m 0.3991,0.3991,0.3991,90,90,90 close-packed structure - 13.01 X 7439
Au-Cr Au3.96 Cr1.04 rt MoNi4,tI10,87 I4/m 0.6398,0.6398,0.4046,90,90,90 close-packed structure - 16.73 X 16908
Au-Cs CsAu rt CsCl,cP2,221 Pm-3m 0.4258,0.4258,0.4258,90,90,90 b.c.c. family black 7.10 X 28110
Au-Cu CuAu ht1 CuAu,oI40,74 Imma 0.3676,0.3956,3.972,90,90,90 close-packed structure - 14.98 X 4164
Au-Cu CuAu rt CuAu,tP2,123 P4/mmm 0.28086,0.28086,0.3665,90,90,90 tetra-auricupride - 14.96 X 24753
Au-Cu Cu0.508 Au0.492 ht2 Cu,cF4,225 Fm-3m 0.3899,0.3899,0.3899,90,90,90 close-packed structure - 14.48 X 56233
Au-Cu Cu1.28 Au2.72 rt Cu3Au,cP4,221 Pm-3m 0.39528,0.39528,0.39528,90,90,90 close-packed structure - 16.59 X 3047
Au-Cu Cu2.74 Au1.26 rt Cu3Au,cP4,221 Pm-3m 0.3782,0.3782,0.3782,90,90,90 aurocupride - 12.96 X 24753
Au-Dy AuDy ht CsCl,cP2,221 Pm-3m 0.3555,0.3555,0.3555,90,90,90 b.c.c. family - 13.29 X 1914
Au-Dy AuDy rt TlI,oS8,63 Cmcm 0.371,1.087,0.461,90,90,90 CrB(TlI)-FeB - 12.84 X 6023
Au-Dy AuDy2 Co2Si-b,oP12,62 Pnma 0.70473,0.49081,0.88977,90,90,90 - - 11.27 X 6023
Au-Dy Au0.98 Dy0.02 Cu,cF4,225 Fm-3m 0.40921,0.40921,0.40921,90,90,90 close-packed structure - 19.03 X 2818
Au-Dy Au2Dy MoSi2,tI6,139 I4/mmm 0.3694,0.3694,0.8961,90,90,90 b.c.c. family - 15.11 X 4731
Au-Dy Au3Dy Cu3Ti,oP8,59 Pmmn 0.49784,0.60887,0.50903,90,90,90 close-packed structure - 16.22 X 6023
Au-Dy Au51 Dy14 Ag51 Gd14,hP68,175 P6/m 1.2558,1.2558,0.9152,90,90,120 - - 16.37 X 6023
Au-Dy Au6Dy Au6Sm,tP56,138 P42/ncm 1.03,1.03,0.967,90,90,90 - - 17.41 A 6023
Au-Er AuEr ht CsCl,cP2,221 Pm-3m 0.3534,0.3534,0.3534,90,90,90 b.c.c. family - 13.70 X 24887
Au-Er AuEr rt TlI,oS8,63 Cmcm 0.365,1.081,0.458,90,90,90 CrB(TlI)-FeB - 13.39 X 6023
Au-Er AuEr2 Co2Si-b,oP12,62 Pnma 0.6996,0.48694,0.8802,90,90,90 - - 11.77 X 6023
Au-Er Au0.95 Er0.05 Cu,cF4,225 Fm-3m 0.4107,0.4107,0.4107,90,90,90 close-packed structure - 18.74 X 2818
Au-Er Au10 Er7 Au10 Gd7,tI136,142 I41/acd 1.017,1.017,2.763,90,90,90 - - 14.60 A 40028
Au-Er Au2Er MoSi2,tI6,139 I4/mmm 0.3663,0.3663,0.892,90,90,90 b.c.c. family - 15.57 X 6760
Au-Er Au3Er Cu3Ti,oP8,59 Pmmn 0.4955,0.6031,0.5084,90,90,90 close-packed structure - 16.57 X 6023
Au-Er Au4Er MoNi4,tI10,87 I4/m 0.6639,0.6639,0.41575,90,90,90 close-packed structure - 17.31 X 6023
Au-Eu AuEu rt FeB-b,oP8,62 Pnma 0.7784,0.4699,0.6054,90,90,90 CrB(TlI)-FeB - 10.47 A 17094
Au-Eu AuEu3 Fe3C-b,oP16,62 Pnma 0.8049,1.03,0.7014,90,90,90 - - 7.46 A 17094
Au-Eu Au2Eu KHg2,oI12,74 Imma 0.4715,0.7331,0.8171,90,90,90 AlB2 family - 12.84 A 17094
Au-Eu Au2Eu3 Er3Ni2,hR45,148 R-3 0.9402,0.9402,1.809,90,90,120 - - 9.17 A 17094
Au-Eu Au3Eu7 Th7Fe3,hP20,186 P63mc 1.0834,1.0834,0.6909,90,90,120 - - 7.82 A 17094
Au-Eu Au5Eu CaCu5,hP6,191 P6/mmm 0.5576,0.5576,0.4575,90,90,120 - - 15.32 X 17094
Au-F AuF3 AuF3,hP24,178 P6122 0.51508,0.51508,1.62637,90,90,120 - orange 6.77 X 24741
Au-F AuF5 hex *,hP6,178 P6122 0.5664,0.5664,1.9221,90,90,120 - - 5.45 P 24016
Au-F AuF5 orth AuF5,oP48,62 Pnma 0.9366,1.5052,0.484,90,90,90 - brown red 5.68 X 38361
Au-F Au3F8 Au3F8,mP22,14 P121/c1 0.52721,1.07076,0.77469,90,132.25,90 - brown 7.62 X 36660
Au-Fe AuFe rt CuAu,tP2,123 P4/mmm 0.26516,0.26516,0.361,90,90,90 close-packed structure - 16.54 X 57761
Au-Fe Au0.04 Fe0.96 rt W,cI2,229 Im-3m 0.28885,0.28885,0.28885,90,90,90 b.c.c. family - 8.47 X 2533
Au-Fe Au0.08 Fe0.92 ht Cu,cF4,225 Fm-3m 0.368,0.368,0.368,90,90,90 close-packed structure - 8.95 X 356
Au-Fe Au0.5 Fe0.5 ht Cu,cF4,225 Fm-3m 0.417,0.417,0.417,90,90,90 close-packed structure - 11.58 X 57761
Au-Fe Au0.93 Fe0.07 ht Cu,cF4,225 Fm-3m 0.405,0.405,0.405,90,90,90 close-packed structure - 18.71 X 54849
Au-Fe Au3Fe Cu3Au,cP4,221 Pm-3m 0.399,0.399,0.399,90,90,90 close-packed structure - 16.91 X 50507
Au-Ga AuGa FeAs,oP8,62 Pnma 0.6267,0.3421,0.6397,90,90,90 AlB2 family - 12.92 X 350
Au-Ga AuGa2 hp *,o**,* - 0.4211,0.43105,1.12,90,90,90 - - - N 46792
Au-Ga AuGa2 CaF2 ,cF12,225 Fm-3m 0.60754,0.60754,0.60754,90,90,90 fluorite family blue 9.96 X 8690
Au-Ga Au0.875 Ga0.125 ht Nd,hP4,194 P63/mmc 0.28712,0.28712,0.93914,90,90,120 close-packed structure - 17.94 X 22849
Au-Ga Au0.88 Ga0.12 Cu,cF4,225 Fm-3m 0.40726,0.40726,0.40726,90,90,90 close-packed structure - 17.87 X 3136
Au-Ga Au2Ga rt Pd2As,oS24,36 Cmc21 0.3199,1.8023,0.6999,90,90,90 - white silver15.26 X 8306
Au-Ga Au7Ga2 ht Au7Ga2,hP27,189 P-62m 0.7724,0.7724,0.8751,90,90,120 Fe2P family - 16.73 X 6010
Au-Ga Au7Ga2 rt *,o**,* - 0.7643,0.8765,0.9009,90,90,90 - - - N 6010
Au-Gd AuGd ht CsCl,cP2,221 Pm-3m 0.36009,0.36009,0.36009,90,90,90 b.c.c. family - 12.60 X 2444
Au-Gd AuGd rt TlI,oS8,63 Cmcm 0.376,1.094,0.464,90,90,90 CrB(TlI)-FeB - 12.33 X 6023
Au-Gd AuGd2 Co2Si-b,oP12,62 Pnma 0.7116,0.49619,0.8998,90,90,90 - - 10.69 X 6023
Au-Gd Au0.994 Gd0.006 Cu,cF4,225 Fm-3m 0.4082,0.4082,0.4082,90,90,90 close-packed structure - 19.21 X 2818
Au-Gd Au10 Gd7 Au10 Gd7,tI136,142 I41/acd 1.0324,1.0324,2.8066,90,90,90 - - 13.64 X 31604
Au-Gd Au2Gd ht MoSi2,tI6,139 I4/mmm 0.37282,0.37282,0.90238,90,90,90 b.c.c. family - 14.59 X 6023
Au-Gd Au3Gd Cu3Ti,oP8,59 Pmmn 0.5005,0.615,0.5105,90,90,90 close-packed structure - 15.81 X 6023
Au-Gd Au4Gd3 Pu3Pd4,hR42,148 R-3 1.35,1.35,0.5995,90,90,120 b.c.c. family - 13.26 X 31604
Au-Gd Au51 Gd14 Ag51 Gd14,hP68,175 P6/m 1.26174,1.26174,0.91902,90,90,120 - - 16.05 X 6023
Au-Gd Au6Gd Au6Sm,tP56,138 P42/ncm 1.0419,1.0419,0.9681,90,90,90 - - 16.93 A 31604
Au-Ge AuGe3 m *,h**,* - 0.328,0.328,0.527,90,90,120 - - - N 15487
Au-Ge Au0.5 Ge0.5 m *,t**,* - 1.6444,1.6444,4.4982,90,90,90 - - - N 6808
Au-Ge Au0.73 Ge0.27 m1 *,t**,* - 1.297,1.297,1.247,90,90,90 - - - N 6808
Au-Ge Au0.73 Ge0.27 m2 *,t**,* - 1.239,1.239,2.017,90,90,90 - - - N 6808
Au-Ge Au0.73Ge0.27 m3 *,t**,* - 0.4127,0.4127,3.854,90,90,90 - - - N 6808
Au-Ge Au0.8 Ge0.2 m Mg,hP2,194 P63/mmc 0.2853,0.2853,0.4687,90,90,120 close-packed structure - 17.30 X 24858
Au-Ge Au0.975 Ge0.025 Cu,cF4,225 Fm-3m 0.4075,0.4075,0.4075,90,90,90 close-packed structure - 19.03 X 56797
Au-Ge Au3Ge m1 *,t**,* - 0.8993,0.8993,1.2469,90,90,90 - - - N 4880
Au-Ge Au3Ge m2 *,t**,* - 0.4127,0.4127,1.927,90,90,90 - - - N 4880
Au-Ge Au3Ge 2 m *,t**,* P42/nbc 1.163,1.163,2.249,90,90,90 - - - N 15487
26 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Hf AuHf rt CuTi,tP4,129 P4/nmm 0.3467,0.3467,0.6323,90,90,90 b.c.c. family - 16.41 A 1721


Au-Hf AuHf2 CuZr2,tI6,139 I4/mmm 0.32309,0.32309,1.16057,90,90,90 close-packed structure - 15.19 X 1765
Au-Hf Au0.02 Hf0.98 rt Mg,hP2,194 P63 /mmc 0.31995,0.31995,0.5054,90,90,120 close-packed structure - 13.26 X 37263
Au-Hf Au10Hf7 rt Zr7Ni10,oS68,64 Cmce 1.322,0.9772,0.9773,90,90,90 - - 16.94 A 37263
Au-Hf Au2Hf MoSi2,tI6,139 I4/mmm 0.3524,0.3524,0.867,90,90,90 b.c.c. family - 17.66 A 37263
Au-Hf Au3Hf Cu3Ti,oP8,59 Pmmn 0.4785,0.6038,0.4877,90,90,90 close-packed structure - 18.13 A 37263
Au-Hf Au4Hf Au4Zr,oP20,62 Pnma 0.5006,0.4844,1.427,90,90,90 close-packed structure - 18.55 A 37263
Au-Hf Au4.2 Hf0.8 MoNi4,tI10,87 I4/m 0.6529,0.6529,0.4028,90,90,90 close-packed structure - 18.76 A 1783
Au-Hg Au0.75 Hg0.25 Mg,hP2,194 P63 /mmc 0.2918,0.2918,0.48112,90,90,120 close-packed structure golden 18.52 X 3587
Au-Hg Au0.80 Hg0.20 *,hP36,* - 0.8736,0.8736,0.9577,90,90,120 - - - N 3587
Au-Hg Au0.828 Hg0.172 Cu,cF4,225 Fm-3m 0.41214,0.41214,0.41214,90,90,90 close-packed structure - 18.75 X 986
Au-Hg Au2Hg *,hP*,* - 1.398,1.398,1.72,90,90,120 - gray silver - N 3587
Au-Hg Au6Hg5 rt Au6Hg5,hP22,193 P63 /mcm 0.69937,0.69937,1.0148,90,90,120 - gray 16.88 X 5065
Au-Ho AuHo ht CsCl,cP2,221 Pm-3m 0.3541,0.3541,0.3541,90,90,90 b.c.c. family - 13.54 X 1914
Au-Ho AuHo rt TlI,oS8,63 Cmcm 0.3685,1.0835,0.4595,90,90,90 CrB(TlI)-FeB - 13.10 X 6023
Au-Ho AuHo2 Co2Si-b,oP12,62 Pnma 0.7025,0.48922,0.88482,90,90,90 - - 11.51 X 6023
Au-Ho Au10Ho7 Au10Gd7,tI136,142 I41/acd 1.021,1.021,2.772,90,90,90 - - 14.36 A 40028
Au-Ho Au2Ho MoSi2,tI6,139 I4/mmm 0.3678,0.3678,0.894,90,90,90 b.c.c. family - 15.35 X 6759
Au-Ho Au3Ho Cu3Ti,oP8,59 Pmmn 0.4966,0.60598,0.50864,90,90,90 close-packed structure - 16.40 X 6023
Au-Ho Au4Ho ht MoNi4,tI10,87 I4/m 0.66534,0.66534,0.4174,90,90,90 close-packed structure - 17.13 X 6023
Au-Ho Au51Ho14 Ag51Gd14,hP68,175 P6/m 1.2545,1.2545,0.9135,90,90,120 - - 16.48 X 6023
Au-Ho Au6Ho Au6Sm,tP56,138 P42 /ncm 1.029,1.029,0.966,90,90,90 - - 17.49 A 6023
Au-I AuI AuI,tP8,138 P42 /ncm 0.435,0.435,1.373,90,90,90 - yellowish 8.28 X 1171
Au-In AuIn *,aP*,* - 0.356,0.43,1.059,90.17,90.54,90. - - - N 19083
Au-In AuIn2 hp PbCl2,mP24,14 P121/c1 0.8114,0.451,1.2145,90,96.,90 - - 12.82 A 55271
Au-In AuIn2 CaF2,cF12,225 Fm-3m 0.65075,0.65075,0.65075,90,90,90 fluorite family blue 10.28 X 7720
Au-In Au0.8 In0.2 o-d Mg,hP2,194 P63 /mmc 0.29,0.29,0.49,90,90,120 close-packed structure - 16.80 X 19083
Au-In Au0.87 In0.13 Nd,hP4,194 P63 /mmc 0.2909,0.2909,0.95,90,90,120 close-packed structure - 17.77 X 2332
Au-In Au0.92 In0.08 Cu,cF4,225 Fm-3m 0.40997,0.40997,0.40997,90,90,90 close-packed structure - 18.35 X 11635
Au-In Au10In3 rt Cu10Sb3,hP26,176 P63 /m 1.0536,1.0536,0.4788,90,90,120 close-packed structure - 16.70 A 2332
Au-In Au3In rt Cu3Ti,oP8,59 Pmmn 0.474,0.586,0.516,90,90,90 close-packed structure - 16.35 A 19083
Au-In Au3In tf *,hP*,* - 0.5828,0.5828,0.4732,90,90,120 - - - N 14232
Au-In Au3.1 In1.9 ht Ni2Al3,hP5,164 P-3m1 0.4538,0.4538,0.5645,90,90,120 - - 13.67 A 2332
Au-In Au7In3 rt Au7In3,hP60,147 P-3 1.2215,1.2215,0.8509,90,90,120 - - 15.62 X 9100
Au-In Au9In4 ht Au6(Au0.5 In0.5 )6In,cP76,215 P-43m 0.9829,0.9829,0.9829,90,90,90 γ-brass - 15.61 X 10484
Au-K KAu2 MgZn2,hP12,194 P63 /mmc 0.5623,0.5623,0.9791,90,90,120 Friauf-Laves phase - 10.73 X 20957
Au-K KAu5 CaCu5,hP6,191 P6/mmm 0.5663,0.5663,0.4483,90,90,120 - green 13.66 X 27413
Au-K K2Au3 K2Au3,oI10,71 Immm 0.4875,0.5454,1.0004,90,90,90 - golden 8.35 X 23088
Au-La AuLa ht TlI,oS8,63 Cmcm 0.395,1.12,0.478,90,90,90 CrB(TlI)-FeB - 10.55 X 6023
Au-La AuLa rt FeB-b,oP8,62 Pnma 0.752,0.469,0.596,90,90,90 CrB(TlI)-FeB - 10.61 X 6023
Au-La AuLa2 Co2Si-b,oP12,62 Pnma 0.7397,0.5107,0.941,90,90,90 - - 8.87 X 6023
Au-La AuLa4 m *,oI*,* - 0.654,0.771,1.132,90,90,90 - - - N 16932
Au-La Au2La KHg2,oI12,74 Imma 0.4811,0.7218,0.8324,90,90,90 AlB2 family - 12.24 A 22457
Au-La Au51La14 Ag51Gd14,hP68,175 P6/m 1.2871,1.2871,0.9388,90,90,120 - - 14.78 X 6023
Au-Li LiAu3 rt Cu3Au,cP4,221 Pm-3m 0.3973,0.3973,0.3973,90,90,90 close-packed structure - 15.83 X 1549
Au-Li Li0.4 Au0.6 Cu,cF4,225 Fm-3m 0.3968,0.3968,0.3968,90,90,90 close-packed structure - 12.86 X 1549
Au-Li Li0.52 Au0.48 *,o*2,* - 0.28,0.321,0.33,90,90,90 - - - N 1549
Au-Li Li0.54 Au0.46 *,t*2,* - 0.323,0.323,0.283,90,90,90 - - - N 1549
Au-Li Li1.1 Au0.9 m CsCl,cP2,221 Pm-3m 0.3098,0.3098,0.3098,90,90,90 b.c.c. family - 10.33 X 1549
Au-Li Li15Au4 Cu15Si4,cI76,220 I-43d 1.0833,1.0833,1.0833,90,90,90 - - 4.66 X 1549
Au-Li Li2Au ht *,h**,* - 0.723,0.723,0.277,90,90,120 - - - N 1549
Au-Li Li3Au BiF3,cF16,225 Fm-3m 0.6302,0.6302,0.6302,90,90,90 b.c.c. family - 5.78 X 1549
Au-Li Li4Au5 ht *,h**,* - 0.81,0.81,0.7,90,90,120 - - - N 1549
Au-Lu AuLu CsCl,cP2,221 Pm-3m 0.34955,0.34955,0.34955,90,90,90 b.c.c. family - 14.46 X 6023
Au-Lu AuLu2 Co2Si-b,oP12,62 Pnma 0.69062,0.48155,0.87024,90,90,90 - - 12.55 X 6023
Au-Lu Au0.93 Lu0.07 Cu,cF4,225 Fm-3m 0.4115,0.4115,0.4115,90,90,90 close-packed structure - 18.63 X 2818
Au-Lu Au2Lu MoSi2,tI6,139 I4/mmm 0.36228,0.36228,0.8873,90,90,90 b.c.c. family - 16.22 X 6023
Au-Lu Au3Lu ht Cu3Ti,oP8,59 Pmmn 0.4921,0.5962,0.5072,90,90,90 close-packed structure - 17.09 X 6023
Au-Lu Au4Lu MoNi4,tI10,87 I4/m 0.66239,0.66239,0.41165,90,90,90 close-packed structure - 17.70 X 6023
Au-Mg MgAu CsCl,cP2,221 Pm-3m 0.327,0.327,0.327,90,90,90 b.c.c. family white 10.51 X 17376
Au-Mg MgAu3 Au+ MgAu3,oS64,63 Cmcm 0.5747,1.995,0.9437,90,90,90 close-packed structure - 15.11 X 2864
Au-Mg MgAu3 Mg+ MgAu3,oS160,63 Cmcm 0.574,1.983,2.359,90,90,90 close-packed structure - 15.22 X 2864
Au-Mg Mg0.142 Au0.858 Cu,cF4,225 Fm-3m 0.4073,0.4073,0.4073,90,90,90 close-packed structure - 16.95 X 53103
Au-Mg Mg0.8 Au3.2 ht ZrAl3,tI16,139 I4/mmm 0.4073,0.4073,1.63,90,90,90 close-packed structure - 15.96 A 2864
Au-Mg Mg0.999 Au0.001 Mg,hP2,194 P63 /mmc 0.32022,0.32022,0.51992,90,90,120 close-packed structure - 1.76 X 199
Au-Mg Mg13Au41 rt Mg13Au41,hP108,193 P63 /mcm 1.4927,1.4927,0.9441,90,90,120 close-packed structure - 15.30 X 3816
Au-Mg Mg2Au Mg2Au,oP108,62 Pnma 1.8328,1.3561,0.8253,90,90,90 - - 7.16 X 17376
Au-Mg Mg3Au Cu3P,hP24,185 P63 cm 0.80594,0.80594,0.84801,90,90,120 - - 5.64 X 27391
Au-Mn AuMn rt Mn+ AuMn,oP2,47 Pmmm 0.3140,0.3176,0.3284,90,90,90 - - 12.77 X 1128
Au-Mn AuMn2 rt MoSi2,tI6,139 I4/mmm 0.3328,0.3328,0.8539,90,90,90 b.c.c. family - 10.78 X 4952
Au-Mn AuMn3 rt AuMn3,tP12,123 P4/mmm 0.4706,0.4706,0.8539,90,90,90 b.c.c. family - 9.53 X 2492
Au-Mn Au0.52 Mn0.48 rt *,t**,* - 0.3262,0.3262,0.3099,90,90,90 - - - N 547
Au-Mn Au0.75 Mn0.25 ht Cu,cF4,225 Fm-3m 0.40591,0.40591,0.40591,90,90,90 close-packed structure - 16.04 X 8254
Au-Mn Au0.76 Mn0.24 rt Mg,hP2,194 P63 /mmc 0.28578,0.28578,0.47297,90,90,120 close-packed structure - 16.17 X 1570
Au-Mn Au0.8 Mn1.2 ht CsCl,cP2,221 Pm-3m 0.3194,0.3194,0.3194,90,90,90 b.c.c. family - 11.39 X 547
Au-Mn Au11Mn3 Au11Mn3,mP28,14 P121/c1 1.26,0.4,0.89,90,98.2,90 - - 17.44 X 14821
Au-Mn Au11Mn4 rt *,mS810,8 C1m1 1.4767,1.4359,6.368,90,90.41,90 - - - N 7983
Au-Mn Au2Mn rt MoSi2,tI6,139 I4/mmm 0.3363,0.3363,0.8592,90,90,90 b.c.c. family - 15.34 X 1056
Handbook of Inorganic Substances – Edition 2015 : Data 27

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Mn Au3Mn rt SrPb3,tP4,123 P4/mmm 0.40418,0.40418,0.40645,90,90,90 close-packed structure - 16.15 X 2423


Au-Mn Au4Mn rt MoNi4,tI10,87 I4/m 0.645,0.645,0.403,90,90,90 close-packed structure - 16.70 X 1265
Au-Mn Au5Mn2 rt Au5Mn2,mS14,12 C12/m1 0.9188,0.3954,0.6479,90,97.56,90 close-packed structure - 15.58 X 2079
Au-Mo Au0.11 Mo0.89 W,cI2,229 Im-3m 0.31467,0.31467,0.31467,90,90,90 b.c.c. family - 11.41 X 521
Au-Mo Au0.99 Mo0.01 Cu,cF4,225 Fm-3m 0.41003,0.41003,0.41003,90,90,90 close-packed structure - 18.88 X 521
Au-Na NaAu2 MgCu2,cF24,227 Fd-3m 0.7815,0.7815,0.7815,90,90,90 Friauf-Laves phase golden 11.60 X 27412
Au-Na Na2Au CuAl2,tI12,140 I4/mcm 0.72817,0.72817,0.54784,90,90,90 - - 5.56 X 57169
Au-Na Na3Au hp1 Cu3P,hP24,185 P63cm 0.87488,0.87488,0.9077,90,90,120 - - 4.40 X 57169
Au-Na Na3Au hp2 BiF3 ,cF16,225 Fm-3m 0.69948,0.69948,0.69948,90,90,90 b.c.c. family - 5.16 X 57169
Au-Nb Au0.3 Nb0.7 ht W,cI2,229 Im-3m 0.3275,0.3275,0.3275,90,90,90 b.c.c. family - 11.74 X 14351
Au-Nb Au0.8 Nb0.2 Cu,cF4,225 Fm-3m 0.4077,0.4077,0.4077,90,90,90 close-packed structure - 17.27 X 7829
Au-Nb Au1.02 Nb2.98 rt Cr3Si,cP8,223 Pm-3n 0.5192,0.5192,0.5192,90,90,90 Frank-Kasper phase - 11.34 X 34396
Au-Nb Au2Nb rt Hg2U,hP3,191 P6/mmm 0.463,0.463,0.273,90,90,120 AlB2 family - 15.95 X 1488
Au-Nb Au2Nb3 rt Au2Nb3,tI10,139 I4/mmm 0.3391,0.3391,1.518,90,90,90 b.c.c. family - 12.80 X 34396
Au-Nb Au2.25 Nb2.75 (N) Mg3 Ru2,cP20,213 P4132 0.7092,0.7092,0.7092,90,90,90 - - 13.01 X 34396
Au-Nd AuNd ht1 TlI,oS8,63 Cmcm 0.384,1.107,0.47,90,90,90 CrB(TlI)-FeB - 11.34 X 6023
Au-Nd AuNd ht2 CsCl,cP2,221 Pm-3m 0.3659,0.3659,0.3659,90,90,90 b.c.c. family - 11.57 X 1914
Au-Nd AuNd rt FeB-b,oP8,62 Pnma 0.732,0.461,0.589,90,90,90 CrB(TlI)-FeB - 11.40 X 6023
Au-Nd AuNd2 Co2Si-b,oP12,62 Pnma 0.7213,0.5025,0.9235,90,90,90 - - 9.63 X 6023
Au-Nd Au36 Nd17 ht Au36 Nd17,tP106,129 P4/nmm 1.5835,1.5835,0.9278,90,90,90 - - 13.62 X 29646
Au-Nd Au51 Nd14 Ag51 Gd14,hP68,175 P6/m 1.27362,1.27362,0.92741,90,90,120 - - 15.38 X 6023
Au-Nd Au6Nd Au6Pr,mS28,15 C12/c1 0.774,0.772,0.907,90,100.1,90 - - 16.51 A 7928
Au-Ni Au0.08 Ni0.92 Cu,cF4,225 Fm-3m 0.3584,0.3584,0.3584,90,90,90 close-packed structure - 10.07 X 16223
Au-Ni Au3Ni Cu3Au,cP4,221 Pm-3m 0.4,0.4,0.4,90,90,90 close-packed structure - 16.86 X 50507
Au-O Au2O3 Au2O3,oF40,43 Fdd2 1.0520,1.2827,0.3838,90,90,90 - - 11.34 X 12086
Au-O Au3O2 tf Au3O2,oS20,63 Cmcm 0.528,0.9145,0.675,90,90,90 - - 12.69 X 908
Au-P Au2P 3 m Au2P 3,mS20,12 C12/m1 0.5863,1.4439,0.4674,90,108.39,90 - black 8.61 X 12210
Au-P Au2P 3 prec *,hP20,* - 0.613,0.613,1.108,90,90,120 - gray - N 6884
Au-Pb AuPb2 CuAl2,tI12,140 I4/mcm 0.7338,0.7338,0.5658,90,90,90 - gray silver 13.33 X 6743
Au-Pb AuPb3 ht V3S,tI32,121 I-42m 1.1959,1.1959,0.5877,90,90,90 - - 12.94 X 6193
Au-Pb Au0.0009Pb0.9991 Cu,cF4,225 Fm-3m 0.49503,0.49503,0.49503,90,90,90 close-packed structure - 11.34 X 12652
Au-Pb Au2Pb MgCu2,cF24,227 Fd-3m 0.7911,0.7911,0.7911,90,90,90 hunchunite - 16.13 X 74
Au-Pd Au0.67 Pd0.33 ht Cu,cF4,225 Fm-3m 0.4002,0.4002,0.4002,90,90,90 close-packed structure - 17.31 X 49437
Au-Pr AuPr ht1 TlI,oS8,63 Cmcm 0.387,1.11,0.472,90,90,90 CrB(TlI)-FeB - 11.07 X 6023
Au-Pr AuPr ht2 CsCl,cP2,221 Pm-3m 0.368,0.368,0.368,90,90,90 b.c.c. family - 11.26 X 1914
Au-Pr AuPr rt FeB-b,oP8,62 Pnma 0.738,0.463,0.59,90,90,90 CrB(TlI)-FeB - 11.13 X 6023
Au-Pr AuPr2 Co2Si-b,oP12,62 Pnma 0.721,0.504,0.925,90,90,90 - - 9.46 X 6195
Au-Pr Au2Pr rt KHg2,oI12,74 Imma 0.4672,0.704,0.8178,90,90,90 AlB2 family - 13.21 X 6023
Au-Pr Au36 Pr17 ht Au36 Nd17,tP106,129 P4/nmm 1.5955,1.5955,0.9348,90,90,90 - - 13.24 A 51925
Au-Pr Au4Pr3 Pu3Pd4,hR42,148 R-3 1.381,1.381,0.6131,90,90,120 b.c.c. family - 11.91 A 51925
Au-Pr Au51 Pr14 Ag51 Gd14,hP68,175 P6/m 1.2769,1.2769,0.9305,90,90,120 - - 15.19 X 6023
Au-Pr Au6Pr Au6Pr,mS28,15 C12/c1 0.7765,0.7745,0.9076,90,100.3,90 - - 16.36 X 7928
Au-Pt Au0.6 Pt0.4 Cu,cF4,225 Fm-3m 0.401,0.401,0.401,90,90,90 close-packed structure - 20.21 X 50774
Au-Pu Au51 Pu14 Ag51 Gd14,hP68,175 P6/m 1.271,1.271,0.921,90,90,120 - - 17.35 A 3725
Au-Rb RbAu CsCl,cP2,221 Pm-3m 0.4098,0.4098,0.4098,90,90,90 b.c.c. family black 6.81 X 28110
Au-Rb RbAu5 CaCu5,hP6,191 P6/mmm 0.5762,0.5762,0.4442,90,90,120 - green 13.92 X 27413
Au-Rb Rb2Au3 K2Au3,oI10,71 Immm 0.4942,0.5442,1.0601,90,90,90 - gray silver 8.87 X 28786
Au-Rb Rb3Au7 Rb3Au7,oS20,65 Cmmm 0.5585,1.3252,0.7258,90,90,90 - gray silver 10.11 X 27439
Au-Rh Au0.05 Rh0.95 Cu,cF4,225 Fm-3m 0.3821,0.3821,0.3821,90,90,90 close-packed structure - 12.81 X 51331
Au-Rh Au0.35 Rh0.65 Cu,cF4,225 Fm-3m 0.3911,0.3911,0.3911,90,90,90 close-packed structure - 15.08 X 58807
Au-S Au2S Cu2O,cP6,224 Pn-3m 0.50206,0.50206,0.50206,90,90,90 - brown 11.18 X 31003
Au-Sb AuSb2 FeS2 ,cP12,205 Pa-3 0.66583,0.66583,0.66583,90,90,90 aurostibite white 9.91 X 2521
Au-Sb AuSb3 m AuSb3,cI8,229 Im-3m 0.608,0.608,0.608,90,90,90 - - 8.31 X 1498
Au-Sb Au0.2 Sb0.8 m Po,cP1,221 Pm-3m 0.2693,0.2693,0.2693,90,90,90 - - 11.63 X 4280
Au-Sb Au0.99 Sb0.01 Cu,cF4,225 Fm-3m 0.4083,0.4083,0.4083,90,90,90 close-packed structure - 19.15 X 254
Au-Sc AuSc CsCl,cP2,221 Pm-3m 0.3369,0.3369,0.3369,90,90,90 b.c.c. family - 10.51 X 33221
Au-Sc AuSc 2 PbCl2,oP12,62 Pnma 0.647,0.4667,0.8358,90,90,90 - - 7.55 A 33221
Au-Sc Au0.92 Sc0.08 Cu,cF4,225 Fm-3m 0.4091,0.4091,0.4091,90,90,90 close-packed structure - 17.93 X 2818
Au-Sc Au15.7 Sc55.3 Au15.7 Sc55.3 ,oI146,71 Immm 1.436,1.4476,1.4833,90,90,90 - - 6.01 X 33221
Au-Sc Au2Sc MoSi2,tI6,139 I4/mmm 0.351,0.351,0.8728,90,90,90 b.c.c. family - 13.56 A 33221
Au-Sc Au3Sc Cu3Ti,oP8,59 Pmmn 0.4823,0.58,0.5003,90,90,90 close-packed structure - 15.09 A 33221
Au-Sc Au4Sc MoNi4,tI10,87 I4/m 0.6546,0.6546,0.4037,90,90,90 close-packed structure - 15.99 A 33221
Au-Se AuSe m AuSe,mS8,12 C12/m1 0.8355,0.3663,0.6262,90,106.03,90 - black 9.95 X 9920
Au-Se AuSe tf NiAs,hP4,194 P63/mmc 0.412,0.412,0.539,90,90,120 AlB2 family - 11.57 X 7066
Au-Se AuSe AuSe,mS16,12 C12/m1 1.2202,0.3690,0.8433,90,103.15,90 - black 9.91 X 9920
Au-Si AuSi3 m *,h**,* - 0.323,0.323,0.511,90,90,120 - - - N 15487
Au-Si Au0.60 Si0.40 m *,cF*,* - 1.9503,1.9503,1.9503,90,90,90 - - - N 6808
Au-Si Au0.60 Si0.40 m2 *,cP*,* - 0.402,0.402,0.402,90,90,90 - - - N 15487
Au-Si Au0.80 Si0.20 m1 *,c**,* - 0.675,0.675,0.675,90,90,90 - - - N 6808
Au-Si Au0.80 Si0.20 m2 *,cI10,* - 0.5558,0.5558,0.5558,90,90,90 - - - N 13852
Au-Si Au0.80 Si0.20 m3 *,oS*,* - 0.5543,0.7872,2.3633,90,90,90 - - - N 22001
Au-Si Au0.85 Si0.15 m *,cF*,* - 0.7844,0.7844,0.7844,90,90,90 - - - N 6808
Au-Si Au7Si3 m *,h**,* - 0.761,0.761,0.922,90,90,120 - - - N 15487
Au-Si Au9.97 Si3.03 m Cu5Zn8,cI52,217 I-43m 0.96,0.96,0.96,90,90,90 γ-brass - 15.38 A 22311
Au-Sm AuSm ht1 TlI,oS8,63 Cmcm 0.38,1.1,0.466,90,90,90 CrB(TlI)-FeB - 11.85 X 6023
Au-Sm AuSm ht2 CsCl,cP2,221 Pm-3m 0.3621,0.3621,0.3621,90,90,90 b.c.c. family - 12.15 X 1914
Au-Sm AuSm rt FeB-b,oP8,62 Pnma 0.725,0.457,0.583,90,90,90 CrB(TlI)-FeB - 11.95 X 6023
Au-Sm AuSm2 Co2Si-b,oP12,62 Pnma 0.7139,0.4982,0.9157,90,90,90 - - 10.15 X 6023
28 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Sm Au10Sm7 *,tI136,142 I41/acd 1.04,1.04,2.8254,90,90,90 - - - N 7471


Au-Sm Au2Sm ht *,t**,* - 1.045,1.045,2.83,90,90,90 - - - N 5630
Au-Sm Au3Sm rt Cu3Ti,oP8,59 Pmmn 0.4966,0.6397,0.5068,90,90,90 close-packed structure - 15.29 A 7471
Au-Sm Au36Sm17 Au36Nd17,tP106,129 P4/nmm 1.57,1.57,0.928,90,90,90 - - 14.01 A 6023
Au-Sm Au51Sm14 Ag51Gd14,hP68,175 P6/m 1.2673,1.2673,0.9232,90,90,120 - - 15.71 X 6023
Au-Sm Au6Sm Au6Sm,tP56,138 P42 /ncm 1.0395,1.0395,0.9706,90,90,90 - - 16.87 X 8015
Au-Sm Au7Sm6 *,hR39,166 R-3m 1.3607,1.3607,0.6039,90,90,120 - - - N 7471
Au-Sn AuSn NiAs,hP4,194 P63 /mmc 0.43218,0.43218,0.5523,90,90,120 yuanjiangite - 11.73 X 1869
Au-Sn AuSn2 AuSn2,oP24,61 Pbca 0.6898,0.7011,1.1773,90,90,90 - gray 10.13 X 47764
Au-Sn AuSn4 ht PtSn4,oS20,68 Ccce 0.652,1.173,0.652,90,90,90 - - 8.95 A 40144
Au-Sn AuSn4 rt PtPb4,tP10,125 P4/nbm 0.663,0.663,0.592,90,90,90 - - 8.57 X 32057
Au-Sn Au0.08 Sn0.92 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3177,0.3177,0.2957,90,90,120 - - 8.03 X 2985
Au-Sn Au0.88 Sn0.12 ht Mg,hP2,194 P63 /mmc 0.29115,0.29115,0.4785,90,90,120 close-packed structure - 17.73 X 33133
Au-Sn Au0.91 Sn0.09 ht Nd,hP4,194 P63 /mmc 0.2901,0.2901,0.9524,90,90,120 close-packed structure - 18.17 X 25728
Au-Sn Au0.970 Sn0.030 Cu,cF4,225 Fm-3m 0.40897,0.40897,0.40897,90,90,90 close-packed structure - 18.90 X 33133
Au-Sn Au3.6 Sn0.4 ht TiNi3,hP16,194 P63 /mmc 0.5808,0.5808,0.9536,90,90,120 close-packed structure - 18.04 A 1163
Au-Sn Au5Sn rt Au5Sn,hR18,155 R32 0.5092,0.5092,1.4333,90,90,120 close-packed structure - 17.08 X 8589
Au-Sn Au9Sn4 m Cu5Zn8,cI52,217 I-43m 0.98,0.98,0.98,90,90,90 γ-brass - 15.86 A 4316
Au-Sr SrAu SrAu,mP40,11 P121/m1 0.6192,0.4697,4.013,90,94.21,90 CrB(TlI)-FeB - 8.12 X 18261
Au-Sr SrAu2 KHg2,oI12,74 Imma 0.4732,0.7484,0.8165,90,90,90 AlB2 family gray green 11.06 X 31724
Au-Sr SrAu5 CaCu5,hP6,191 P6/mmm 0.5627,0.5627,0.4616,90,90,120 - - 14.07 X 1337
Au-Sr Sr3Au2 rt Er3Ni2,hR45,148 R-3 0.9604,0.9604,1.836,90,90,120 - - 6.69 X 18510
Au-Sr Sr7Au3 Th7Fe3,hP20,186 P63 mc 1.107,1.107,0.7161,90,90,120 - - 5.26 X 17470
Au-Ta Au0.33 Ta0.67 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 1.006,1.006,0.523,90,90,90 Frank-Kasper phase - 17.53 A 1559
Au-Ta Au0.5 Ta0.5 Pa,tI2,139 I4/mmm 0.338,0.338,0.305,90,90,90 b.c.c. family - 18.01 X 1559
Au-Ta Au0.75 Ta3.25 Cr3Si,cP8,223 Pm-3n 0.5224,0.5224,0.5224,90,90,90 Frank-Kasper phase - 17.14 X 5616
Au-Ta Au0.9 Ta0.1 Cu,cF4,225 Fm-3m 0.4085,0.4085,0.4085,90,90,90 close-packed structure - 19.04 X 1559
Au-Tb AuTb ht CsCl,cP2,221 Pm-3m 0.359,0.359,0.359,90,90,90 b.c.c. family - 12.77 X 37141
Au-Tb AuTb rt TlI,oS8,63 Cmcm 0.373,1.09,0.462,90,90,90 CrB(TlI)-FeB - 12.59 X 6023
Au-Tb AuTb2 Co2Si-b,oP12,62 Pnma 0.7078,0.4929,0.8938,90,90,90 - - 10.97 X 6023
Au-Tb Au0.987 Tb0.013 Cu,cF4,225 Fm-3m 0.4088,0.4088,0.4088,90,90,90 close-packed structure - 19.10 X 2818
Au-Tb Au10 Tb7 Au10Gd7,tI136,142 I41/acd 1.028,1.028,2.793,90,90,90 - - 13.87 A 37141
Au-Tb Au2 Tb MoSi2,tI6,139 I4/mmm 0.3707,0.3707,0.8987,90,90,90 b.c.c. family - 14.87 X 4114
Au-Tb Au3 Tb ht Cu3Ti,oP8,59 Pmmn 0.4992,0.6115,0.5096,90,90,90 close-packed structure - 16.01 X 6023
Au-Tb Au4 Tb3 Pu3Pd4,hR42,148 R-3 1.344,1.344,0.5973,90,90,120 b.c.c. family - 13.49 A 37141
Au-Tb Au51 Tb14 Ag51Gd14,hP68,175 P6/m 1.2579,1.2579,0.9166,90,90,120 - - 16.22 X 6023
Au-Tb Au6 Tb Au6Sm,tP56,138 P42 /ncm 1.032,1.032,0.969,90,90,90 - - 17.26 A 6023
Au-Te AuTe2 hp CdI2,hP3,164 P-3m1 0.4116,0.4116,0.5026,90,90,120 CdI2 -PbI2 polytype - 10.18 X 27132
Au-Te AuTe2 AuTe2,mS6,12 C12/m1 0.7189,0.4407,0.5069,90,90.04,90 calaverite yellow 9.35 X 27132
Au-Te Au0.38 Te0.62 m Po,cP1,221 Pm-3m 0.296,0.296,0.296,90,90,90 - - 9.86 X 1684
Au-Te Au22.7 Te36.4 Au22.7 Te36.4 ,aP61,1 P1 1.0783,1.2123,1.342,108.03,104.36,97.45 montbrayite white 9.61 X 25682
Au-Th AuTh TlI,oS8,63 Cmcm 0.381,1.1362,0.4587,90,90,90 CrB(TlI)-FeB - 14.35 A 19159
Au-Th AuTh2 CuAl2,tI12,140 I4/mcm 0.7462,0.7462,0.5989,90,90,90 - - 13.17 X 6743
Au-Th Au2 Th Hg2U,hP3,191 P6/mmm 0.4747,0.4747,0.3421,90,90,120 AlB2 family - 15.57 X 19159
Au-Th Au2 Th3 *,c**,* - 1.12,1.12,1.12,90,90,90 - - - N 19159
Au-Th Au4 Th3 Pu3Pd4,hR42,148 R-3 1.3732,1.3732,0.6129,90,90,120 b.c.c. family - 14.77 A 19159
Au-Th Au51 Th14 Ag51Gd14,hP68,175 P6/m 1.2808,1.2808,0.926,90,90,120 - - 16.78 A 26552
Au-Ti AuTi ht1 AuCd,oP4,51 Pmma 0.463,0.2944,0.488,90,90,90 close-packed structure - 12.23 A 1721
Au-Ti AuTi ht2 CsCl,cP2,221 Pm-3m 0.3254,0.3254,0.3254,90,90,90 b.c.c. family - 11.80 X 5319
Au-Ti AuTi rt CuTi,tP4,129 P4/nmm 0.3335,0.3335,0.6028,90,90,90 b.c.c. family - 12.13 A 1721
Au-Ti AuTi3 rt Cr3Si,cP8,223 Pm-3n 0.50974,0.50974,0.50974,90,90,90 Frank-Kasper phase - 8.54 X 3823
Au-Ti AuTi3 stab Cu3Au,cP4,221 Pm-3m 0.4096,0.4096,0.4096,90,90,90 close-packed structure - 8.23 X 2084
Au-Ti Au0.35 Ti0.65 m *,hP*,* - 0.327,0.327,0.526,90,90,120 - - - N 16444
Au-Ti Au0.88 Ti0.12 Cu,cF4,225 Fm-3m 0.4065,0.4065,0.4065,90,90,90 close-packed structure - 17.71 X 1457
Au-Ti Au2 Ti MoSi2,tI6,139 I4/mmm 0.343,0.343,0.8538,90,90,90 b.c.c. family - 14.61 X 1128
Au-Ti Au4 Ti MoNi4,tI10,87 I4/m 0.646,0.646,0.3975,90,90,90 close-packed structure - 16.73 A 1457
Au-Tl AuTl2 CuAl2,tI12,140 I4/mcm 0.726,0.726,0.56,90,90,90 - - 13.63 A 6743
Au-Tl Au0.99 Tl0.01 Cu,cF4,225 Fm-3m 0.4075,0.4075,0.4075,90,90,90 close-packed structure - 19.34 X 263
Au-Tm AuTm ht CsCl,cP2,221 Pm-3m 0.3516,0.3516,0.3516,90,90,90 b.c.c. family - 13.98 X 1914
Au-Tm AuTm rt TlI,oS8,63 Cmcm 0.362,1.078,0.457,90,90,90 CrB(TlI)-FeB - 13.63 X 6023
Au-Tm AuTm2 Co2Si-b,oP12,62 Pnma 0.6958,0.4834,0.8767,90,90,90 - - 12.05 X 6023
Au-Tm Au0.94 Tm0.06 Cu,cF4,225 Fm-3m 0.4112,0.4112,0.4112,90,90,90 close-packed structure - 18.66 X 2818
Au-Tm Au10 Tm7 Au10Gd7,tI136,142 I41/acd 1.008,1.008,2.748,90,90,90 - - 15.00 A 40028
Au-Tm Au2 Tm MoSi2,tI6,139 I4/mmm 0.3644,0.3644,0.8896,90,90,90 b.c.c. family - 15.83 X 5342
Au-Tm Au3 Tm Cu3Ti,oP8,59 Pmmn 0.4943,0.6016,0.5071,90,90,90 close-packed structure - 16.73 X 6023
Au-Tm Au4 Tm MoNi4,tI10,87 I4/m 0.6634,0.6634,0.41413,90,90,90 close-packed structure - 17.44 X 6023
Au-U Au2U Hg2U,hP3,191 P6/mmm 0.4756,0.4756,0.311,90,90,120 AlB2 family gray faint 17.23 X 31884
Au-U Au51U14 Ag51Gd14,hP68,175 P6/m 1.26521,1.26521,0.91381,90,90,120 - white 17.54 X 23532
Au-V AuV3 rt Cr3Si,cP8,223 Pm-3n 0.48813,0.48813,0.48813,90,90,90 Frank-Kasper phase - 9.99 X 3823
Au-V AuV3 stab Cu3Au,cP4,221 Pm-3m 0.3964,0.3964,0.3964,90,90,90 close-packed structure - 9.33 X 2084
Au-V Au0.25 V0.75 ht W,cI2,229 Im-3m 0.3063,0.3063,0.3063,90,90,90 b.c.c. family - 10.11 X 9380
Au-V Au0.8 V0.2 ht Cu,cF4,225 Fm-3m 0.4047,0.4047,0.4047,90,90,90 close-packed structure - 16.81 X 13521
Au-V Au2 V rt Au2 V,oS12,63 Cmcm 0.8482,0.4810,0.4684,90,90,90 close-packed structure - 15.46 X 1783
Au-V Au4 V rt MoNi4,tI10,87 I4/m 0.6361,0.6361,0.4009,90,90,90 close-packed structure - 17.17 X 46769
Au-Y AuY CsCl,cP2,221 Pm-3m 0.3559,0.3559,0.3559,90,90,90 b.c.c. family - 10.53 X 1914
Au-Y AuY2 PbCl2,oP12,62 Pnma 0.7115,0.4933,0.8908,90,90,90 - gray silver 7.96 X 55665
Au-Y Au2 Y MoSi2,tI6,139 I4/mmm 0.3688,0.3688,0.8949,90,90,90 b.c.c. family - 13.17 A 4084
Au-Y Au2 Y3 U3Si2,tP10,127 P4/mbm 0.8059,0.8059,0.3907,90,90,90 - gray silver 8.65 X 55665
Handbook of Inorganic Substances – Edition 2015 : Data 29

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Y Au3 Y Cu3Ti,oP8,59 Pmmn 0.5084,0.6096,0.4968,90,90,90 close-packed structure - 14.66 A 4084


Au-Yb AuYb ht CsCl,cP2,221 Pm-3m 0.3584,0.3584,0.3584,90,90,90 b.c.c. family - 13.35 X 4701
Au-Yb AuYb rt FeB-b,oP8,62 Pnma 0.743,0.459,0.5849,90,90,90 CrB(TlI)-FeB - 12.32 X 6023
Au-Yb AuYb2 PbCl2,oP12,62 Pnma 0.7808,0.457,0.9409,90,90,90 - - 10.74 X 4701
Au-Yb Au0.94 Yb0.06 Cu,cF4,225 Fm-3m 0.41082,0.41082,0.41082,90,90,90 close-packed structure - 18.73 X 2818
Au-Yb Au2 Yb MoSi2,tI6,139 I4/mmm 0.3622,0.3622,0.88584,90,90,90 b.c.c. family - 16.20 X 5342
Au-Yb Au3 Yb Cu3Ti,oP8,59 Pmmn 0.4928,0.598,0.5077,90,90,90 close-packed structure - 16.96 X 4701
Au-Yb Au3 Yb5 Cr5B3,tI32,140 I4/mcm 0.7793,0.7793,1.426,90,90,90 - - 11.17 X 4701
Au-Yb Au3 Yb7 Th7Fe3,hP20,186 P63mc 1.0372,1.0372,0.6514,90,90,120 - - 9.86 X 4701
Au-Yb Au4 Yb MoNi4,tI10,87 I4/m 0.6628,0.6628,0.4128,90,90,90 close-packed structure - 17.60 X 4701
Au-Yb Au4 Yb5 Sm5 Ge4,oP36,62 Pnma 0.7752,1.5029,0.788,90,90,90 - - 11.96 X 4701
Au-Zn AuZn3 rt UH3 ,cP32,223 Pm-3n 0.7903,0.7903,0.7903,90,90,90 - - 10.58 X 1031
Au-Zn Au0.05 Zn0.95 Mg,hP2,194 P63/mmc 0.27078,0.27078,0.47534,90,90,120 close-packed structure - 7.92 X 2146
Au-Zn Au0.78 Zn0.22 Cu,cF4,225 Fm-3m 0.4034,0.4034,0.4034,90,90,90 close-packed structure - 17.00 X 254
Au-Zn Au0.81 Zn0.19 *,o*4,* - 0.4026,0.4034,0.4062,90,90,90 - - 17.31 N 924
Au-Zn Au1.04 Zn0.96 rt CsCl,cP2,221 Pm-3m 0.31426,0.31426,0.31426,90,90,90 b.c.c. family - 14.32 X 54860
Au-Zn Au2.5 Zn1.5 m Au(Au0.5 Zn0.5 )3,oP16,26 Pmc21 0.6345,0.8971,0.4486,90,90,90 b.c.c. family - 15.36 X 2728
Au-Zn Au2.84 Zn1.16 SrPb3,tP4,123 P4/mmm 0.3999,0.3999,0.4064,90,90,90 close-packed structure - 16.23 X 723
Au-Zn Au3Zn rt Au+ Au3Zn,tI64,142 I41/acd 0.5586,0.5586,3.34,90,90,90 close-packed structure - 16.73 X 1703
Au-Zn Au3Zn rt Zn+ Au3Zn,oS32,64 Cmce 1.66035,0.55813,0.55813,90,90,90 close-packed structure - 16.86 X 1703
Au-Zn Au5Zn3 rt Au5Zn3,oI128,72 Ibam 0.551,1.102,3.362,90,90,90 close-packed structure - 15.37 X 1032
Au-Zr AuZr ht AuZr,mP32,10 P12/m1 1.1695,0.4828,1.1719,90,107.09,90 - - 12.11 X 43143
Au-Zr AuZr rt AuZr,aP32,2 P-1 0.4841,1.1507,1.1537,75.18,87.59,87.42 - - 12.34 X 43143
Au-Zr AuZr2 rt CuZr2,tI6,139 I4/mmm 0.328,0.328,1.16,90,90,90 close-packed structure - 10.10 X 1765
Au-Zr AuZr3 Cr3Si,cP8,223 Pm-3n 0.5488,0.5488,0.5488,90,90,90 Frank-Kasper phase - 9.46 X 33220
Au-Zr Au0.925 Zr0.075 Cu,cF4,225 Fm-3m 0.4085,0.4085,0.4085,90,90,90 close-packed structure - 18.42 X 304
Au-Zr Au10 Zr7 rt *,tI34,* - 0.6949,0.6949,1.3272,90,90,90 - - - N 33220
Au-Zr Au2Zr MoSi2,tI6,139 I4/mmm 0.3555,0.3555,0.876,90,90,90 b.c.c. family - 14.55 A 33220
Au-Zr Au2Zr2 ht2 U3(U0.5 Mo0.5 ),tP4,123 P4/mmm 0.4835,0.4835,0.3416,90,90,90 close-packed structure - 11.99 X 43143
Au-Zr Au3Zr Cu3Ti,oP8,59 Pmmn 0.479,0.608,0.489,90,90,90 close-packed structure - 15.91 A 33220
Au-Zr Au4Zr Au4Zr,oP20,62 Pnma 0.5006,0.4845,1.4294,90,90,90 close-packed structure yellow 16.84 X 1783
B-Ba BaB6 CaB6,cP7,221 Pm-3m 0.42615,0.42615,0.42615,90,90,90 - black 4.34 X 39368
B-Be Be0.167 B B,tP196,76 P41 1.016,1.016,1.428,90,90,90 - red brick 2.64 F 1441
B-Be Be1.6 B25 Be1.6 B25,tP58,134 P42/nnm 0.88557,0.88557,0.51157,90,90,90 - - 2.36 X 43446
B-Be Be2B ht CaF2 ,cF12,225 Fm-3m 0.4663,0.4663,0.4663,90,90,90 fluorite family - 1.89 X 1370
B-Be Be4B Be4B,tP10,129 P4/nmm 0.338,0.338,0.706,90,90,90 - brownish 1.93 X 1777
B-Be Be4.9 B13.5 Be3.9 (Be0.5 B0.5 )2B12.5 ,hP120,191 P6/mmm 0.97738,0.97738,0.95467,90,90,120 - - 2.40 X 40443
B-Br BBr BCl,hR162,166 R-3m 1.3175,1.3175,1.7776,90,90,120 - red ruby 3.04 X 33513
B-Br BBr3 BCl3 ,hP8,176 P63/m 0.6406,0.6406,0.6864,90,90,120 - - 3.41 A 268
B-C BC1.6 ht-hp *,o**,* - 0.47943,0.59181,0.60517,90,90,90 - - 6.97 N 46711
B-C B0.026 C0.974 gra C,cF8,227 Fd-3m 0.35725,0.35725,0.35725,90,90,90 - black 3.49 X 47773
B-C B0.38 C0.62 ht-hp C,cF8,227 Fd-3m 0.35778,0.35778,0.35778,90,90,90 - - 3.35 X 46711
B-C B13C2 B13C2,hR45,166 R-3m 0.55985,0.55985,1.20664,90,90,120 - black 2.50 X 31959
B-C B25C B25C,tP68,134 P42/nnm 0.8753,0.8753,0.5093,90,90,90 - - 2.40 X 9472
B-C B90C12 *,o*102,* - 0.508,0.88,1.793,90,90,90 - - - N 4088
B-Ca CaB4 (C) UB4 ,tP20,127 P4/mbm 0.70989,0.70989,0.41353,90,90,90 - - 2.66 X 46433
B-Ca CaB6 CaB6,cP7,221 Pm-3m 0.41514,0.41514,0.41514,90,90,90 - black 2.44 X 43098
B-Ce CeB4 UB4 ,tP20,127 P4/mbm 0.72034,0.72034,0.41006,90,90,90 - black 5.72 X 49768
B-Ce CeB6 rt CaB6,cP7,221 Pm-3m 0.41429,0.41429,0.41429,90,90,90 - purple dark 4.79 X 50013
B-Cl BCl cub BCl,cP96,205 Pa-3 1.24498,1.24498,1.24498,90,90,90 - blue dark 1.91 X 55631
B-Cl BCl orth BCl,oP64,19 P212121 0.785,1.291,1.364,90,90,90 - purple 1.78 X 2908
B-Cl BCl rhom BCl,hR162,166 R-3m 1.2596,1.2596,1.7001,90,90,120 - orange 1.78 X 33513
B-Cl BCl tet BCl,tP16,137 P42/nmc 0.809,0.809,0.5451,90,90,90 - - 1.72 X 486
B-Cl BCl2 BCl2 ,oP24,61 Pbca 0.6281,0.769,1.19,90,90,90 - - 1.89 X 882
B-Cl BCl3 lt BCl3 ,hP8,176 P63/m 0.608,0.608,0.655,90,90,120 - - 1.86 X 881
B-Co CoB FeB-b,oP8,62 Pnma 0.5243,0.3037,0.3948,90,90,90 CrB(TlI)-FeB - 7.37 X 57
B-Co CoB0.02 NaCl,cF8,225 Fm-3m 0.35452,0.35452,0.35452,90,90,90 rocksalt family - 8.82 X 38370
B-Co Co0.01 B rhom1 B,hR423,166 R-3m 1.0944,1.0944,2.3834,90,90,120 β-boron family - 2.46 F 33293
B-Co Co2 B CuAl2,tI12,140 I4/mcm 0.5016,0.5016,0.422,90,90,90 - - 8.05 X 3793
B-Co Co23 B6 Cr23 C6,cF116,225 Fm-3m 1.04618,1.04618,1.04618,90,90,90 - - 8.24 X 52971
B-Co Co3 B Fe3C-b,oP16,62 Pnma 0.5229,0.6631,0.4432,90,90,90 - - 8.11 A 16223
B-Cr CrB B+ MoB,tI16,141 I41/amd 0.294,0.294,1.572,90,90,90 - - 6.14 A 7669
B-Cr CrB rt TlI,oS8,63 Cmcm 0.29782,0.787,0.29346,90,90,90 CrB(TlI)-FeB - 6.07 X 20380
B-Cr CrB0.026 stab1 Mg,hP2,194 P63/mmc 0.27606,0.27606,0.44154,90,90,120 close-packed structure - 5.96 F 6151
B-Cr CrB2 AlB2 ,hP3,191 P6/mmm 0.2975,0.2975,0.307,90,90,120 AlB2 family - 5.20 X 20460
B-Cr CrB4 rt CrB4,oI10,71 Immm 0.28717,0.47482,0.54856,90,90,90 - gray silver 4.23 X 56265
B-Cr Cr2B Mg2 Cu,oF48,70 Fddd 0.4275,0.7452,1.4795,90,90,90 - black 6.47 X 51406
B-Cr Cr2B3 (Al) V2B3,oS20,63 Cmcm 0.30264,1.8115,0.29542,90,90,90 - - 5.60 X 20380
B-Cr Cr2.51 B103 rhom1 Cr2.5 B103.3 ,hR339,166 R-3m 1.09637,1.09637,2.38477,90,90,120 β-boron family - 2.50 X 5447
B-Cr Cr3B4 Ta3B4,oI14,71 Immm 0.29516,0.30004,1.3018,90,90,90 - - 5.74 X 20380
B-Cr Cr5B3 Cr5B3,tI32,140 I4/mcm 0.546,0.546,1.064,90,90,90 - - 6.12 X 507
B-Cu Cu3.7 B103.9 rhom1 Cu4.5 B103 ,hR399,166 R-3m 1.09703,1.09703,2.38898,90,90,120 β-boron family - 2.72 X 8356
B-D B5D7 B5H7,mP96,13 P12/c1 1.23688,0.562,1.423,90,125.016,90 - colorless 1.12 X 4644
B-Dy DyB12 rt UB12 ,cF52,225 Fm-3m 0.7493,0.7493,0.7493,90,90,90 - - 4.61 A 46652
B-Dy DyB2 AlB2 ,hP3,191 P6/mmm 0.32924,0.32924,0.38517,90,90,120 AlB2 family - 8.46 X 55304
B-Dy DyB4 rt UB4 ,tP20,127 P4/mbm 0.7021,0.7021,0.3972,90,90,90 - - 6.98 X 10273
B-Dy DyB6 CaB6,cP7,221 Pm-3m 0.40998,0.40998,0.40998,90,90,90 - - 5.48 A 46652
B-Dy DyB66 YB66 ,cF1936,226 Fm-3c 2.3381,2.3381,2.3381,90,90,90 - - 2.73 A 46652
30 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Dy Dy0.56 B14 Tb0.56 B14,mS60,12 C12/m1 1.01023,1.0325,0.5856,90,124.986,90 - - 3.22 A 38960


B-Er ErB12 rt UB12,cF52,225 Fm-3m 0.74815,0.74815,0.74815,90,90,90 - - 4.71 A 46652
B-Er ErB2 AlB2,hP3,191 P6/mmm 0.3273,0.3273,0.37835,90,90,120 AlB2 family golden 8.94 X 55304
B-Er ErB4 lt *,oP20,* - 0.39932,0.70787,0.70789,90,90,90 - - - N 19225
B-Er ErB4 rt UB4,tP20,127 P4/mbm 0.7071,0.7071,0.4,90,90,90 - - 6.99 X 14300
B-Er ErB6 CaB6,cP7,221 Pm-3m 0.41165,0.41165,0.41165,90,90,90 - blue 5.53 A 28809
B-Er ErB66 YB66,cF1936,226 Fm-3c 2.3436,2.3436,2.3436,90,90,90 - - 2.73 A 46652
B-Er Er0.56 B14 Tb0.56 B14,mS60,12 C12/m1 1.00884,1.0309,0.5856,90,125.022,90 - - 3.26 A 38960
B-Eu EuB6 CaB6,cP7,221 Pm-3m 0.41849,0.41849,0.41849,90,90,90 - gray dark 4.91 X 30154
B-F BF2 BF2,mP12,14 P121/c1 0.4826,0.6530,0.6475,90,124.2,90 - - 1.92 X 980
B-F BF3 m BF3,mP32,14 P121/c1 0.4779,1.400,0.7430,90,107.60,90 - - 1.90 X 14732
B-F BF3 BF3,aP32,2 P-1 0.4730,0.7374,1.3987,87.21,89.22,72.70 - white 1.94 X 16952
B-F B17F27 B17F27,aP88,2 P-1 0.7321,1.3176,1.3529,69.364,79.511,81.299 - colorless 1.94 X 41136
B-F B2F3 B2F3,mP320,13 P12/c1 2.4577,0.7334,2.5493,90,106.708,90 - yellow 1.90 X 41136
B-F B5F6 B5F6,tI88,88 I41/a 0.64118,0.64118,2.7551,90,90,90 - colorless 1.97 X 41136
B-Fe FeB m TlI,oS8,63 Cmcm 0.2951,0.7564,0.2953,90,90,90 CrB(TlI)-FeB - 6.72 A 25295
B-Fe FeB rt FeB-b,oP8,62 Pnma 0.54954,0.29408,0.40477,90,90,90 CrB(TlI)-FeB - 6.77 X 47699
B-Fe FeB2 AlB2,hP3,191 P6/mmm 0.3045,0.3045,0.3035,90,90,120 AlB2 family - 5.28 X 5461
B-Fe Fe0.91 B0.09 rt W,cI2,229 Im-3m 0.28603,0.28603,0.28603,90,90,90 b.c.c. family - 7.35 X 19476
B-Fe Fe2B CuAl2,tI12,140 I4/mcm 0.51059,0.51059,0.4251,90,90,90 - - 7.34 X 47699
B-Fe Fe2.1 B103.2 rhom1 Cr2.5 B103.3 ,hR339,166 R-3m 1.09514,1.09514,2.38609,90,90,120 β-boron family - 2.48 X 9972
B-Fe Fe22.29 B6.71 *,cF*,225 Fm-3m 1.0642,1.0642,1.0642,90,90,90 - - 7.26 N 44594
B-Fe Fe3B ht Ni3P,tI32,82 I-4 0.8655,0.8655,0.4297,90,90,90 - - 7.36 A 15740
B-Fe Fe3.11 B0.89 m Fe3C-b,oP16,62 Pnma 0.53612,0.66761,0.44673,90,90,90 - - 7.61 A 44594
B-Fe Fe7B m *,hP*,* - 0.5501,0.5501,0.7213,90,90,120 - - - N 20776
B-Ga GaB12 *,t*130,* - 1.293,1.293,0.484,90,90,90 - - - N 1424
B-Gd GdB12 hp-ht UB12,cF52,225 Fm-3m 0.7524,0.7524,0.7524,90,90,90 - - 4.48 A 10760
B-Gd GdB2 ht AlB2,hP3,191 P6/mmm 0.3319,0.3319,0.3944,90,90,120 AlB2 family - 7.89 X 43498
B-Gd GdB4 UB4,tP20,127 P4/mbm 0.71316,0.71316,0.40505,90,90,90 - blue 6.46 X 42288
B-Gd GdB6 CaB6,cP7,221 Pm-3m 0.41123,0.41123,0.41123,90,90,90 - black 5.30 X 583
B-Gd GdB66 YB66,cF1936,226 Fm-3c 2.34487,2.34487,2.34487,90,90,90 - - 2.69 A 13163
B-Gd Gd0.56 B14 Tb0.56 B14,mS60,12 C12/m1 1.01316,1.0339,0.5853,90,124.867,90 - - 3.16 A 38960
B-Gd Gd2B5 Gd2B5,mP28,14 P121/c1 0.7136,0.7159,0.7183,90,102.68,90 - gray silver 6.84 X 20928
B-Ge Ge1.14 B103 rhom1 Ge1.1 B102.9 ,hR465,166 R-3m 1.09588,1.09588,2.38622,90,90,120 β-boron family - 2.40 X 14299
B-H BH3 BH3,mP16,14 P121/c1 0.44,0.6487,0.62355,90,117.53,90 - colorless 0.58 X 43925
B-H B10H13 1,1' B10H13,oP184,61 Pbca 1.05515,1.45604,1.06601,90,90,90 - colorless 0.98 X 38405
B-H B10H13 1,5' B10H13,mP184,14 P121/c1 0.7235,1.5453,1.63971,90,114.754,90 - colorless 0.97 X 12331
B-H B10H13 1,6' B10H13-b,oP368,61 Pbca 1.13252,1.4045,2.08013,90,90,90 - colorless 0.97 X 46310
B-H B10H13 2,2' B10H13,tI368,110 I41cd 1.1901,1.1901,2.3135,90,90,90 - colorless 0.98 X 13309
B-H B10H13 2,6' B10H13-a,oP368,61 Pbca 1.158,1.4673,1.9765,90,90,90 - colorless 0.96 X 13309
B-H B13H19 B13H19,mP128,14 P121/c1 0.9217,0.6498,1.9719,90,97.69,90 - yellow 0.91 X 9826
B-H B2H3 B2H3,oP160,61 Pbca 1.0410,1.3613,1.0410,90,90,90 - - 0.89 X 2194
B-H B2H5 B2H5,mP56,14 P121/c1 0.558,1.014,0.8941,90,110.985,90 - - 0.75 X 2908
B-H B3H4 B3H4,oP112,33 Pna21 1.0686,0.8686,1.1351,90,90,90 - colorless 0.92 X 17059
B-H B3H5 mon B3H5,mP96,14 P121/c1 1.125,0.694,1.337,90,123.50,90 - - 0.86 X 883
B-H B3H5 orth B3H5,oS64,36 Cmc21 0.75,0.923,0.85,90,90,90 - - 0.85 X 981
B-H B4H5 B4H5,mP144,14 P121/c1 0.5849,1.367,1.675,90,100.83,90 - - 0.98 X 5231
B-H B5H11 B5H11,mP64,14 P121/c1 0.676,0.851,1.17575,90,120.683,90 - - 0.74 X 625
B-H B5H4 B5H4,tI288,142 I41/acd 0.965,0.965,2.964,90,90,90 - - 1.12 X 2247
B-H B5H7 mon B5H7,mP96,13 P12/c1 1.244,0.562,1.432,90,125.08,90 - - 0.99 X 5673
B-H B5H7 orth B5H7,oP80,58 Pnnm 0.7255,1.044,0.568,90,90,90 - - 0.94 X 336
B-H B5H8 B5H8,oP104,33 Pna21 1.102,0.587,1.4988,90,90,90 - - 0.85 X 18968
B-H B5H9 lt B5H9,tP112,76 P41 1.0201,1.0201,0.9996,90,90,90 - - 0.81 X 36074
B-H B5H9 rt B5H9,tI28,107 I4mm 0.716,0.716,0.538,90,90,90 - - 0.76 X 415
B-H B7H10 B7H10,oP136,19 P212121 0.8963,0.9976,1.3119,90,90,90 - yellow 0.97 X 14170
B-H B9H11 mon B9H11,mP160,14 P121/c1 0.9199,1.3180,1.2515,90,109.58,90 - - 1.01 X 1925
B-H B9H11 orth B9H11,oP160,56 Pccn 1.0844,1.2107,1.0803,90,90,90 - - 1.02 X 1926
B-Hf HfB NaCl,cF8,225 Fm-3m 0.462,0.462,0.462,90,90,90 rocksalt family - 12.75 X 3543
B-Hf HfB12 hp-ht UB12,cF52,225 Fm-3m 0.7377,0.7377,0.7377,90,90,90 - - 5.10 A 16164
B-Hf HfB2 AlB2,hP3,191 P6/mmm 0.31425,0.31425,0.3476,90,90,120 AlB2 family gray dark 11.18 X 20578
B-Hf Hf0.44 B104.8 rhom1 Ti2.0 B103.2 ,hR357,166 R-3m 1.0948,1.0948,2.3909,90,90,120 β-boron family - 2.43 X 21551
B-Ho HoB12 rt UB12,cF52,225 Fm-3m 0.75032,0.75032,0.75032,90,90,90 - - 4.63 A 46652
B-Ho HoB2 AlB2,hP3,191 P6/mmm 0.32628,0.32628,0.37586,90,90,120 AlB2 family - 8.94 X 55304
B-Ho HoB4 lt *,oP20,* - 0.4002,0.7077,0.7088,90,90,90 - - 6.89 N 55649
B-Ho HoB4 rt UB4,tP20,127 P4/mbm 0.70842,0.70842,0.4006,90,90,90 - black 6.88 X 55649
B-Ho HoB6 CaB6,cP7,221 Pm-3m 0.4116,0.4116,0.4116,90,90,90 - - 5.47 A 46652
B-Ho HoB66 YB66,cF1936,226 Fm-3c 2.3365,2.3365,2.3365,90,90,90 - - 2.74 A 46652
B-Ho Ho0.56 B14 Tb0.56 B14,mS60,12 C12/m1 1.00969,1.0319,0.5858,90,125.002,90 - - 3.24 A 38960
B-I BI3 BCl3,hP8,176 P63 /m 0.69909,0.69909,0.73642,90,90,120 - colorless 4.17 X 39557
B-Ir IrB0.02 NaCl,cF8,225 Fm-3m 0.38402,0.38402,0.38402,90,90,90 rocksalt family - 22.57 X 38370
B-Ir IrB0.9 ht WC,hP2,187 P-6m2 0.2815,0.2815,0.2823,90,90,120 AlB2 family - 17.31 X 6169
B-Ir IrB0.9 rt IrB0.9 ,oS16,36 Cmc21 0.2771,0.7578,0.7314,90,90,90 - - 17.47 X 6169
B-Ir IrB1.1 ThSi2,tI12,141 I41/amd 0.281,0.281,1.0263,90,90,90 - - 16.73 X 1219
B-Ir Ir0.02 B rhom1 B,hR423,166 R-3m 1.09287,1.09287,2.38274,90,90,120 β-boron family - 3.17 F 14249
B-Ir Ir2B2.5 Ir2B2.5 ,mS28,12 C12/m1 1.05300,0.29038,0.61013,90,91.119,90 - - 14.65 X 7226
B-K KB6 CaB6,cP7,221 Pm-3m 0.42246,0.42246,0.42246,90,90,90 - red 2.29 X 42997
B-La LaB4 UB4,tP20,127 P4/mbm 0.7324,0.7324,0.4181,90,90,90 - black 5.39 X 7991
B-La LaB6 CaB6,cP7,221 Pm-3m 0.41566,0.41566,0.41566,90,90,90 - blue 4.71 X 17674
Handbook of Inorganic Substances – Edition 2015 : Data 31

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Li LiB hex LiB,hP4,194 P63/mmc 0.4022,0.4022,0.2796,90,90,120 - gray 1.51 X 37415


B-Li LiB3 LiB3 ,tP20,127 P4/mbm 0.5975,0.5975,0.4189,90,90,90 - red 1.75 X 36558
B-Li Li0.092 B tet B,tP196,76 P41 1.016,1.016,1.428,90,90,90 - brown 2.45 F 3567
B-Li Li10 B103 rhom1 Li10B103 ,hR378,166 R-3m 1.101,1.101,2.4185,90,90,120 β-boron family black 2.32 X 53486
B-Li Li2.5 B2 m (Li0.62 B0.38 )4B0.5 ,cI16,217 I-43m 0.493,0.493,0.493,90,90,90 - - 1.08 X 11631
B-Li Li2.9 B14 Li3B14,tI160,122 I-42d 1.0764,1.0764,0.8947,90,90,90 - red 2.20 X 21528
B-Li Li8B103.4 m Zr2.0 B102.1 ,hR357,166 R-3m 1.09654,1.09654,2.40495,90,90,120 β-boron family black 2.33 X 30200
B-Lu LuB12 UB12 ,cF52,225 Fm-3m 0.74635,0.74635,0.74635,90,90,90 - - 4.87 A 18152
B-Lu LuB2 AlB2 ,hP3,191 P6/mmm 0.32441,0.32441,0.37036,90,90,120 AlB2 family - 9.67 X 55304
B-Lu LuB4 UB4 ,tP20,127 P4/mbm 0.7041,0.7041,0.39755,90,90,90 - black 7.35 A 40680
B-Lu LuB6 CaB6,cP7,221 Pm-3m 0.41,0.41,0.41,90,90,90 - - 5.78 A 4230
B-Lu LuB66 YB66 ,cF1936,226 Fm-3c 2.3412,2.3412,2.3412,90,90,90 - - 2.76 A 6740
B-Mg MgB12 MgB12,oP424,62 Pnma 1.6632,1.7802,1.0396,90,90,90 - black 2.49 X 47033
B-Mg MgB2 AlB2 ,hP3,191 P6/mmm 0.30849,0.30849,0.35187,90,90,120 AlB2 family golden 2.63 X 45453
B-Mg MgB4 MgB4,oP20,62 Pnma 0.5464,0.4428,0.7472,90,90,90 - black 2.48 X 6620
B-Mg MgB7 MgB7,oI64,74 Imma 0.59769,1.04782,0.81245,90,90,90 - red dark 2.61 X 54280
B-Mg Mg2.5 B22 Al1.67 B22,tP216,92 P41212 1.03795,1.03795,1.4391,90,90,90 - black 2.56 X 54280
B-Mg Mg5.22 B103 rhom1 Sc3.7 B101.8 ,hR357,166 R-3m 1.0983,1.0983,2.41561,90,90,120 β-boron family brown dark 2.45 X 40027
B-Mg Mg8 B100 Mg5.85 B101.9 ,hR375,166 R-3m 1.10398,1.10398,2.4195,90,90,120 - black 2.49 X 57631
B-Mn MnB rt FeB-b,oP8,62 Pnma 0.556,0.2977,0.4145,90,90,90 CrB(TlI)-FeB gray 6.37 X 337
B-Mn MnB2 ht AlB2 ,hP3,191 P6/mmm 0.3005,0.3005,0.3038,90,90,120 AlB2 family - 5.35 X 8051
B-Mn MnB4 rt MnB4,mS10,12 C12/m1 0.54760,0.53669,0.29487,90,122.270,90 - - 4.45 X 5043
B-Mn Mn0.81 B0.19 rt Mn,cI58,217 I-43m 0.89204,0.89204,0.89204,90,90,90 - - 6.32 A 11630
B-Mn Mn2 B rt Mn+ Mg2 Cu,oF48,70 Fddd 0.42082,0.72914,1.45395,90,90,90 - - 7.19 X 14298
B-Mn Mn2 B tet CuAl2,tI12,140 I4/mcm 0.5148,0.5148,0.4208,90,90,90 - - 7.19 X 3793
B-Mn Mn3 B4 Ta3B4,oI14,71 Immm 0.296,0.3032,1.286,90,90,90 - - 5.99 X 337
B-Mn Mn4.48 B103 rhom1 Mn4.4 B102.9 ,hR345,166 R-3m 1.09875,1.09875,2.39937,90,90,120 β-boron family - 2.70 X 8356
B-Mo MoB ht TlI,oS8,63 Cmcm 0.316,0.861,0.308,90,90,90 CrB(TlI)-FeB - 8.46 A 3195
B-Mo MoB rt MoB,tI16,141 I41/amd 0.3105,0.3105,1.697,90,90,90 - - 8.67 X 265
B-Mo MoB2 ht AlB2 ,hP3,191 P6/mmm 0.30049,0.30049,0.31726,90,90,120 AlB2 family - 7.87 X 31774
B-Mo MoB2 rt MoB2,hR18,166 R-3m 0.30152,0.30152,2.0971,90,90,120 - black olive 7.09 X 19145
B-Mo Mo0.01 B rhom1 B,hR423,166 R-3m 1.09303,1.09303,2.38217,90,90,120 β-boron family - 2.55 F 14249
B-Mo Mo0.9 B3 rt Mo0.8 B3,hP16,194 P63/mmc 0.52646,0.52646,0.6121,90,90,120 - - 5.37 X 31774
B-Mo Mo2 B CuAl2,tI12,140 I4/mcm 0.5547,0.5547,0.4739,90,90,90 - - 9.23 X 6743
B-Mo Mo3 B2 ht U3Si2,tP10,127 P4/mbm 0.6,0.6,0.315,90,90,90 - - 9.06 A 1230
B-N BN cub ZnS,cF8,216 F-43m 0.36159,0.36159,0.36159,90,90,90 qingsongite colorless 3.49 X 24529
B-N BN hex BN-b,hP4,194 P63/mmc 0.24982,0.24982,0.66357,90,90,120 - white 2.30 X 47869
B-N BN hp-ht BN,oF8,42 Fmm2 0.25,0.335,0.434,90,90,90 - - 4.54 X 17513
B-N BN hp2 ZnO,hP4,186 P63mc 0.2552,0.2552,0.422,90,90,120 adamantane structure - 3.46 A 14173
B-N BN part *,cF*,* - 0.8405,0.8405,0.8405,90,90,90 - - - N 19216
B-N BN rhom BN,hR6,160 R3m 0.2504,0.2504,1.0000,90,90,120 - - 2.28 X 29458
B-N B0.5 N0.5 hp2 C,cF8,227 Fd-3m 0.3615,0.3615,0.3615,90,90,90 - - 3.49 X 4265
B-N B13N2 ht-hp B13C2,hR45,166 R-3m 0.54455,0.54455,1.22649,90,90,120 - - 2.67 X 47869
B-N B25.03 N0.94 B25N,tP62,111 P-42m 0.8634,0.8634,0.5128,90,90,90 - - 2.47 X 9913
B-Na Na2B29 Na2B29,mS62,8 C1m1 1.02022,1.0403,0.5874,90,124.982,90 - black 2.34 X 37002
B-Na Na3B20 Na3B20,oS46,65 Cmmm 0.57009,1.86945,0.41506,90,90,90 - black 2.14 X 34002
B-Nb NbB TlI,oS8,63 Cmcm 0.32961,0.87224,0.31653,90,90,90 CrB(TlI)-FeB - 7.57 A 24502
B-Nb NbB1.88 AlB2 ,hP3,191 P6/mmm 0.31111,0.31111,0.32627,90,90,120 AlB2 family black 6.88 X 44182
B-Nb Nb0.53 B105.5 rhom1 Fe1.2 B105.4 ,hR411,166 R-3m 1.0938,1.0938,2.3858,90,90,120 β-boron family - 2.40 X 21551
B-Nb Nb2 B3 V2B3,oS20,63 Cmcm 0.33058,1.948,0.31293,90,90,90 - - 7.19 A 24502
B-Nb Nb3 B2 U3Si2,tP10,127 P4/mbm 0.618,0.618,0.33,90,90,90 - - 7.91 A 4865
B-Nb Nb3 B4 Ta3B4,oI14,71 Immm 0.31428,0.33033,1.4076,90,90,90 - - 7.32 A 24502
B-Nb Nb5 B6 V5B6,oS22,65 Cmmm 0.31567,2.2767,0.33034,90,90,90 - - 7.41 A 24502
B-Nd NdB4 UB4 ,tP20,127 P4/mbm 0.72197,0.72197,0.41016,90,90,90 - golden 5.82 X 46633
B-Nd NdB6 rt CaB6,cP7,221 Pm-3m 0.41269,0.41269,0.41269,90,90,90 - blue 4.94 X 30154
B-Nd NdB66 YB66 ,cF1936,226 Fm-3c 2.3476,2.3476,2.3476,90,90,90 - - 2.64 A 46633
B-Nd Nd2 B5 Pr2B5,mS56,15 C12/c1 1.50808,0.72522,0.72841,90,109.104,90 - - 6.04 X 46633
B-Ni NiB TlI,oS8,63 Cmcm 0.2927,0.7394,0.2963,90,90,90 CrB(TlI)-FeB - 7.20 A 43127
B-Ni NiB0.01 NaCl,cF8,225 Fm-3m 0.35311,0.35311,0.35311,90,90,90 rocksalt family - 8.87 X 38370
B-Ni NiB12 *,c**,* - 0.7385,0.7385,0.7385,90,90,90 - - - N 3744
B-Ni NiBx Cu,cF4,225 Fm-3m 0.35246,0.35246,0.35246,90,90,90 close-packed structure - 8.91 X 31714
B-Ni Ni2B CuAl2,tI12,140 I4/mcm 0.4995,0.4995,0.4238,90,90,90 - - 8.05 X 50501
B-Ni Ni2.12 B103 rhom1 Ni2.1 B104.1 ,hR429,166 R-3m 1.09615,1.09615,2.38544,90,90,120 β-boron family - 2.48 X 17663
B-Ni Ni3B Fe3C-b,oP16,62 Pnma 0.52219,0.66171,0.43918,90,90,90 - gray silver 8.18 X 47754
B-Ni Ni4B3 mon Ni4B3,mS28,15 C12/c1 0.64282,0.48795,0.78190,90,103.315,90 - - 7.44 X 3409
B-Ni Ni4B3 orth Ni4B3,oP28,62 Pnma 1.1953,0.2981,0.6569,90,90,90 - - 7.58 X 1078
B-Np NpB12 UB12 ,cF52,225 Fm-3m 0.7478,0.7478,0.7478,90,90,90 - - 5.83 A 4754
B-Np NpB2 AlB2 ,hP3,191 P6/mmm 0.31623,0.31623,0.39719,90,90,120 AlB2 family - 12.49 X 22389
B-Np NpB4 UB4 ,tP20,127 P4/mbm 0.7088,0.7088,0.3995,90,90,90 - - 9.28 A 19139
B-Np NpB6 CaB6,cP7,221 Pm-3m 0.41129,0.41129,0.41129,90,90,90 - - 7.21 A 4754
B-O B2O hp hex *,h**,* - 0.798,0.798,0.909,90,90,120 - brown - N 2602
B-O B2O hp B2O,hP6,164 P-3m1 0.2879,0.2879,0.7052,90,90,120 - - 2.47 X 20299
B-O B2O3 cub *,c**,* - 1.004,1.004,1.004,90,90,90 - - - N 404
B-O B2O3 hp B2O3,oS20,36 Cmc21 0.7803,0.4613,0.4129,90,90,90 - - 3.11 X 3857
B-O B2O3 mon *,m*10,* - 0.453,0.415,0.45466,90,118.806,90 - - - N 1442
B-O B2O3 rt B2O3-b,hP15,144 P31 0.43358,0.43358,0.83397,90,90,120 - - 2.55 X 5033
B-O B6O0.84 B6P,hR42,166 R-3m 0.53774,0.53774,1.2322,90,90,120 - brown 2.53 X 33232
B-Os OsB cub *,c**,* - 0.704,0.704,0.704,90,90,90 - - - N 1219
32 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Os OsB hex WC,hP2,187 P-6m2 0.28767,0.28767,0.28718,90,90,120 AlB2 family - 16.22 X 54499
B-Os OsB2 RuB2,oP6,59 Pmmn 0.28702,0.46729,0.40792,90,90,90 - - 12.86 X 55292
B-Os Os0.01 B rhom1 B,hR423,166 R-3m 1.09319,1.09319,2.38263,90,90,120 β-boron family - 2.75 F 14249
B-Os Os2B3 Ru2B3,hP10,194 P63 /mmc 0.29145,0.29145,1.29213,90,90,120 - - 14.42 X 59461
B-P BP ht ZnO,hP4,186 P63 mc 0.3562,0.3562,0.59,90,90,120 adamantane structure - 2.14 A 1891
B-P BP rt ZnS,cF8,216 F-43m 0.4543,0.4543,0.4543,90,90,90 adamantane structure - 2.96 X 27505
B-P B6P B6P,hR42,166 R-3m 0.6000,0.6000,1.1857,90,90,120 - black blue 2.58 X 18883
B-Pd PdB0.163 NaCl,cF8,225 Fm-3m 0.4001,0.4001,0.4001,90,90,90 close-packed structure - 11.22 X 47698
B-Pd PdB0.19 rt CoO,tI4,139 I4/mmm 0.2849,0.2849,0.40038,90,90,90 rocksalt family - 11.08 X 39589
B-Pd PdB0.214 ht NaCl,cF8,225 Fm-3m 0.40272,0.40272,0.40272,90,90,90 rocksalt family - 11.06 X 38370
B-Pd Pd0.01 B rhom1 B,hR423,166 R-3m 1.09311,1.09311,2.38212,90,90,120 β-boron family - 2.57 F 14249
B-Pd Pd2B CaCl2,oP6,58 Pnnm 0.46918,0.51271,0.31096,90,90,90 - - 9.93 X 13432
B-Pd Pd3B rt Fe3C-b,oP16,62 Pnma 0.54644,0.75632,0.48506,90,90,90 - - 10.93 X 47754
B-Pd Pd3B2 (Si) *,hP*,* - 0.648,0.648,0.342,90,90,120 - - - N 395
B-Pd Pd5B2 Mn5C2,mS28,15 C12/c1 1.2786,0.4955,0.5472,90,97.03,90 - - 10.69 X 1407
B-Pd Pd6B rt Pd6B,mS28,15 C12/c1 0.48902,0.8467,0.93639,90,100.03,90 - - 11.29 X 47698
B-Pr PrB4 UB4,tP20,127 P4/mbm 0.7235,0.7235,0.4116,90,90,90 - black 5.68 A 10062
B-Pr PrB6 lt CaB6,cP7,221 Pm-3m 0.412,0.412,0.412,90,90,90 - black 4.89 X 13752
B-Pr Pr2B5 Pr2B5,mS56,15 C12/c1 1.51603,0.72771,0.73137,90,109.607,90 - - 5.87 X 42046
B-Pt PtB hp-ht NiAs,hP4,194 P63 /mmc 0.3358,0.3358,0.4058,90,90,120 AlB2 family - 17.26 X 1219
B-Pt PtB0.027 NaCl,cF8,225 Fm-3m 0.39258,0.39258,0.39258,90,90,90 rocksalt family - 21.45 X 38370
B-Pt PtB0.67 ht PtB0.67,oS8,63 Cmcm 0.3371,0.5817,0.4045,90,90,90 AlB2 family - 16.94 X 28321
B-Pt Pt0.01 B rhom1 B,hR423,166 R-3m 1.09278,1.09278,2.3819,90,90,120 β-boron family - 2.76 F 14249
B-Pt Pt0.975 B0.025 Cu,cF4,225 Fm-3m 0.392,0.392,0.392,90,90,90 close-packed structure - 21.01 X 30195
B-Pt Pt2B MoS2,hP6,194 P63 /mmc 0.27936,0.27936,1.0486,90,90,120 - - 18.79 A 12460
B-Pt Pt4B *,c**,* - 0.75669,0.75669,0.75669,90,90,90 - - - N 12460
B-Pu PuB NaCl,cF8,225 Fm-3m 0.4905,0.4905,0.4905,90,90,90 rocksalt family - 14.34 X 19139
B-Pu PuB12 UB12,cF52,225 Fm-3m 0.74843,0.74843,0.74843,90,90,90 - - 5.92 A 2603
B-Pu PuB2 AlB2,hP3,191 P6/mmm 0.31862,0.31862,0.39491,90,90,120 AlB2 family - 12.70 X 22389
B-Pu PuB4 UB4,tP20,127 P4/mbm 0.71,0.71,0.4014,90,90,90 - - 9.43 X 1188
B-Pu PuB6 CaB6,cP7,221 Pm-3m 0.4115,0.4115,0.4115,90,90,90 - - 7.36 X 1188
B-Pu Pu0.66 B66 YB66,cF1936,226 Fm-3c 2.343,2.343,2.343,90,90,90 - - 2.71 A 2603
B-Re ReB2 ReB2,hP6,194 P63 /mmc 0.28982,0.28982,0.74723,90,90,120 - - 12.70 X 52590
B-Re Re0.01 B rhom1 B,hR423,166 R-3m 1.09281,1.09281,2.38278,90,90,120 β-boron family - 2.74 F 14249
B-Re Re3B Re3B,oS16,63 Cmcm 0.2890,0.9313,0.7258,90,90,90 - - 19.36 X 1205
B-Re Re7B3 Th7Fe3,hP20,186 P63 mc 0.75029,0.75029,0.48816,90,90,120 - - 18.64 X 16780
B-Rh RhB NiAs,hP4,194 P63 /mmc 0.3309,0.3309,0.4224,90,90,120 AlB2 family - 9.43 X 1219
B-Rh RhB0.02 NaCl,cF8,225 Fm-3m 0.38043,0.38043,0.38043,90,90,90 rocksalt family - 12.44 X 38370
B-Rh Rh0.01 B rhom1 B,hR423,166 R-3m 1.09287,1.09287,2.38156,90,90,120 β-boron family - 2.56 F 14249
B-Rh Rh2B Co2Si-b,oP12,62 Pnma 0.542,0.398,0.744,90,90,90 - - 8.97 X 565
B-Rh Rh5B4 Rh5B4,hP18,194 P63 /mmc 0.33058,0.33058,2.0394,90,90,120 - - 9.60 X 14296
B-Rh Rh7B3 Th7Fe3,hP20,186 P63 mc 0.74696,0.74696,0.47777,90,90,120 - - 10.83 X 16780
B-Rh Rh9B5.5 Rh9B5.5 ,aP30,2 P-1 0.5483,0.6818,0.9072,110.78,94.73,90.46 - - 10.37 X 43503
B-Ru RuB *,cI*,* - 0.702,0.702,0.702,90,90,90 - - - N 1974
B-Ru RuB2 RuB2,oP6,59 Pmmn 0.28657,0.46457,0.40462,90,90,90 - - 7.56 X 49383
B-Ru Ru0.01 B rhom1 B,hR423,166 R-3m 1.09281,1.09281,2.36236,90,90,120 β-boron family - 2.58 F 14249
B-Ru Ru11B8 Ru11B8,oP38,55 Pbam 1.1342,1.1609,0.2836,90,90,90 - - 10.66 X 1214
B-Ru Ru2B3 Ru2B3,hP10,194 P63 /mmc 0.29049,0.29049,1.28164,90,90,120 - - 8.32 X 59461
B-Ru Ru7B3 Th7Fe3,hP20,186 P63 mc 0.74669,0.74669,0.47142,90,90,120 - - 10.80 X 16780
B-S BS2 mon1 BS2,mP48,14 P121/c1 1.2091,0.4063,2.187,90,107.64,90 - colorless 1.94 X 13113
B-S BS2 mon2 BS2,mP24,14 P121/c1 0.68,1.0545,0.7828,90,117.27,90 - - 2.00 X 13916
B-S B2S3 hp B2S3,tI500,88 I41/a 1.6086,1.6086,3.0488,90,90,90 - yellow pale 2.48 X 40500
B-S B2S3 B2S3,mP40,14 P121/c1 0.4039,1.0722,1.862,90,96.23,90 - colorless 1.95 X 10534
B-S B6.46 S0.54 B6(B0.53 Se0.47),hR48,166 R-3m 0.58,0.58,1.19,90,90,120 - - 2.50 A 1440
B-Sc ScB12 cub UB12,cF52,225 Fm-3m 0.7402,0.7402,0.7402,90,90,90 - - 2.86 X 21213
B-Sc ScB12 tet ScB12,tI26,139 I4/mmm 0.522,0.522,0.735,90,90,90 - - 2.90 X 2478
B-Sc ScB15 ScB15,tP192,76 P41 1.02995,1.02995,1.4223,90,90,90 - black 2.74 X 57323
B-Sc ScB19 *,tP*,92 P41212 1.02915,1.02915,1.42463,90,90,90 - - - N 34454
B-Sc ScB2 AlB2,hP3,191 P6/mmm 0.31482,0.31482,0.35148,90,90,120 AlB2 family - 3.66 X 47034
B-Sc Sc3.68 B101.78 rhom1 Sc3.7 B101.8 ,hR357,166 R-3m 1.09658,1.09658,2.40875,90,90,120 β-boron family - 2.51 X 11693
B-Se BSe2 BS2,mP24,14 P121/c1 0.7205,1.1202,0.8123,90,117.62,90 - - 3.86 A 13916
B-Se B2Se3 *,mP40,* - 0.406,3.86,1.043,90,90.,90 - - - N 6563
B-Se B6.53 Se0.47 B6(B0.53 Se0.47),hR48,166 R-3m 0.59041,0.59041,1.1947,90,90,120 - brown dark 2.98 X 27480
B-Si SiB3 SiB3,oI64,74 Imma 0.83915,1.2568,0.62134,90,90,90 - orange 2.45 X 41119
B-Si SiB6 CaB6,cP7,221 Pm-3m 0.415,0.415,0.415,90,90,90 - black 2.16 X 803
B-Si Si0.99 B0.01 C,cF8,227 Fd-3m 0.5424,0.5424,0.5424,90,90,90 - - 2.32 X 43498
B-Si Si1.8 B5.2 rt Si(Si0.28 B0.72 )3B3,hR42,166 R-3m 0.6319,0.6319,1.2713,90,90,120 - - 2.42 X 1633
B-Si Si10.7 B59.6 Si5.78 (Si0.41 B0.59)12B52.5 ,oP340,58 Pnnm 1.4397,1.8318,0.9911,90,90,90 - black 2.40 X 19284
B-Si Si15B290 *,hR*,166 R-3m 1.10152,1.10152,2.38625,90,90,120 - - - N 43498
B-Si Si2.8 B101.8 rhom1 Si1.2(Si0.13 B0.87 )12B91.4,hR339,166 R-3m 1.101,1.101,2.39,90,90,120 β-boron family - 2.34 X 14381
B-Sm SmB2 hp-ht AlB2,hP3,191 P6/mmm 0.331,0.331,0.4019,90,90,120 AlB2 family - 7.49 X 10760
B-Sm SmB4 UB4,tP20,127 P4/mbm 0.7174,0.7174,0.40641,90,90,90 - blue 6.15 X 21192
B-Sm SmB6 hp CaB6,cP7,221 Pm-3m 0.41327,0.41327,0.41327,90,90,90 - blue dark 5.06 X 53841
B-Sm SmB66 rt YB66,cF1936,226 Fm-3c 2.34683,2.34683,2.34683,90,90,90 - - 2.66 A 15793
B-Sm Sm2B5 Gd2B5,mP28,14 P121/c1 0.7179,0.718,0.7205,90,102.02,90 - gray 6.49 X 24106
B-Sr SrB6 CaB6,cP7,221 Pm-3m 0.41982,0.41982,0.41982,90,90,90 - black 3.42 X 33995
B-Ta TaB TlI,oS8,63 Cmcm 0.3276,0.8669,0.3157,90,90,90 CrB(TlI)-FeB - 14.21 X 312
B-Ta TaB2 AlB2,hP3,191 P6/mmm 0.3076,0.3076,0.3275,90,90,120 AlB2 family gray dark 12.53 X 27542
Handbook of Inorganic Substances – Edition 2015 : Data 33

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Ta Ta1.08 B104.2 rhom1 Ta1.1 B104.2 ,hR393,166 R-3m 1.0942,1.0942,2.3898,90,90,120 β-boron family - 2.66 X 21551
B-Ta Ta2B ht CuAl2,tI12,140 I4/mcm 0.5783,0.5783,0.4866,90,90,90 - - 15.21 X 6743
B-Ta Ta3B2 rt U3Si2,tP10,127 P4/mbm 0.6184,0.6184,0.3284,90,90,90 - - 14.93 A 6291
B-Ta Ta3B4 Ta3B4,oI14,71 Immm 0.313,0.329,1.40,90,90,90 - - 13.50 X 312
B-Ta Ta5B6 V5B6,oS22,65 Cmmm 0.31385,2.2602,0.32895,90,90,90 - - 13.80 X 23555
B-Tb TbB12 rt UB12 ,cF52,225 Fm-3m 0.7504,0.7504,0.7504,90,90,90 - - 4.54 A 5909
B-Tb TbB2 AlB2 ,hP3,191 P6/mmm 0.32938,0.32938,0.3886,90,90,120 AlB2 family - 8.21 X 11557
B-Tb TbB4 lt *,oP20,* - 0.40241,0.71087,0.71296,90,90,90 - - - N 18882
B-Tb TbB4 rt UB4 ,tP20,127 P4/mbm 0.712,0.712,0.4042,90,90,90 - brown gray 6.55 X 14300
B-Tb TbB50 *,oP*,* - 0.948,1.661,1.764,90,90,90 - - - N 35892
B-Tb TbB6 CaB6,cP7,221 Pm-3m 0.411,0.411,0.411,90,90,90 - blue 5.35 X 1306
B-Tb TbB66 YB66 ,cF1936,226 Fm-3c 2.3457,2.3457,2.3457,90,90,90 - - 2.69 A 6740
B-Tb Tb0.56 B14 Tb0.56 B14,mS60,12 C12/m1 1.01008,1.03354,0.5855,90,124.937,90 - - 3.19 X 38960
B-Tc TcB0.04 Mg,hP2,194 P63/mmc 0.274,0.274,0.4398,90,90,120 close-packed structure - 11.43 F 2227
B-Tc TcB2 ReB2,hP6,194 P63/mmc 0.2892,0.2892,0.7453,90,90,120 - - 7.36 A 2227
B-Tc Tc3B Re3B,oS16,63 Cmcm 0.2891,0.9161,0.7246,90,90,90 - - 10.55 A 2227
B-Tc Tc7B3 Th7Fe3,hP20,186 P63mc 0.7417,0.7417,0.4777,90,90,120 - - 10.48 A 2227
B-Th ThB12 hp-ht UB12 ,cF52,225 Fm-3m 0.7612,0.7612,0.7612,90,90,90 - gray silver 5.45 A 16164
B-Th ThB4 UB4 ,tP20,127 P4/mbm 0.7256,0.7256,0.41118,90,90,90 - gray dark 8.45 X 31723
B-Th ThB6 CaB6,cP7,221 Pm-3m 0.40931,0.40931,0.40931,90,90,90 - red dark 7.19 X 31723
B-Th ThB66 (O) YB66 ,cF1936,226 Fm-3c 2.3518,2.3518,2.3518,90,90,90 - - 2.90 A 6740
B-Ti TiB cub NaCl,cF8,225 Fm-3m 0.4261,0.4261,0.4261,90,90,90 rocksalt family - 5.04 X 24041
B-Ti TiB orth FeB-b,oP8,62 Pnma 0.612,0.306,0.456,90,90,90 CrB(TlI)-FeB - 4.57 X 577
B-Ti TiB0.5 *,hP*,* - 0.5934,0.5934,0.4779,90,90,120 - - - N 324
B-Ti TiB2 rt AlB2 ,hP3,191 P6/mmm 0.30292,0.30292,0.32284,90,90,120 AlB2 family - 4.50 X 32378
B-Ti Ti0.84 B25 Ti0.94 B25,tP52,134 P42/nnm 0.8830,0.8830,0.5072,90,90,90 - - 2.61 X 8863
B-Ti Ti0.925 B0.075 rt Mg,hP2,194 P63/mmc 0.2952,0.2952,0.4685,90,90,120 close-packed structure - 4.24 X 44925
B-Ti Ti2B ht CuAl2,tI12,140 I4/mcm 0.611,0.611,0.456,90,90,90 - - 4.16 A 3544
B-Ti Ti2.00 B103.3 rhom1 Ti2.0 B103.2 ,hR357,166 R-3m 1.0925,1.0925,2.3913,90,90,120 β-boron family - 2.44 X 21551
B-Ti Ti3B4 Ta3B4,oI14,71 Immm 0.3051,0.3259,1.3747,90,90,90 - - 4.54 A 49291
B-Tm TmB12 UB12 ,cF52,225 Fm-3m 0.7474,0.7474,0.7474,90,90,90 - - 4.75 A 39328
B-Tm TmB2 AlB2 ,hP3,191 P6/mmm 0.32602,0.32602,0.37535,90,90,120 AlB2 family gray 9.16 X 53186
B-Tm TmB4 UB4 ,tP20,127 P4/mbm 0.7047,0.7047,0.3985,90,90,90 - - 7.12 A 39328
B-Tm TmB6 CaB6,cP7,221 Pm-3m 0.411,0.411,0.411,90,90,90 - - 5.59 A 1468
B-Tm TmB66 YB66 ,cF1936,226 Fm-3c 2.3433,2.3433,2.3433,90,90,90 - - 2.73 A 6740
B-U UB12 rt UB12 ,cF52,225 Fm-3m 0.74734,0.74734,0.74734,90,90,90 - - 5.85 X 54679
B-U UB2 rt AlB2 ,hP3,191 P6/mmm 0.3131,0.3131,0.3985,90,90,120 AlB2 family - 12.74 X 54679
B-U UB4 rt UB4 ,tP20,127 P4/mbm 0.7075,0.7075,0.3979,90,90,90 - black 9.38 X 346
B-V VB TlI,oS8,63 Cmcm 0.30655,0.80501,0.29809,90,90,90 CrB(TlI)-FeB - 5.58 A 52816
B-V VB2 AlB2 ,hP3,191 P6/mmm 0.2997,0.2997,0.3056,90,90,120 AlB2 family gray dark 5.07 X 20460
B-V V0.77 B25 Ti0.94 B25,tP52,134 P42/nnm 0.8824,0.8824,0.5072,90,90,90 - - 2.60 X 9679
B-V V1.5 B105 rhom1 Cr2.5 B103.3 ,hR339,166 R-3m 1.0972,1.0972,2.3908,90,90,120 β-boron family - 2.42 X 19291
B-V V2B3 V2B3,oS20,63 Cmcm 0.30599,1.8429,0.29839,90,90,90 - gray 5.30 X 30210
B-V V3B2 U3Si2,tP10,127 P4/mbm 0.5755,0.5755,0.3038,90,90,90 - - 5.76 X 35965
B-V V3B4 Ta3B4,oI14,71 Immm 0.298,0.304,1.32,90,90,90 - - 5.45 A 4865
B-V V5B6 rt V5B6,oS22,65 Cmmm 0.29773,2.1242,0.30613,90,90,90 - - 5.48 A 23555
B-W WB ht TlI,oS8,63 Cmcm 0.31354,0.84544,0.30659,90,90,90 CrB(TlI)-FeB - 15.91 A 59381
B-W WB rt MoB,tI16,141 I41/amd 0.3106,0.3106,1.69513,90,90,90 - - 15.81 X 59381
B-W WB2 ht WB2 ,hP12,194 P63/mmc 0.29831,0.29831,1.38790,90,90,120 - - 12.76 X 4482
B-W WB2 rt AlB2 ,hP3,191 P6/mmm 0.302,0.302,0.305,90,90,120 AlB2 family - 14.16 X 3232
B-W WB4 *,tP20,* - 0.634,0.634,0.45,90,90,90 - - - N 1427
B-W W0.01 B rhom1 B,hR423,166 R-3m 1.09382,1.09382,2.38356,90,90,120 β-boron family - 2.73 F 14249
B-W W1.83 B9 W1.83 B9,hP22,147 P-3 0.5206,0.5206,0.6335,90,90,120 - - 9.69 X 3670
B-W W2B CuAl2,tI12,140 I4/mcm 0.5568,0.5568,0.4744,90,90,90 - - 17.09 X 6743
B-W W2B5 rt Mo2 B4.65 ,hR21,166 R-3m 0.3011,0.3011,2.093,90,90,120 - - 12.79 X 3716
B-Y YB12 UB12 ,cF52,225 Fm-3m 0.75,0.75,0.75,90,90,90 - - 3.44 X 2478
B-Y YB2 AlB2 ,hP3,191 P6/mmm 0.32875,0.32875,0.3836,90,90,120 AlB2 family - 5.11 X 46652
B-Y YB4 UB4 ,tP20,127 P4/mbm 0.7111,0.7111,0.4017,90,90,90 - - 4.32 X 13140
B-Y YB50 rt *,oP*,18 P21212 1.66251,1.76198,0.94797,90,90,90 - - - N 28768
B-Y YB6 CaB6,cP7,221 Pm-3m 0.41,0.41,0.41,90,90,90 - blue 3.70 X 43098
B-Y Y1.06 B66 YB66 ,cF1936,226 Fm-3c 2.34364,2.34364,2.34364,90,90,90 - black 2.50 X 33500
B-Yb YbB12 UB12 ,cF52,225 Fm-3m 0.7468,0.7468,0.7468,90,90,90 - - 4.83 A 27904
B-Yb YbB2 AlB2 ,hP3,191 P6/mmm 0.32522,0.32522,0.37297,90,90,120 AlB2 family - 9.46 X 58631
B-Yb YbB4 UB4 ,tP20,127 P4/mbm 0.7074,0.7074,0.399,90,90,90 - black 7.20 A 44765
B-Yb YbB6 CaB6,cP7,221 Pm-3m 0.41479,0.41479,0.41479,90,90,90 - blue 5.54 X 30154
B-Yb YbB66 YB66 ,cF1936,226 Fm-3c 2.3422,2.3422,2.3422,90,90,90 - - 2.75 A 6740
B-Zn Zn0.01 B rhom2 B,hR36,166 R-3m 0.491,0.491,1.2582,90,90,120 - - 2.61 F 11007
B-Zn Zn4.12 B103 rhom1 Zn4.1 B102.6 ,hR363,166 R-3m 1.0986,1.0986,2.4016,90,90,120 β-boron family - 2.74 X 20091
B-Zr ZrB ht NaCl,cF8,225 Fm-3m 0.465,0.465,0.465,90,90,90 rocksalt family - 6.74 X 3543
B-Zr ZrB12 UB12 ,cF52,225 Fm-3m 0.74075,0.74075,0.74075,90,90,90 - gray 3.61 X 41044
B-Zr ZrB2 AlB2 ,hP3,191 P6/mmm 0.3168,0.3168,0.3528,90,90,120 AlB2 family gray 6.11 X 21221
B-Zr Zr0.72 B105 rhom1 Sc1.6 B104.0 ,hR363,166 R-3m 1.0932,1.0932,2.3849,90,90,120 β-boron family - 2.42 X 21551
Ba-Be BaBe 13 NaZn13,cF112,226 Fm-3c 1.0485,1.0485,1.0485,90,90,90 - - 2.93 X 3508
Ba-Bi BaBi3 SrPb3,tP4,123 P4/mmm 0.5188,0.5188,0.5157,90,90,90 close-packed structure - 9.14 X 1524
Ba-Bi Ba11 Bi10 Ho11 Ge10,tI84,139 I4/mmm 1.323,1.323,1.9365,90,90,90 - - 7.06 X 40462
Ba-Bi Ba16 Bi11 Ca16 Sb11,tP56,113 P-421m 1.3744,1.3744,1.2568,90,90,90 - - 6.29 A 33066
Ba-Bi Ba2Bi La2Sb,tI12,139 I4/mmm 0.5263,0.5263,1.87,90,90,90 - - 6.20 X 7941
Ba-Bi Ba2Bi3 K2Au3,oI10,71 Immm 0.4819,0.7989,0.9982,90,90,90 - gray silver 7.79 X 43006
34 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Bi Ba4Bi3 Th3P 4,cI28,220 I-43d 1.055,1.055,1.055,90,90,90 - - 6.65 X 41566


Ba-Bi Ba5Bi3 Mn5Si3,hP16,193 P63 /mcm 1.013,1.013,0.779,90,90,120 - - 6.30 X 9486
Ba-Br BaBr2 hex Fe2P,hP9,189 P-62m 0.84826,0.84826,0.4824,90,90,120 Fe2P family - 4.92 A 22371
Ba-Br BaBr2 hp PbCl2,mP24,14 P121/c1 0.9302,0.4896,1.2773,90,92.,90 - - 6.79 X 30136
Ba-Br BaBr2 rt PbCl2,oP12,62 Pnma 0.82746,0.49599,0.99264,90,90,90 - - 4.84 X 56908
Ba-C BaC2 hp BaC2,hR9,166 R-3m 0.50166,0.50166,0.72524,90,90,120 - - 5.09 X 59217
Ba-C BaC2 ht NaCl,cF8,225 Fm-3m 0.6563,0.6563,0.6563,90,90,90 rocksalt family white 3.79 X 35820
Ba-C BaC2 lt ThC2,mS12,15 C12/c1 0.75217,0.47441,0.80861,90,107.743,90 - white 3.90 X 35820
Ba-C BaC2 rt CaC2,tI6,139 I4/mmm 0.43943,0.43943,0.7125,90,90,90 - colorless 3.89 X 35820
Ba-C BaC6 BaC6,hP14,194 P63 /mmc 0.4302,0.4302,1.051,90,90,120 GIC golden 4.13 X 8132
Ba-C Ba3[C60] Ba3[C60],cP126,223 Pm-3n 1.1343,1.1343,1.1343,90,90,90 fullerene family - 2.58 X 27960
Ba-C Ba3[C70] *,m**,* - 2.355,2.34,2.451,90,94.03,90 fullerene family - - N 37255
Ba-C Ba6[C60] Cs6[C60],cI132,204 Im-3 1.1171,1.1171,1.1171,90,90,90 fullerene family - 3.68 X 26541
Ba-Ca Ba0.3 Ca0.7 rt Cu,cF4,225 Fm-3m 0.583,0.583,0.583,90,90,90 close-packed structure - 2.32 X 204
Ba-Ca Ba0.4 Ca0.6 W,cI2,229 Im-3m 0.467,0.467,0.467,90,90,90 b.c.c. family - 2.58 X 204
Ba-Cd BaCd CsCl,cP2,221 Pm-3m 0.4213,0.4213,0.4213,90,90,90 b.c.c. family - 5.55 X 6645
Ba-Cd BaCd11 BaCd11,tI48,141 I41/amd 1.202,1.202,0.774,90,90,90 - - 8.16 X 487
Ba-Cd BaCd2 KHg2,oI12,74 Imma 0.517,0.8383,0.8658,90,90,90 AlB2 family - 6.41 X 4947
Ba-Cd Ba2Cd CuZr2,tI6,139 I4/mmm 0.4272,0.4272,1.52,90,90,90 close-packed structure - 4.63 X 9928
Ba-Cd Ba7Cd31 Ba7Cd31,hP41,191 P6/mmm 1.0740,1.0740,1.0200,90,90,120 - - 7.25 X 7993
Ba-Cl BaCl2 hp1 PbCl2,mP24,14 P121/c1 0.8613,0.4604,1.1901,90,92.5,90 - - 5.87 X 30136
Ba-Cl BaCl2 hp2 Fe2P,hP9,189 P-62m 0.7083,0.7083,0.4058,90,90,120 Fe2P family - 5.88 A 26215
Ba-Cl BaCl2 ht CaF2,cF12,225 Fm-3m 0.7324,0.7324,0.7324,90,90,90 fluorite family - 3.52 X 1944
Ba-Cl BaCl2 lt PbCl2,oP12,62 Pnma 0.78813,0.47369,0.9436,90,90,90 - - 3.93 X 56908
Ba-Cl BaCl2 rt Fe2P,hP9,189 P-62m 0.8103,0.8103,0.4651,90,90,120 Fe2P family - 3.92 A 11954
Ba-Cu BaCu BaCu,hP8,194 P63 /mmc 0.4499,0.4499,1.625,90,90,120 - - 4.68 X 12942
Ba-Cu BaCu13 NaZn13,cF112,226 Fm-3c 1.1697,1.1697,1.1697,90,90,90 - brass 8.00 X 46673
Ba-D BaD2 rt PbCl2,oP12,62 Pnma 0.6789,0.4171,0.7852,90,90,90 - white 4.22 X 20787
Ba-F BaF2 hp1 PbCl2,oP12,62 Pnma 0.65287,0.39625,0.77687,90,90,90 - - 5.79 X 53193
Ba-F BaF2 hp2 Co1.75 Ge,hP6,194 P63 /mmc 0.4253,0.4253,0.5516,90,90,120 AlB2 family - 6.74 X 30908
Ba-F BaF2 CaF2,cF12,225 Fm-3m 0.61827,0.61827,0.61827,90,90,90 frankdicksonite - 4.93 X 53193
Ba-Ga BaGa2 AlB2,hP3,191 P6/mmm 0.44322,0.44322,0.50824,90,90,120 AlB2 family gray silver 5.32 X 51936
Ba-Ga BaGa4 BaAl4,tI10,139 I4/mmm 0.45661,0.45661,1.0778,90,90,90 - - 6.15 X 24628
Ba-Ga Ba10Ga VAl10,cF176,227 Fd-3m 2.052,2.052,2.052,90,90,90 - - 4.44 X 12704
Ba-Ga Ba5Ga6 Ba5Ga6,hP24,188 P-6c2 0.7771,0.7771,1.4376,90,90,120 - - 4.88 X 28761
Ba-Ga Ba8Ga7 Ba8Ga7,cP60,198 P213 1.2990,1.2990,1.2990,90,90,90 - - 4.81 X 15896
Ba-Ge BaGe TlI,oS8,63 Cmcm 0.5057,1.1942,0.4299,90,90,90 CrB(TlI)-FeB - 5.37 X 3352
Ba-Ge BaGe2 hp ThSi2,tI12,141 I41/amd 0.4769,0.4769,1.4737,90,90,90 - pink 5.60 X 13885
Ba-Ge BaGe2 BaSi2,oP24,62 Pnma 0.9075,0.6808,1.1644,90,90,90 - gray silver 5.22 X 33508
Ba-Ge BaGe3 hp Mg3Cd,hP8,194 P63 /mmc 0.6814,0.6814,0.5027,90,90,120 close-packed structure - 5.83 X 56363
Ba-Ge BaGe5 BaGe5,oP66,53 Pmna 1.0727,0.92844,1.4794,90,90,90 - gray 5.64 X 54429
Ba-Ge Ba2Ge Co2Si-b,oP12,62 Pnma 0.838,0.548,1.004,90,90,90 - - 5.00 X 7852
Ba-Ge Ba3Ge4 ht Ba3Si4,tP28,136 P42 /mnm 0.8621,0.8621,1.2031,90,90,90 - black 5.22 X 34126
Ba-Ge Ba3Ge4 rt Ba3Ge4,oS56,65 Cmmm 1.1799,1.221,1.2097,90,90,90 - gray 5.35 X 34126
Ba-Ge Ba4Ge21.5 Na4Si23,cP54,223 Pm-3n 1.066,1.066,1.066,90,90,90 clathrate gray silver 5.79 X 41984
Ba-Ge Ba5Ge3 Ba5Si3,tP32,130 P4/ncc 0.8519,0.8519,1.6554,90,90,90 - black gray 5.00 X 36729
Ba-Ge Ba6Ge24 K6Sn25,cP124,213 P4132 1.45483,1.45483,1.45483,90,90,90 clathrate black 5.54 X 37679
Ba-Ge Ba7Ge6 Ca7Sn6,oP52,62 Pnma 0.80853,2.4545,0.89782,90,90,90 - - 5.21 X 58930
Ba-Ge Ba8Ge43 ht1 Ba8Ge43,cI408,230 Ia-3d 2.13123,2.13123,2.13123,90,90,90 clathrate gray 5.79 X 43971
Ba-H BaH2 hp1 Co1.75 Ge,hP6,194 P63 /mmc 0.44,0.44,0.56,90,90,120 AlB2 family - 4.93 X 53311
Ba-H BaH2 hp2 *,hP3,191 P6/mmm 0.32741,0.32741,0.29518,90,90,120 - - 8.44 N 53311
Ba-H BaH2 ht *,cI*,* - 0.9465,0.9465,0.9465,90,90,90 - - - N 1244
Ba-H BaH2 rt PbCl2,oP12,62 Pnma 0.6792,0.4168,0.7858,90,90,90 - white 4.16 X 29632
Ba-Hg BaHg CsCl,cP2,221 Pm-3m 0.4131,0.4131,0.4131,90,90,90 b.c.c. family - 7.96 X 9082
Ba-Hg BaHg11 BaHg11,cP36,221 Pm-3m 0.95875,0.95875,0.95875,90,90,90 - gray silver 13.25 X 36547
Ba-Hg BaHg2 KHg2,oI12,74 Imma 0.5102,0.8063,0.87,90,90,90 AlB2 family - 9.99 X 4947
Ba-Hg BaHg6 BaHg6,oP28,62 Pnma 1.3389,0.51939,1.0426,90,90,90 - - 12.28 X 59624
Ba-Hg Ba2Hg CuZr2,tI6,139 I4/mmm 0.42,0.42,1.519,90,90,90 close-packed structure - 5.89 X 9928
Ba-Hg Ba20Hg103 Ba20Hg103 ,cF492,216 F-43m 2.3333,2.3333,2.3333,90,90,90 - gray silver 12.24 X 59576
Ba-Hg Ba7Hg31 Ba7Cd31,hP41,191 P6/mmm 1.0778,1.0778,1.0189,90,90,120 - - 11.63 A 9082
Ba-I BaI2 hp PbCl2,mP24,14 P121/c1 0.9572,0.5022,1.3501,90,90.99,90 - - 8.01 X 30136
Ba-I BaI2 hp-ht Fe2P,hP9,189 P-62m 0.9142,0.9142,0.5173,90,90,120 Fe2P family white 5.20 X 16276
Ba-I BaI2 rt PbCl2,oP12,62 Pnma 0.8922,0.5304,1.0695,90,90,90 - - 5.13 X 1944
Ba-In BaIn NaHg,oS16,63 Cmcm 0.8158,1.2481,0.5578,90,90,90 b.c.c. family gray silver 5.90 X 45726
Ba-In BaIn2 KHg2,oI12,74 Imma 0.522,0.8504,0.852,90,90,90 AlB2 family gray silver 6.44 X 45726
Ba-In BaIn4 BaAl4,tI10,139 I4/mmm 0.497,0.497,1.1983,90,90,90 - gray silver 6.69 X 45726
Ba-In Ba2In Co2Si-b,oP12,62 Pnma 0.80973,0.59134,1.0939,90,90,90 - - 4.94 X 57458
Ba-In Ba9In4 Sm9Ga4,tI26,87 I4/m 1.3948,1.3948,0.5888,90,90,90 - - 4.92 X 55606
Ba-Li Li4Ba Li4Ba,hP30,194 P63 /mmc 1.0936,1.0936,0.8943,90,90,120 - gray 1.78 X 47758
Ba-Li Li44Ba19 Li44Ba19,tI252,122 I-42d 1.63911,1.63911,3.2712,90,90,90 - - 2.20 X 48443
Ba-Mg BaMg2 MgZn2,hP12,194 P63 /mmc 0.66699,0.66699,1.0602,90,90,120 Friauf-Laves phase gray silver 3.03 X 42995
Ba-Mg Ba2Mg17 Zn17Th2,hR57,166 R-3m 1.065,1.065,1.5587,90,90,120 CaCu5-Zr4Al3 white silver2.24 X 7493
Ba-Mg Ba6Mg23 Th6Mn23,cF116,225 Fm-3m 1.5263,1.5263,1.5263,90,90,90 - - 2.59 A 2452
Ba-Mn Ba0.03 Mn0.97 rt Mn,cI58,217 I-43m 0.895,0.895,0.895,90,90,90 - - 7.71 X 7746
Ba-N Ba[N2] ThC2,mS12,15 C12/c1 0.71608,0.43776,0.72188,90,104.968,90 - - 5.02 X 58275
Ba-N Ba[N3]2 Ba[N3]2,mP14,11 P121/m1 0.5448,0.4399,0.9613,90,99.64,90 - colorless 3.24 X 42494
Ba-N Ba2N hp1 CdI2,hP3,164 P-3m1 0.38211,0.38211,0.6902,90,90,120 CdI2 -PbI2 polytype - 5.49 X 44521
Ba-N Ba2N CdCl2,hR9,166 R-3m 0.4029,0.4029,2.2425,90,90,120 - brown dark 4.56 X 45825
Handbook of Inorganic Substances – Edition 2015 : Data 35

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-N Ba3N TiCl3,hP8,193 P63/mcm 0.76418,0.76418,0.70501,90,90,120 - - 3.97 X 35184


Ba-N Ba3N4 *,hP*,* - 0.522,0.522,0.55,90,90,120 - black - N 3060
Ba-N Ba4N2 hp2 Th3P 4,cI28,220 I-43d 0.83741,0.83741,0.83741,90,90,90 - - 6.53 X 44521
Ba-Na NaBa CdNi,cF96,227 Fd-3m 1.7027,1.7027,1.7027,90,90,90 - - 2.59 X 28898
Ba-Na Na2Ba rt MgZn2,hP12,194 P63/mmc 0.7393,0.7393,1.1999,90,90,120 Friauf-Laves phase - 2.14 X 29710
Ba-Ni Ba2Ni3 ht Sr2Ni3,hP5,164 P-3m1 0.4201,0.4201,0.91371,90,90,120 - - 5.36 X 57412
Ba-O BaO hp1 NiAs,hP4,194 P63/mmc 0.3617,0.3617,0.6349,90,90,120 AlB2 family - 7.08 X 19464
Ba-O BaO hp2 BaO,tP4,129 P4/nmm 0.4375,0.4375,0.3248,90,90,90 b.c.c. family - 8.19 X 19464
Ba-O BaO rt NaCl,cF8,225 Fm-3m 0.5539,0.5539,0.5539,90,90,90 rocksalt family - 5.99 X 11136
Ba-O BaO1.97 CaC2,tI6,139 I4/mmm 0.38059,0.38059,0.6837,90,90,90 - white 5.66 X 36288
Ba-O Ba[O2] hp Ba[O2],oS6,65 Cmmm 0.38922,0.57551,0.30424,90,90,90 - - 8.25 X 55284
Ba-P BaP 10 rt BaP 10,oS44,36 Cmc21 0.6452,1.2589,1.1927,90,90,90 - black 3.07 X 15671
Ba-P BaP 3 BaP 3,mS16,12 C12/m1 1.1684,0.7664,0.4765,90,112.7,90 - black 3.89 X 6201
Ba-P BaP 8 BaP 8,aP18,2 P-1 0.6762,0.7233,0.8567,86.32,84.31,70.4 - black 3.26 X 41942
Ba-P Ba3P 14 Sr3P14,mP34,14 P121/c1 0.6516,1.299,1.19969,90,123.4,90 - red 3.31 X 7713
Ba-P Ba3P 4 Sr3As4,oF56,43 Fdd2 1.4851,1.8236,0.615,90,90,90 - black 4.27 X 17584
Ba-P Ba4P 2.67 Th3P 4,cI28,220 I-43d 0.9779,0.9779,0.9779,90,90,90 - black gray 4.49 X 11060
Ba-P Ba4P 3 ht Ba4P 3,oP56,55 Pbam 1.2562,1.3254,1.1273,90,90,90 - black gray 4.55 X 28206
Ba-P Ba5P 4 rt Sm5 Ge4,oP36,62 Pnma 0.833,1.6503,0.8405,90,90,90 - - 4.66 X 42331
Ba-P Ba5P 9 rt Ba5P 9,oF112,43 Fdd2 1.5626,1.8968,1.0272,90,90,90 - gray dark 4.21 X 42383
Ba-Pb BaPb rt TlI,oS8,63 Cmcm 0.529,1.26,0.478,90,90,90 CrB(TlI)-FeB black 7.18 X 2119
Ba-Pb BaPb3 BaPb3,hR36,166 R-3m 0.72906,0.72906,2.56443,90,90,120 close-packed structure gray silver 9.61 X 51634
Ba-Pb Ba2Pb Co2Si-b,oP12,62 Pnma 0.86512,0.5691,1.0618,90,90,90 - - 6.12 X 47801
Ba-Pb Ba3Pb5 rt Pu3Pd5,oS32,63 Cmcm 1.1154,0.9049,1.137,90,90,90 - black gray 8.38 X 38719
Ba-Pb Ba4.82Pb3 W5Si3,tI32,140 I4/mcm 1.4148,1.4148,0.64288,90,90,90 - - 6.63 X 45199
Ba-Pb Ba5Pb3 Cr5B3,tI32,140 I4/mcm 0.9038,0.9038,1.6843,90,90,90 - gray silver 6.32 X 2119
Ba-Pd BaPd TlI,oS8,63 Cmcm 0.435,1.179,0.468,90,90,90 CrB(TlI)-FeB - 6.75 A 8298
Ba-Pd BaPd2 MgCu2,cF24,227 Fd-3m 0.7967,0.7967,0.7967,90,90,90 Friauf-Laves phase - 9.20 X 5530
Ba-Pd BaPd5 CaCu5,hP6,191 P6/mmm 0.554,0.554,0.433,90,90,120 - - 9.66 X 5558
Ba-Po BaPo NaCl,cF8,225 Fm-3m 0.7119,0.7119,0.7119,90,90,90 rocksalt family gray 6.38 X 1261
Ba-Pt BaPt NiAs,hP4,194 P63/mmc 0.5057,0.5057,0.542,90,90,120 AlB2 family black shiny 9.20 X 43052
Ba-Pt BaPt2 MgCu2,cF24,227 Fd-3m 0.794,0.794,0.794,90,90,90 Friauf-Laves phase - 14.00 X 6237
Ba-Pt BaPt5 CaCu5,hP6,191 P6/mmm 0.5505,0.5505,0.4337,90,90,120 - - 16.23 X 5558
Ba-Pt Ba2Pt CdCl2,hR9,166 R-3m 0.45642,0.45642,2.20912,90,90,120 - black 5.87 X 44176
Ba-Pt Ba3Pt2 Er3Ni2,hR45,148 R-3 0.9624,0.9624,1.8606,90,90,120 - black 8.03 X 44098
Ba-Rh BaRh2 MgCu2,cF24,227 Fd-3m 0.7852,0.7852,0.7852,90,90,90 Friauf-Laves phase - 9.42 X 938
Ba-S BaS hp CsCl,cP2,221 Pm-3m 0.3648,0.3648,0.3648,90,90,90 b.c.c. family orange 5.79 X 13746
Ba-S BaS rt NaCl,cF8,225 Fm-3m 0.6387,0.6387,0.6387,90,90,90 rocksalt family colorless 4.32 X 13746
Ba-S BaS2 rt BaS2 ,mS12,15 C12/c1 0.9299,0.4736,0.8993,90,118.37,90 - yellow 3.84 X 8831
Ba-S BaS3 BaS3 ,tP8,113 P-421m 0.6871,0.6871,0.41681,90,90,90 - yellow 3.94 X 9001
Ba-S Ba2S3 Ba2S3,tI20,109 I41md 0.6112,0.6112,1.5950,90,90,90 - yellow 4.13 X 9001
Ba-Sb BaSb2 BaSb2,mP18,11 P121/m1 1.1679,0.4381,1.2571,90,100.53,90 - gray silver 6.00 X 44113
Ba-Sb BaSb3 SrAs3,mS16,12 C12/m1 1.0807,0.8519,0.6471,90,112.66,90 - gray silver 6.07 X 12027
Ba-Sb Ba11 Sb10 Ba11 Sb10,oI84,71 Immm 1.2653,1.3161,1.9472,90,90,90 - gray dark 5.59 X 44113
Ba-Sb Ba16 Sb11 Ca16 Sb11,tP56,113 P-421m 1.3582,1.3582,1.2393,90,90,90 - - 5.14 A 33066
Ba-Sb Ba2Sb La2Sb,tI12,139 I4/mmm 0.522,0.522,1.846,90,90,90 - - 5.23 X 9486
Ba-Sb Ba2Sb3 Sr2Sb3,mP40,14 P121/c1 0.6934,1.3453,1.5817,90,90.25,90 - gray 5.76 X 18717
Ba-Sb Ba5Sb3 Mn5 Si3,hP16,193 P63/mcm 0.997,0.997,0.773,90,90,120 - - 5.25 X 9486
Ba-Sb Ba5Sb4 ht Eu5As4,oS36,64 Cmce 1.7749,0.9021,0.9059,90,90,90 - gray dark 5.37 X 35420
Ba-Sb Ba5Sb4 rt Sm5 Ge4,oP36,62 Pnma 0.9012,1.7823,0.9041,90,90,90 - black 5.37 X 14786
Ba-Se BaSe hp CsCl,cP2,221 Pm-3m 0.3795,0.3795,0.3795,90,90,90 b.c.c. family red 6.57 X 17353
Ba-Se BaSe rt NaCl,cF8,225 Fm-3m 0.6593,0.6593,0.6593,90,90,90 rocksalt family red 5.01 X 17353
Ba-Se BaSe 2 BaS2 ,mS12,15 C12/c1 0.982,0.4929,0.9335,90,118.48,90 - red 4.94 X 14787
Ba-Se BaSe 3 BaS3 ,tP8,113 P-421m 0.72802,0.72802,0.42495,90,90,90 - brown red 5.52 X 14787
Ba-Si BaSi TlI,oS8,63 Cmcm 0.5043,1.1933,0.41395,90,90,90 CrB(TlI)-FeB gray silver 4.41 X 32497
Ba-Si BaSi2 hp1 EuGe2,hP3,164 P-3m1 0.4047,0.4047,0.533,90,90,120 AlB2 family - 4.25 A 13453
Ba-Si BaSi2 hp2 SrSi2,cP12,213 P4132 0.6715,0.6715,0.6715,90,90,90 - golden 4.24 X 11377
Ba-Si BaSi2 BaSi2,oP24,62 Pnma 0.89326,0.67262,1.15335,90,90,90 - black 3.71 X 53575
Ba-Si BaSi6 ht-hp Eu(Ga0.33 Ge0.67)6,oS28,63 Cmcm 0.44789,1.03679,1.19634,90,90,90 clathrate - 3.66 X 53560
Ba-Si Ba0.001 Si0.999 C,cF8,227 Fd-3m 0.54316,0.54316,0.54316,90,90,90 - - 2.34 X 54715
Ba-Si Ba2Si Co2Si-b,oP12,62 Pnma 0.843,0.54,0.988,90,90,90 - - 4.47 X 10295
Ba-Si Ba3Si4 Ba3Si4,tP28,136 P42/mnm 0.85233,0.85233,1.18322,90,90,90 - gray 4.05 X 51495
Ba-Si Ba3.8 Si23 hp Na4Si23,cP54,223 Pm-3n 1.0331,1.0331,1.0331,90,90,90 clathrate gray dark 3.52 X 41984
Ba-Si Ba5Si3 Ba5Si3,tP32,130 P4/ncc 0.8465,0.8465,1.645,90,90,90 - black gray 4.34 X 36727
Ba-Si Ba6Si25 K6Sn25,cP124,213 P4132 1.4061,1.4061,1.4061,90,90,90 clathrate - 3.65 X 57142
Ba-Sn BaSn TlI,oS8,63 Cmcm 0.531,1.2485,0.465,90,90,90 CrB(TlI)-FeB - 5.52 X 3352
Ba-Sn BaSn2 EuGe2,hP3,164 P-3m1 0.4652,0.4652,0.5546,90,90,120 AlB2 family - 5.99 X 51614
Ba-Sn BaSn3 Mg3 Cd,hP8,194 P63/mmc 0.7254,0.7254,0.55,90,90,120 close-packed structure gray silver 6.54 X 49785
Ba-Sn BaSn5 BaSn5,hP6,191 P6/mmm 0.53734,0.53734,0.7097,90,90,120 - gray silver 6.84 X 39510
Ba-Sn Ba2Sn Co2Si-b,oP12,62 Pnma 0.86152,0.56985,1.0569,90,90,90 - - 5.04 X 47801
Ba-Sn Ba3Sn2 Ba3Sn2,tP20,92 P41212 0.66854,0.66854,1.7842,90,90,90 - - 5.41 X 58930
Ba-Sn Ba3Sn5 Pu3Pd5,oS32,63 Cmcm 1.0995,0.8987,1.1176,90,90,90 - black gray 6.05 X 39497
Ba-Sn Ba5Sn3 Cr5B3,tI32,140 I4/mcm 0.902,0.902,1.678,90,90,90 - - 5.07 X 11095
Ba-Sr Ba0.22 Sr0.78 rt Cu,cF4,225 Fm-3m 0.6136,0.6136,0.6136,90,90,90 close-packed structure - 2.83 X 782
Ba-Sr Ba0.5 Sr0.5 W,cI2,229 Im-3m 0.492,0.492,0.492,90,90,90 b.c.c. family - 3.14 X 782
Ba-T BaT2 PbCl2,oP12,62 Pnma 0.679,0.4161,0.782,90,90,90 - - 4.31 A 22169
Ba-Te BaTe hp CsCl,cP2,221 Pm-3m 0.3914,0.3914,0.3914,90,90,90 b.c.c. family - 7.34 X 17353
Ba-Te BaTe rt NaCl,cF8,225 Fm-3m 0.7005,0.7005,0.7005,90,90,90 rocksalt family white 5.12 X 17353
36 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Te BaTe2 SrS2,tI12,140 I4/mcm 0.7181,0.7181,0.8898,90,90,90 - black 5.68 X 30625


Ba-Te BaTe3 BaS3,tP8,113 P-42 1m 0.7915,0.7915,0.443,90,90,90 - black 6.22 X 17729
Ba-Tl BaTl2 CaIn2,hP6,194 P63 /mmc 0.522,0.522,0.8437,90,90,120 AlB2 family - 9.11 X 2405
Ba-Tl BaTl3 rt Cd3Er,oS16,63 Cmcm 0.7024,1.3899,0.5201,90,90,90 close-packed structure gray 9.82 X 40112
Ba-Tl BaTl4 EuIn4,mS20,12 C12/m1 1.2408,0.5351,1.0383,90,116.,90 - gray silver 10.24 X 56311
Ba-Zn BaZn CsCl,cP2,221 Pm-3m 0.4093,0.4093,0.4093,90,90,90 b.c.c. family - 4.91 X 18140
Ba-Zn BaZn13 NaZn13,cF112,226 Fm-3c 1.2358,1.2358,1.2358,90,90,90 - - 6.95 X 46673
Ba-Zn BaZn2 KHg2,oI12,74 Imma 0.5009,0.8104,0.78,90,90,90 AlB2 family - 5.62 X 18140
Ba-Zn BaZn5 BaZn5,oS24,63 Cmcm 1.0783,0.8398,0.532,90,90,90 - gray silver 6.40 X 49745
Ba-Zn Ba2Zn CuZr2,tI6,139 I4/mmm 0.4175,0.4175,1.496,90,90,90 close-packed structure - 4.33 A 18140
Be-Br BeBr2 rt SiS2,oI12,72 Ibam 0.5569,1.0405,0.5543,90,90,90 - - 3.49 X 38007
Be-C Be2C CaF2,cF12,225 Fm-3m 0.434,0.434,0.434,90,90,90 fluorite family colorless 2.44 X 3250
Be-Ca CaBe13 NaZn13,cF112,226 Fm-3c 1.0312,1.0312,1.0312,90,90,90 - - 1.90 X 1585
Be-Ce Be13Ce NaZn13,cF112,226 Fm-3c 1.0376,1.0376,1.0376,90,90,90 - - 3.06 X 43051
Be-Cl BeCl2 ht SiS2,oI12,72 Ibam 0.5285,0.9807,0.5227,90,90,90 - - 1.96 X 38007
Be-Cl BeCl2 rt ZnI2,tI96,142 I41/acd 1.0595,1.0595,1.8036,90,90,90 - - 2.10 X 38007
Be-Cm Be13Cm NaZn13,cF112,226 Fm-3c 1.0272,1.0272,1.0272,90,90,90 - - 4.46 A 9103
Be-Co BeCo CsCl,cP2,221 Pm-3m 0.2625,0.2625,0.2625,90,90,90 b.c.c. family - 6.24 X 11075
Be-Co Be0.3 Co0.7 ht *,tP*,* - 0.2658,0.2658,0.2726,90,90,90 - - - N 10976
Be-Co Be0.67 Co0.33 ht W,cI2,229 Im-3m 0.2582,0.2582,0.2582,90,90,90 b.c.c. family - 4.92 X 10606
Be-Co Be12Co ThMn12,tI26,139 I4/mmm 0.7237,0.7237,0.4249,90,90,90 CaCu5-Zr4Al3 - 2.49 A 847
Be-Co Be17Co2 rt Be15.34 Rh2.36 ,hP19,187 P-6m2 0.42,0.42,1.047,90,90,120 - - 2.81 A 10606
Be-Co Be3Co rt *,hP*,* - 0.83783,0.83783,1.37652,90,90,120 - - - N 11075
Be-Co Be5Co m Be5Au,cF24,216 F-43m 0.5852,0.5852,0.5852,90,90,90 Friauf-Laves phase - 3.45 A 3273
Be-Co Be6Co *,cF*,* - 1.52466,1.52466,1.52466,90,90,90 - - - N 11075
Be-Co Be9Co ht *,cI*,* - 0.76136,0.76136,0.76136,90,90,90 - - - N 11075
Be-Cr Be0.09 Cr0.91 W,cI2,229 Im-3m 0.28623,0.28623,0.28623,90,90,90 b.c.c. family - 6.82 X 690
Be-Cr Be12Cr ThMn12,tI26,139 I4/mmm 0.7238,0.7238,0.4174,90,90,90 CaCu5-Zr4Al3 - 2.43 X 14140
Be-Cr Be2Cr MgZn2,hP12,194 P63 /mmc 0.4239,0.4239,0.6919,90,90,120 Friauf-Laves phase - 4.32 X 113
Be-Cu BeCu CsCl,cP2,221 Pm-3m 0.2702,0.2702,0.2702,90,90,90 b.c.c. family - 6.11 X 4846
Be-Cu Be0.35 Cu0.65 ht W,cI2,229 Im-3m 0.279,0.279,0.279,90,90,90 b.c.c. family - 6.80 X 96
Be-Cu Be2Cu MgCu2,cF24,227 Fd-3m 0.5977,0.5977,0.5977,90,90,90 Friauf-Laves phase - 5.08 X 15739
Be-Cu Be2.25 Cu0.75 Cu0.7 Zn2,hP3,187 P-6m2 0.4179,0.4179,0.2557,90,90,120 AlB2 family - 2.92 X 4846
Be-Dy Be13Dy NaZn13,cF112,226 Fm-3c 1.021,1.021,1.021,90,90,90 - - 3.49 X 18198
Be-Er Be13Er NaZn13,cF112,226 Fm-3c 1.021,1.021,1.021,90,90,90 - - 3.55 X 2362
Be-Eu Be13Eu NaZn13,cF112,226 Fm-3c 1.03,1.03,1.03,90,90,90 - - 3.27 X 2362
Be-F BeF2 ht1 SiO2,hP18,180 P6222 0.4806,0.4806,0.52404,90,90,120 - - 2.23 X 21465
Be-F BeF2 rt SiO2,hP9,152 P3121 0.4739,0.4739,0.51875,90,90,120 - colorless 2.32 X 56392
Be-F BeF2 tet SiO2,tP12,92 P41212 0.4749,0.4749,0.655,90,90,90 - - 2.11 A 19522
Be-Fe Be0.25 Fe0.75 rt W,cI2,229 Im-3m 0.279,0.279,0.279,90,90,90 b.c.c. family - 6.75 X 12631
Be-Fe Be0.56 Fe1.44 m CsCl,cP2,221 Pm-3m 0.273,0.273,0.273,90,90,90 b.c.c. family - 6.98 X 11797
Be-Fe Be12Fe ThMn12,tI26,139 I4/mmm 0.7253,0.7253,0.4232,90,90,90 CaCu5-Zr4Al3 - 2.45 A 847
Be-Fe Be15.2 Fe2.2 rt Be15.34 Rh2.36 ,hP19,187 P-6m2 0.4137,0.4137,1.072,90,90,120 - - 2.72 A 4960
Be-Fe Be2Fe MgZn2,hP12,194 P63 /mmc 0.4225,0.4225,0.6872,90,90,120 Friauf-Laves phase - 4.62 A 37338
Be-Fe Be5Fe Be5Au,cF24,216 F-43m 0.5875,0.5875,0.5875,90,90,90 Friauf-Laves phase - 3.31 A 15739
Be-Gd Be13Gd rt NaZn13,cF112,226 Fm-3c 1.028,1.028,1.028,90,90,90 - - 3.36 A 7726
Be-H BeH2 BeH2,oI36,72 Ibam 0.4160,0.9082,0.7707,90,90,90 - - 0.75 X 21868
Be-Hf BeHf TlI,oS8,63 Cmcm 0.334,1.,0.372,90,90,90 CrB(TlI)-FeB - 10.02 A 13095
Be-Hf Be13Hf ht NaZn13,cF112,226 Fm-3c 1.,1.,1.,90,90,90 - - 3.93 A 1385
Be-Hf Be17Hf2 hex1 Th2Ni17,hP38,194 P63 /mmc 0.744,0.744,0.738,90,90,120 CaCu5-Zr4Al3 - 4.79 A 1385
Be-Hf Be17Hf2 hex2 Zn17U2,hP114,194 P63 /mmc 0.7499,0.7499,2.1905,90,90,120 CaCu5-Zr4Al3 - 4.77 A 1522
Be-Hf Be17Hf2 rhom Zn17Th2,hR57,166 R-3m 0.7494,0.7494,1.093,90,90,120 CaCu5-Zr4Al3 - 4.78 A 1385
Be-Hf Be2Hf AlB2,hP3,191 P6/mmm 0.3787,0.3787,0.3159,90,90,120 AlB2 family - 8.32 X 1385
Be-Hf Be5Hf CaCu5,hP6,191 P6/mmm 0.4519,0.4519,0.3465,90,90,120 - - 6.06 X 1385
Be-Ho Be13Ho NaZn13,cF112,226 Fm-3c 1.0225,1.0225,1.0225,90,90,90 - - 3.51 X 2362
Be-I BeI2 orth SiS2,oI12,72 Ibam 0.6025,1.1316,0.6035,90,90,90 - - 4.24 X 38007
Be-I BeI2 tet ZnI2,tI96,142 I41/acd 1.219,1.219,2.1325,90,90,90 - - 4.41 X 38007
Be-Ir Be17Ir2 Be15.34 Rh2.36 ,hP19,187 P-6m2 0.4193,0.4193,1.089,90,90,120 - - 5.38 A 6239
Be-La Be13La NaZn13,cF112,226 Fm-3c 1.046,1.046,1.046,90,90,90 - - 2.97 X 2362
Be-Lu Be13Lu NaZn13,cF112,226 Fm-3c 1.0173,1.0173,1.0173,90,90,90 - - 3.69 X 2362
Be-Mg MgBe13 NaZn13,cF112,226 Fm-3c 1.0166,1.0166,1.0166,90,90,90 - - 1.79 X 1585
Be-Mn Be12Mn ThMn12,tI26,139 I4/mmm 0.7276,0.7276,0.4256,90,90,90 CaCu5-Zr4Al3 - 2.40 A 847
Be-Mn Be2Mn MgZn2,hP12,194 P63 /mmc 0.4231,0.4231,0.6909,90,90,120 Friauf-Laves phase - 4.52 X 113
Be-Mn Be2Mn0.17 MgCu2,cF24,227 Fd-3m 0.589,0.589,0.589,90,90,90 Friauf-Laves phase - 1.78 X 4221
Be-Mo BeMo3 rt Cr3Si,cP8,223 Pm-3n 0.489,0.489,0.489,90,90,90 Frank-Kasper phase - 8.43 X 1196
Be-Mo Be12Mo ThMn12,tI26,139 I4/mmm 0.7251,0.7251,0.4234,90,90,90 CaCu5-Zr4Al3 - 3.04 X 16875
Be-Mo Be13Mo *,tP56,89 P422 1.027,1.027,0.429,90,90,90 - - 3.13 N 397
Be-Mo Be2Mo MgZn2,hP12,194 P63 /mmc 0.4434,0.4434,0.7275,90,90,120 Friauf-Laves phase - 6.11 X 113
Be-Mo Be22Mo Zn22Zr,cF184,227 Fd-3m 1.1634,1.1634,1.1634,90,90,90 - - 2.48 X 2015
Be-N Be3N2 ht Be3N2,hP12,194 P63 /mmc 0.28413,0.28413,0.9693,90,90,120 - - 2.70 X 4902
Be-N Be3N2 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 0.81452,0.81452,0.81452,90,90,90 - colorless 2.71 X 42498
Be-Nb Be0.15 Nb0.85 W,cI2,229 Im-3m 0.3289,0.3289,0.3289,90,90,90 b.c.c. family - 7.50 X 4240
Be-Nb Be12Nb ThMn12,tI26,139 I4/mmm 0.7357,0.7357,0.4247,90,90,90 CaCu5-Zr4Al3 - 2.90 X 683
Be-Nb Be17Nb2 ht Zn17Th2,hR57,166 R-3m 0.7409,0.7409,1.084,90,90,120 CaCu5-Zr4Al3 - 3.28 X 1066
Be-Nb Be2Nb MgCu2,cF24,227 Fd-3m 0.6535,0.6535,0.6535,90,90,90 Friauf-Laves phase - 5.28 X 1053
Be-Nb Be2Nb3 U3Si2,tP10,127 P4/mbm 0.649,0.649,0.335,90,90,90 - - 6.98 X 1181
Be-Nb Be3Nb PuNi3,hR36,166 R-3m 0.4561,0.4561,2.105,90,90,120 Laves-CaCu5 - 4.73 X 1053
Be-Nd Be13Nd NaZn13,cF112,226 Fm-3c 1.0352,1.0352,1.0352,90,90,90 - - 3.13 X 2362
Handbook of Inorganic Substances – Edition 2015 : Data 37

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Be-Ni BeNi CsCl,cP2,221 Pm-3m 0.2604,0.2604,0.2604,90,90,90 b.c.c. family - 6.37 X 13856


Be-Ni Be0.35 Ni0.65 m *,oP*,* - 0.2578,0.3647,0.3914,90,90,90 - - - N 10976
Be-Ni Be0.989 Ni0.011 Mg,hP2,194 P63/mmc 0.22878,0.22878,0.3598,90,90,120 close-packed structure - 1.95 X 13623
Be-Ni Be21 Ni5 *,cF*,* - 0.7619,0.7619,0.7619,90,90,90 - - - N 2328
Be-Ni Be7Ni ht *,cI*,* - 0.7624,0.7624,0.7624,90,90,90 - - - N 13856
Be-Np Be13 Np NaZn13,cF112,226 Fm-3c 1.0256,1.0256,1.0256,90,90,90 - - 4.36 A 556
Be-O BeO ht BeO,tP8,136 P42/mnm 0.475,0.475,0.274,90,90,90 - - 2.69 X 2458
Be-O BeO rt ZnO,hP4,186 P63mc 0.2696,0.2696,0.43792,90,90,120 bromellite colorless 3.01 X 19040
Be-Os Be12 Os *,mP*,11 P121/m1 1.0628,0.84803,1.1305,90,96.546,90 - - - N 15544
Be-Os Be17 Os2 Be15.34 Rh2.36,hP19,187 P-6m2 0.4221,0.4221,1.094,90,90,120 - - 5.25 A 6239
Be-Os Be17 Os3 Be17 Ru3,cI160,204 Im-3 1.13421,1.13421,1.13421,90,90,90 - - 6.59 A 15544
Be-P BeP2 BeP2,tI12,141 I41/amd 0.3546,0.3546,1.501,90,90,90 - brown red 2.50 X 10023
Be-P Be3P 2 Be3P 2,tI160,142 I41/acd 1.022,1.022,2.039,90,90,90 fluorite family ochre 2.22 X 9180
Be-Pa Be13Pa NaZn13,cF112,226 Fm-3c 1.02607,1.02607,1.02607,90,90,90 - - 4.28 A 9103
Be-Pd BePd CsCl,cP2,221 Pm-3m 0.2813,0.2813,0.2813,90,90,90 b.c.c. family - 8.61 X 113
Be-Pd BePd2 CuZr2,tI6,139 I4/mmm 0.27498,0.27498,0.97148,90,90,90 b.c.c. family gray 10.03 X 40871
Be-Pd BePd3 Re3B,oS16,63 Cmcm 0.28498,0.95672,0.7567,90,90,90 - gray 10.57 X 40871
Be-Pd Be12Pd ThMn12,tI26,139 I4/mmm 0.7271,0.7271,0.4251,90,90,90 CaCu5-Zr4Al3 - 3.17 A 928
Be-Pd Be5Pd Be5Au,cF24,216 F-43m 0.5982,0.5982,0.5982,90,90,90 Friauf-Laves phase yellowish 4.70 X 97
Be-Po BePo ZnS,cF8,216 F-43m 0.5838,0.5838,0.5838,90,90,90 adamantane structure black 7.28 X 1261
Be-Pr Be13Pr NaZn13,cF112,226 Fm-3c 1.037,1.037,1.037,90,90,90 - - 3.07 X 2362
Be-Pt Be12Pt ht ThMn12,tI26,139 I4/mmm 0.7237,0.7237,0.4252,90,90,90 CaCu5-Zr4Al3 - 4.52 A 928
Be-Pt Be5Pt Be5Au,cF24,216 F-43m 0.5978,0.5978,0.5978,90,90,90 Friauf-Laves phase - 7.47 X 928
Be-Pu Be13Pu NaZn13,cF112,226 Fm-3c 1.0278,1.0278,1.0278,90,90,90 - - 4.42 X 765
Be-Re Be2Re MgZn2,hP12,194 P63/mmc 0.4345,0.4345,0.7087,90,90,120 Friauf-Laves phase - 11.71 X 113
Be-Re Be22 Re Zn22 Zr,cF184,227 Fd-3m 1.1561,1.1561,1.1561,90,90,90 - - 3.31 X 1616
Be-Re Be4Re0.23 Be5Au,cF24,216 F-43m 0.5875,0.5875,0.5875,90,90,90 Friauf-Laves phase - 2.58 X 16874
Be-Rh BeRh CsCl,cP2,221 Pm-3m 0.2739,0.2739,0.2739,90,90,90 b.c.c. family - 9.04 X 4883
Be-Rh Be15.34 Rh2.36 Be15.34 Rh2.36,hP19,187 P-6m2 0.4191,0.4191,1.0886,90,90,120 - - 3.82 X 4960
Be-Ru Be17 Ru2 Be15.34 Rh2.36,hP19,187 P-6m2 0.4203,0.4203,1.09,90,90,120 - - 3.54 A 6239
Be-Ru Be17 Ru3 Be17 Ru3,cI160,204 Im-3 1.1337,1.1337,1.1337,90,90,90 - - 4.16 X 1576
Be-Ru Be2Ru MgZn2,hP12,194 P63/mmc 0.596,0.596,0.918,90,90,120 Friauf-Laves phase - 2.80 A 1974
Be-Ru Be3Ru2 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.142,1.142,1.142,90,90,90 - - 4.09 A 1974
Be-S BeS rt ZnS,cF8,216 F-43m 0.4863,0.4863,0.4863,90,90,90 adamantane structure colorless 2.37 X 6803
Be-Sb Be13 Sb NaZn13,cF112,226 Fm-3c 1.0046,1.0046,1.0046,90,90,90 - - 3.13 X 10486
Be-Sc Be13 Sc NaZn13,cF112,226 Fm-3c 1.009,1.009,1.009,90,90,90 - - 2.10 A 42063
Be-Sc Be17 Sc2 Th2Ni17,hP38,194 P63/mmc 0.761,0.761,0.75,90,90,120 CaCu5-Zr4Al3 - 2.15 A 2052
Be-Sc Be5Sc CaCu5,hP6,191 P6/mmm 0.455,0.455,0.35,90,90,120 - - 2.38 X 2369
Be-Se BeSe hp NiAs,hP4,194 P63/mmc 0.3123,0.3123,0.4955,90,90,120 AlB2 family - 6.98 X 30922
Be-Se BeSe rt ZnS,cF8,216 F-43m 0.4647,0.4647,0.4647,90,90,90 adamantane structure black gray 5.82 X 30922
Be-Sm Be13 Sm NaZn13,cF112,226 Fm-3c 1.0325,1.0325,1.0325,90,90,90 - - 3.23 X 2362
Be-Sr SrBe 13 NaZn13,cF112,226 Fm-3c 1.046,1.046,1.046,90,90,90 - - 2.38 X 3508
Be-Ta BeTa2 CuAl2,tI12,140 I4/mcm 0.601,0.601,0.489,90,90,90 - - 13.95 X 6743
Be-Ta Be12 Ta ThMn12,tI26,139 I4/mmm 0.7349,0.7349,0.4243,90,90,90 CaCu5-Zr4Al3 - 4.19 A 10692
Be-Ta Be17 Ta2 Zn17 Th2,hR57,166 R-3m 0.7388,0.7388,1.074,90,90,120 CaCu5-Zr4Al3 - 5.05 A 1385
Be-Ta Be2Ta MgCu2,cF24,227 Fd-3m 0.6507,0.6507,0.6507,90,90,90 Friauf-Laves phase - 9.59 X 9440
Be-Ta Be2Ta3 U3Si2,tP10,127 P4/mbm 0.65,0.65,0.332,90,90,90 - - 13.28 A 1385
Be-Ta Be3Ta PuNi3,hR36,166 R-3m 0.453,0.453,2.095,90,90,120 Laves-CaCu5 - 8.35 A 1385
Be-Tb Be13 Tb NaZn13,cF112,226 Fm-3c 1.0254,1.0254,1.0254,90,90,90 - - 3.40 X 11809
Be-Tc Be22 Tc Zn22 Zr,cF184,227 Fd-3m 1.1566,1.1566,1.1566,90,90,90 - - 2.54 A 14819
Be-Te BeTe hp NiAs,hP4,194 P63/mmc 0.3423,0.3423,0.5528,90,90,120 AlB2 family - 8.09 X 30922
Be-Te BeTe rt ZnS,cF8,216 F-43m 0.56269,0.56269,0.56269,90,90,90 adamantane structure - 5.09 X 6803
Be-Th Be13 Th NaZn13,cF112,226 Fm-3c 1.04101,1.04101,1.04101,90,90,90 - - 4.11 X 18420
Be-Ti BeTi m CsCl,cP2,221 Pm-3m 0.294,0.294,0.294,90,90,90 b.c.c. family - 3.72 X 11780
Be-Ti Be0.1 Ti rt Mg,hP2,194 P63/mmc 0.2956,0.2956,0.4745,90,90,120 close-packed structure - 4.51 F 324
Be-Ti Be12 Ti ThMn12,tI26,139 I4/mmm 0.739,0.739,0.419,90,90,90 CaCu5-Zr4Al3 - 2.26 A 1385
Be-Ti Be17 Ti2 hex Th2Ni17,hP38,194 P63/mmc 0.736,0.736,0.73,90,90,120 CaCu5-Zr4Al3 - 2.41 A 1385
Be-Ti Be17 Ti2 rhom Zn17 Th2,hR57,166 R-3m 0.7392,0.7392,1.079,90,90,120 CaCu5-Zr4Al3 - 2.43 A 1385
Be-Ti Be2Ti MgCu2,cF24,227 Fd-3m 0.645,0.645,0.645,90,90,90 Friauf-Laves phase - 3.26 X 9440
Be-Ti Be3Ti PuNi3,hR36,166 R-3m 0.449,0.449,2.132,90,90,120 Laves-CaCu5 - 3.01 A 1385
Be-Tm Be13 Tm NaZn13,cF112,226 Fm-3c 1.0199,1.0199,1.0199,90,90,90 - - 3.58 X 2362
Be-U Be13 U NaZn13,cF112,226 Fm-3c 1.0268,1.0268,1.0268,90,90,90 - - 4.36 X 23144
Be-V Be12 V ThMn12,tI26,139 I4/mmm 0.7266,0.7266,0.4194,90,90,90 CaCu5-Zr4Al3 - 2.39 X 683
Be-V Be2V MgZn2,hP12,194 P63/mmc 0.4385,0.4385,0.713,90,90,120 Friauf-Laves phase - 3.86 X 113
Be-W Be0.05 W0.95 W,cI2,229 Im-3m 0.31624,0.31624,0.31624,90,90,90 b.c.c. family - 18.39 X 3138
Be-W Be12W ThMn12,tI26,139 I4/mmm 0.7235,0.7235,0.4233,90,90,90 CaCu5-Zr4Al3 - 4.38 A 909
Be-W Be2W MgZn2,hP12,194 P63/mmc 0.4437,0.4437,0.7274,90,90,120 Friauf-Laves phase - 10.81 X 113
Be-W Be22W Zn22 Zr,cF184,227 Fd-3m 1.1631,1.1631,1.1631,90,90,90 - - 3.23 X 2015
Be-Y Be13 Y NaZn13,cF112,226 Fm-3c 1.024,1.024,1.024,90,90,90 - - 2.55 A 13394
Be-Yb Be13 Yb NaZn13,cF112,226 Fm-3c 1.0182,1.0182,1.0182,90,90,90 - - 3.65 X 2362
Be-Zr Be13 Zr NaZn13,cF112,226 Fm-3c 1.0047,1.0047,1.0047,90,90,90 - - 2.73 X 305
Be-Zr Be17 Zr2 Zn17 Th2,hR57,166 R-3m 0.7538,0.7538,1.1015,90,90,120 CaCu5-Zr4Al3 - 3.08 X 16818
Be-Zr Be2Zr AlB2 ,hP3,191 P6/mmm 0.3814,0.3814,0.323,90,90,120 AlB2 family - 4.46 X 9440
Be-Zr Be5Zr CaCu5,hP6,191 P6/mmm 0.4564,0.4564,0.3485,90,90,120 - - 3.60 X 1064
Bi-Br BiBr BiBr,mS32,12 C12/m1 1.3064,0.4338,2.0061,90,107.42,90 - - 7.08 X 11942
Bi-Br BiBr3 ht AlCl3,mS16,12 C12/m1 0.7249,1.2528,0.6849,90,110.68,90 - - 5.12 X 13825
Bi-Br BiBr3 rt BiBr3,mP16,14 P121/c1 0.6756,0.9848,0.8429,90,109.65,90 - yellow 5.64 X 13825
Bi-Br Bi6Br7 Bi6Cl7,oP104,58 Pnnm 1.5622,2.3852,0.9139,90,90,90 - black 7.07 X 11942
38 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Ca Ca11Bi10 Ho11Ge10,tI84,139 I4/mmm 1.222,1.222,1.779,90,90,90 - gray 6.33 X 10304


Bi-Ca Ca16Bi11 Ca16Sb11,tP56,113 P-42 1m 1.24949,1.24949,1.143,90,90,90 - - 5.47 A 33066
Bi-Ca Ca2Bi La2Sb,tI12,139 I4/mmm 0.472,0.472,1.654,90,90,90 - gray 5.21 X 8665
Bi-Ca Ca5Bi3 (H) Yb5Sb3,oP32,62 Pnma 1.2722,0.9666,0.8432,90,90,90 - black 5.30 X 7942
Bi-Ca Ca5Bi3 rt Mn5Si3,hP16,193 P63 /mcm 0.91757,0.91757,0.71444,90,90,120 - - 5.27 A 46240
Bi-Ce CeBi hp2 CsCl,cP2,221 Pm-3m 0.3739,0.3739,0.3739,90,90,90 b.c.c. family - 11.09 X 18186
Bi-Ce CeBi lt CuTi,tP2,123 P4/mmm 0.3993,0.3993,0.335,90,90,90 b.c.c. family - 10.85 X 18186
Bi-Ce CeBi rt NaCl,cF8,225 Fm-3m 0.655,0.655,0.655,90,90,90 rocksalt family - 8.25 X 27909
Bi-Ce CeBi2 *,aP*,* - 0.6528,1.18516,1.30564,91.515,92.199,103.02 - - - N 9099
Bi-Ce Ce2Bi La2Sb,tI12,139 I4/mmm 0.45911,0.45911,1.81539,90,90,90 - - 8.49 A 9099
Bi-Ce Ce4Bi3 Th3P 4,cI28,220 I-43d 0.9672,0.9672,0.9672,90,90,90 - - 8.72 X 26245
Bi-Ce Ce5Bi3 Mn5Si3,hP16,193 P63 /mcm 0.95313,0.95313,0.65871,90,90,120 - - 8.51 A 9099
Bi-Cl BiCl3 BiCl3,oP16,33 Pna21 0.7641,0.6291,0.9172,90,90,90 - - 4.75 X 5686
Bi-Cl Bi6Cl7 Bi6Cl7,oP104,58 Pnnm 1.5075,2.3093,0.8784,90,90,90 - - 6.53 X 31486
Bi-Cl Bi7Cl10 rt Bi7Cl10,tI1216,142 I41/acd 2.8235,2.8235,3.995,90,90,90 - black 6.06 X 45710
Bi-Cm CmBi rt NaCl,cF8,225 Fm-3m 0.6335,0.6335,0.6335,90,90,90 rocksalt family - 11.91 X 20198
Bi-Cs CsBi CsSb,mP32,14 P121/c1 1.5237,0.7737,1.4399,90,112.722,90 - black 5.80 X 43945
Bi-Cs CsBi2 MgCu2,cF24,227 Fd-3m 0.972,0.972,0.972,90,90,90 Friauf-Laves phase gray silver 7.97 X 43945
Bi-Cs Cs3Bi BiF3,cF16,225 Fm-3m 0.9292,0.9292,0.9292,90,90,90 b.c.c. family black 5.03 X 1414
Bi-Cs Cs3Bi2 Eu3Ga2,mS20,15 C12/c1 1.0077,1.03207,1.0145,90,105.21,90 - gray dark 5.33 X 37249
Bi-Cs Cs5Bi4 Rb5As4,mS20,12 C12/m1 1.2887,0.6323,1.26361,90,122.94,90 - - 5.77 X 38697
Bi-Dy DyBi lt *,t*8,* - 0.6247,0.6247,0.6212,90,90,90 - - - N 13387
Bi-Dy DyBi rt NaCl,cF8,225 Fm-3m 0.6234,0.6234,0.6234,90,90,90 rocksalt family gray 10.18 X 13387
Bi-Dy Dy5Bi3 Y5Bi3,oP32,62 Pnma 0.8155,0.9432,1.1934,90,90,90 - - 10.42 X 38857
Bi-Er ErBi rt NaCl,cF8,225 Fm-3m 0.6186,0.6186,0.6186,90,90,90 rocksalt family - 10.56 X 25998
Bi-Er Er5Bi3 Y5Bi3,oP32,62 Pnma 0.809,0.9349,1.1806,90,90,90 - - 10.88 X 38857
Bi-Eu EuBi2 HfGa2,tI24,141 I41/amd 0.4726,0.4726,3.4221,90,90,90 close-packed structure black 9.91 X 43480
Bi-Eu Eu11Bi10 Ho11Ge10,tI84,139 I4/mmm 1.26103,1.26103,1.82598,90,90,90 - - 8.60 A 12388
Bi-Eu Eu16Bi11 Ca16Sb11,tP56,113 P-42 1m 1.2885,1.2885,1.1883,90,90,90 - - 7.96 X 37729
Bi-Eu Eu4Bi3 Th3P 4,cI28,220 I-43d 0.992,0.992,0.992,90,90,90 - gray 8.40 X 32459
Bi-Eu Eu5Bi3 hex Mn5Si3,hP16,193 P63 /mcm 0.95551,0.95551,0.73256,90,90,120 - - 7.95 X 46240
Bi-Eu Eu5Bi3 orth Yb5Sb3,oP32,62 Pnma 1.31522,1.01219,0.87544,90,90,90 - - 7.90 X 12388
Bi-F BiF3 cub BiF3,cF16,225 Fm-3m 0.5849,0.5849,0.5849,90,90,90 gananite white 8.83 X 243
Bi-F BiF3 hp HoH3,hP24,165 P-3c1 0.7076,0.7076,0.735,90,90,120 - - 8.32 A 14573
Bi-F BiF3 orth Fe3C-b,oP16,62 Pnma 0.65614,0.70153,0.48414,90,90,90 - - 7.93 X 11059
Bi-F BiF5 UF5,tI12,87 I4/m 0.6581,0.6581,0.4229,90,90,90 - colorless 5.51 X 6331
Bi-Gd GdBi rt NaCl,cF8,225 Fm-3m 0.63108,0.63108,0.63108,90,90,90 rocksalt family - 9.68 X 9099
Bi-Gd Gd4Bi3 Th3P 4,cI28,220 I-43d 0.93876,0.93876,0.93876,90,90,90 - gray 10.08 X 58208
Bi-Gd Gd5Bi3 Bi+ Mn5Si3,hP16,193 P63 /mcm 0.9182,0.9182,0.6426,90,90,120 - - 10.00 X 4690
Bi-Gd Gd5Bi3 rt Y5Bi3,oP32,62 Pnma 0.8226,0.954,1.2085,90,90,90 - - 9.90 X 38857
Bi-Hf HfBi ZrSb,oS24,63 Cmcm 0.38059,1.0735,1.4208,90,90,90 - - 13.30 A 39471
Bi-Hf HfBi2 TiAs2,oP24,58 Pnnm 1.014,1.5574,0.3969,90,90,90 - - 12.64 X 39471
Bi-Hf Hf8Bi9 V7.5 Sb9,tP34,129 P4/nmm 1.0718,1.0718,0.752,90,90,90 - - 12.72 A 33528
Bi-Ho HoBi lt *,t*8,* - 0.621,0.621,0.6217,90,90,90 - - - N 17120
Bi-Ho HoBi rt NaCl,cF8,225 Fm-3m 0.6223,0.6223,0.6223,90,90,90 rocksalt family - 10.31 X 18387
Bi-Ho Ho5Bi3 orth1 Y5Bi3,oP32,62 Pnma 0.8128,0.9385,1.1874,90,90,90 - - 10.65 X 38857
Bi-Ho Ho5Bi3 orth2 Yb5Sb3,oP32,62 Pnma 1.181,0.9359,0.8095,90,90,90 - - 10.78 A 44867
Bi-I BiI ht1 BiI-a,mS16,12 C12/m1 1.4386,0.4430,1.0493,90,107.87,90 - black 7.01 X 11940
Bi-I BiI ht2 BiI-b,mS16,12 C12/m1 1.4444,0.4456,1.0538,90,107.64,90 - black 6.90 X 11940
Bi-I BiI rt BiI,mS32,12 C12/m1 1.4245,0.4428,1.9968,90,92.96,90 - black 7.09 X 11940
Bi-I BiI3 mon BiBr3,mP16,14 P121/c1 0.6728,0.9565,0.8106,90,107.56,90 - - 7.88 A 35056
Bi-I BiI3 rhom BiI3,hR24,148 R-3 0.75249,0.75249,2.0733,90,90,120 - red 5.78 X 31169
Bi-I BiI3 trig BiI3,hP8,162 P-31m 0.75,0.75,0.69,90,90,120 - - 5.83 X 457
Bi-I Bi4I Bi4I,mS40,12 C12/m1 2.5948,0.4354,1.3259,90,104.48,90 - black 8.82 X 50283
Bi-I Bi7I2 Bi7I2,mP18,11 P121/m1 1.1447,0.4342,1.3309,90,92.08,90 - - 8.62 X 26811
Bi-I Bi9I2 Bi9I2,mP22,11 P121/m1 1.3353,0.4383,1.5184,90,115.06,90 - - 8.81 X 23300
Bi-In InBi InBi,tP4,129 P4/nmm 0.502,0.502,0.479,90,90,90 - - 8.91 X 11041
Bi-In InBi3 m *,oI4,74 Imma 0.605,0.624,0.335,90,90,90 - - - N 9379
Bi-In In0.2 Bi0.8 m Sn,tI4,141 I41/amd 0.615,0.615,0.3305,90,90,90 - - 10.10 X 9379
Bi-In In0.45 Bi0.55 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3314,0.3314,0.3115,90,90,120 - - 9.34 X 3753
Bi-In In0.56 Bi0.44 hp Pa,tI2,139 I4/mmm 0.3715,0.3715,0.3426,90,90,90 b.c.c. family - 10.98 X 45277
Bi-In In0.62 Bi0.38 m W,cI2,229 Im-3m 0.3832,0.3832,0.3832,90,90,90 b.c.c. family - 8.89 X 3753
Bi-In In0.66 Bi0.34 hp In,tI2,139 I4/mmm 0.3447,0.3447,0.3883,90,90,90 close-packed structure - 10.57 X 45277
Bi-In In0.78 Bi0.22 m In,tI2,139 I4/mmm 0.3545,0.3545,0.4304,90,90,90 close-packed structure - 8.32 X 3753
Bi-In In0.9 Bi0.1 ht In,tI2,139 I4/mmm 0.3472,0.3472,0.4495,90,90,90 close-packed structure - 7.61 X 11634
Bi-In In0.94 Bi0.06 In,tI2,139 I4/mmm 0.3265,0.3265,0.5023,90,90,90 close-packed structure - 7.47 X 11634
Bi-In In2Bi Co1.75 Ge,hP6,194 P63 /mmc 0.5495,0.5495,0.6579,90,90,120 AlB2 family - 8.47 X 11041
Bi-In In3Bi2 m *,hP*,* - 1.17,1.17,0.853,90,90,120 - - - N 1498
Bi-In In5Bi3 In5Bi3,tI32,140 I4/mcm 0.8544,0.8544,1.268,90,90,90 - - 8.62 X 11041
Bi-Ir IrBi2 CoSb2,mP12,14 P121/c1 0.69011,0.67885,0.69617,90,116.454,90 pyrite-marcasite family - 13.88 X 59458
Bi-K KBi CsSb,mP32,14 P121/c1 1.4223,0.7248,1.342,90,113.03,90 - black 5.18 X 43945
Bi-K KBi2 MgCu2,cF24,227 Fd-3m 0.9521,0.9521,0.9521,90,90,90 Friauf-Laves phase gray silver 7.04 X 43945
Bi-K K3Bi ht BiF3,cF16,225 Fm-3m 0.8805,0.8805,0.8805,90,90,90 b.c.c. family - 3.17 X 1814
Bi-K K3Bi rt Cu3P,hP24,185 P63 cm 1.0649,1.0649,1.094,90,90,120 - black 3.03 X 35320
Bi-K K3Bi2 Eu3Ga2,mS20,15 C12/c1 0.9381,0.9794,0.9284,90,104.99,90 - gray dark 4.31 A 37249
Bi-K K5Bi4 K5Bi4,mS18,12 C12/m1 1.2517,0.5541,1.1625,90,111.46,90 - - 4.57 X 38697
Bi-La LaBi NaCl,cF8,225 Fm-3m 0.661,0.661,0.661,90,90,90 rocksalt family - 8.00 X 21779
Bi-La LaBi2 *,oP12,* - 0.4564,0.4737,1.751,90,90,90 - - - N 10739
Handbook of Inorganic Substances – Edition 2015 : Data 39

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-La La0.95 Bi0.05 ht Pa,tI2,139 I4/mmm 0.4126,0.4126,0.431,90,90,90 b.c.c. family - 6.45 X 10739
Bi-La La2Bi La2Sb,tI12,139 I4/mmm 0.46737,0.46737,1.83952,90,90,90 - - 8.05 A 9099
Bi-La La4Bi3 Th3P 4,cI28,220 I-43d 0.979,0.979,0.979,90,90,90 - gray 8.37 A 18176
Bi-La La5Bi3 Mn5 Si3,hP16,193 P63/mcm 0.96585,0.96585,0.6697,90,90,120 - - 8.11 A 9099
Bi-Li LiBi rt CuAu,tP2,123 P4/mmm 0.3361,0.3361,0.4247,90,90,90 close-packed structure - 7.47 X 100
Bi-Li Li3Bi BiF3 ,cF16,225 Fm-3m 0.67264,0.67264,0.67264,90,90,90 b.c.c. family - 5.02 X 41813
Bi-Lu LuBi NaCl,cF8,225 Fm-3m 0.6156,0.6156,0.6156,90,90,90 rocksalt family - 10.93 X 2059
Bi-Lu Lu5Bi3 Y5Bi3,oP32,62 Pnma 0.8046,0.9768,1.1718,90,90,90 - - 10.83 A 30981
Bi-Mg Mg0.995 Bi0.005 Mg,hP2,194 P63/mmc 0.32106,0.32106,0.52146,90,90,120 close-packed structure - 1.80 X 1131
Bi-Mg Mg1.5 Bi ht Ag2S,cI20,229 Im-3m 0.5297,0.5297,0.5297,90,90,90 - - 5.49 A 28923
Bi-Mg Mg3 Bi2 rt La2O3,hP5,164 P-3m1 0.4671,0.4671,0.7403,90,90,120 - - 5.83 X 67
Bi-Mn MnBi lt NiAs,hP4,194 P63/mmc 0.429,0.429,0.6126,90,90,120 AlB2 family - 8.98 X 3405
Bi-Mn MnBi tf *,cF*,* - 1.205,1.205,1.205,90,90,90 - - - N 26288
Bi-Mn Mn1.08 Bi ht Co1.75 Ge,hP6,194 P63/mmc 0.4365,0.4365,0.592,90,90,120 AlB2 family - 9.12 X 53106
Bi-Mn Mn2.23 Bi1.88 ht Mn2.23 Bi1.88 ,oP10,51 Pmma 0.5959,0.4334,0.7505,90,90,90 - - 8.83 X 6503
Bi-Mn Mn3 Bi m Mn3 Bi,hR48,166 R-3m 1.997,1.997,0.449,90,90,120 - - 4.80 X 18848
Bi-Na NaBi CuAu,tP2,123 P4/mmm 0.346,0.346,0.48,90,90,90 close-packed structure - 6.70 X 54
Bi-Na Na3Bi rt Na3As,hP8,194 P63/mmc 0.5448,0.5448,0.9655,90,90,120 - - 3.72 X 145
Bi-Nb Nb0.75 Bi0.25 W,cI2,229 Im-3m 0.3327,0.3327,0.3327,90,90,90 b.c.c. family - 11.00 X 2273
Bi-Nb Nb3 Bi ht-hp Cr3Si,cP8,223 Pm-3n 0.532,0.532,0.532,90,90,90 Frank-Kasper phase - 10.76 X 2273
Bi-Nd NdBi NaCl,cF8,225 Fm-3m 0.641,0.641,0.641,90,90,90 rocksalt family black gray 8.91 X 21779
Bi-Nd NdBi2 *,aP*,* - 0.64682,1.18576,1.29796,91.723,92.361,104.013 - - - N 9099
Bi-Nd Nd2 Bi La2Sb,tI12,139 I4/mmm 0.45603,0.45603,1.7865,90,90,90 - - 8.89 X 57414
Bi-Nd Nd4 Bi3 Th3P 4,cI28,220 I-43d 0.9552,0.9552,0.9552,90,90,90 - gray 9.18 A 39704
Bi-Nd Nd5 Bi3 Mn5 Si3,hP16,193 P63/mcm 0.937,0.937,0.6528,90,90,120 - - 9.02 A 39704
Bi-Ni NiBi NiBi,mS66,12 C12/m1 1.41239,0.81621,1.28325,90,123.389,90 - black 11.52 X 36613
Bi-Ni NiBi3 NiBi3,oP16,62 Pnma 0.88796,0.40997,1.1478,90,90,90 - - 10.90 X 47796
Bi-Ni Ni0.92 Bi IC Ni0.92 Bi,oP20,51 Pmma 0.53243,0.81527,1.41209,90,90,90 - gray silver 4.27 X 38078
Bi-Ni Ni5Bi5.6 Ni5Bi5.6,oI52,74 Imma 0.4219,1.924,1.1656,90,90,90 - - 10.28 X 55634
Bi-Np NpBi NaCl,cF8,225 Fm-3m 0.637,0.637,0.637,90,90,90 rocksalt family - 11.46 X 30189
Bi-O BiO tf BiO,hR6,160 R3m 0.388,0.388,0.971,90,90,120 - yellowish 8.85 X 3235
Bi-O BiO1.5 ht2 CaF2 ,cF12,225 Fm-3m 0.56542,0.56542,0.56542,90,90,90 fluorite family brown 8.56 X 44796
Bi-O BiO1.5 m tet BiO1.5 ,tI6,139 I4/mmm 0.4022,0.4022,0.5558,90,90,90 - - 8.61 X 51957
Bi-O BiO2 SbO2,mS24,15 C12/c1 1.23668,0.5118,0.5567,90,107.838,90 - brown dark 9.54 X 30600
Bi-O Bi12.8 O19.2 m Bi12.8 O19.2 ,cI66,197 I23 1.02501,1.02501,1.02501,90,90,90 - yellow 9.20 X 25858
Bi-O Bi2O2.5 tf Bi2O3,tP20,114 P-421c 0.773,0.773,0.563,90,90,90 - - 9.04 X 6279
Bi-O Bi2O2.7 tf Bi2O2.7 ,tI14,139 I4/mmm 0.385,0.385,1.225,90,90,90 - yellowish 8.44 X 2806
Bi-O Bi2O3 hp1 Bi2O3,hP20,159 P31c 0.7749,0.7749,0.6302,90,90,120 - yellow 9.44 X 55264
Bi-O Bi2O3 hp2 Bi2O3,hP20,186 P63mc 0.7605,0.7605,0.5937,90,90,120 - - 10.41 X 57164
Bi-O Bi2O3 ht1 Bi2O3,tP20,114 P-421c 0.774,0.774,0.56446,90,90,90 sphaerobismoite yellow 9.15 X 50887
Bi-O Bi2O3 m cub Ag2O2.5 ,cP10,224 Pn-3m 0.5529,0.5529,0.5529,90,90,90 - - 9.16 X 49211
Bi-O Bi2O3 m mon Bi2O3,mP40,14 P121/c1 0.9107,0.7344,1.009,90,102.111,90 - - 9.38 X 55264
Bi-O Bi2O3 m orth Sb2O3,oP20,56 Pccn 0.49555,1.27299,0.55854,90,90,90 - - 8.78 X 46461
Bi-O Bi2O3 rt Bi2O3,mP20,14 P121/c1 0.58444,0.81574,0.75032,90,112.97,90 bismite green dark 9.40 X 39332
Bi-O Bi4O7 Bi4O7,aP22,2 P-1 0.67253,0.6995,0.77961,72.566,88.842,76.925 - brown dark 9.25 X 40439
Bi-O Bi6O7 tf Bi6O7,tI38,139 I4/mmm 0.385,0.385,3.51,90,90,90 - - 8.72 X 4258
Bi-Pb Pb0.0039 Bi0.9961 As,hR6,166 R-3m 0.4534,0.4534,1.1814,90,90,120 - - 9.90 X 1618
Bi-Pb Pb0.375 Bi0.625 hp Nd,hP4,194 P63/mmc 0.345,0.345,1.13,90,90,120 close-packed structure - 11.88 X 4871
Bi-Pb Pb0.7 Bi0.3 rt Mg,hP2,194 P63/mmc 0.35059,0.35059,0.5686,90,90,120 close-packed structure - 11.40 X 16116
Bi-Pb Pb0.75 Bi0.25 Cu,cF4,225 Fm-3m 0.49714,0.49714,0.49714,90,90,90 close-packed structure - 11.23 X 10056
Bi-Pb Pb0.96 Bi1.04 m *,tP48,* - 0.9931,0.9931,1.499,90,90,90 - - - N 7786
Bi-Pd PdBi ht PdBi,oS32,36 Cmc21 0.8707,0.7203,1.0662,90,90,90 CrB(TlI)-FeB - 12.53 X 910
Bi-Pd PdBi rt PdBi,mP16,4 P1211 0.5635,1.0651,0.5661,90,100.85,90 CrB(TlI)-FeB - 12.56 X 22882
Bi-Pd PdBi0.6 ht *,hP16,* - 0.777,0.777,0.5817,90,90,120 - - - N 1007
Bi-Pd PdBi2 ht CuZr2,tI6,139 I4/mmm 0.3362,0.3362,1.2983,90,90,90 close-packed structure - 11.87 X 910
Bi-Pd PdBi2 rt PdBi2,mS12,12 C12/m1 1.274,0.425,0.5665,90,102.58,90 froodite - 11.63 X 910
Bi-Pd Pd0.91 Bi0.09 Cu,cF4,225 Fm-3m 0.39498,0.39498,0.39498,90,90,90 close-packed structure - 12.46 X 48616
Bi-Pd Pd3Bi rt Pd3Bi,oP16,51 Pmma 0.9393,0.5752,0.4954,90,90,90 close-packed structure - 13.11 X 4696
Bi-Pd Pd5Bi2 rt Pd5Bi2,mS28,12 C12/m1 1.4192,0.5780,0.6752,90,117.256,90 - - 12.82 X 12434
Bi-Pd Pd8Bi3 ht Pd8Sb3,hR132,161 R3c 0.7809,0.7809,4.2597,90,90,120 - - 13.09 A 12434
Bi-Pr PrBi NaCl,cF8,225 Fm-3m 0.647,0.647,0.647,90,90,90 rocksalt family - 8.58 X 21779
Bi-Pr PrBi2 *,o**,* - 0.6512,1.1821,1.3022,90,90,90 - - - N 33073
Bi-Pr Pr2Bi La2Sb,tI12,139 I4/mmm 0.4602,0.4602,1.7988,90,90,90 - - 8.56 A 33073
Bi-Pr Pr4Bi3 Th3P 4,cI28,220 I-43d 0.9622,0.9622,0.9622,90,90,90 - gray 8.88 A 33073
Bi-Pr Pr5Bi3 Mn5 Si3,hP16,193 P63/mcm 0.9452,0.9452,0.6542,90,90,120 - - 8.74 A 33073
Bi-Pt PtBi NiAs,hP4,194 P63/mmc 0.4315,0.4315,0.549,90,90,120 AlB2 family - 15.16 X 1752
Bi-Pt PtBi2 ht1 FeS2 ,cP12,205 Pa-3 0.67014,0.67014,0.67014,90,90,90 insizwaite - 13.53 X 29567
Bi-Pt PtBi2 ht2 PtBi2,hP9,147 P-3 0.657,0.657,0.616,90,90,120 - - 13.26 X 4714
Bi-Pt PtBi2 rt AuSn2,oP24,61 Pbca 0.6732,0.6794,1.3346,90,90,90 - - 13.34 X 13855
Bi-Pt Pt0.67 Bi ht NiAs,hP4,194 P63/mmc 0.413,0.413,0.558,90,90,120 AlB2 family - 13.69 X 4213
Bi-Pu PuBi hp2 CsCl,cP2,221 Pm-3m 0.344,0.344,0.344,90,90,90 b.c.c. family - 18.48 X 35836
Bi-Pu PuBi NaCl,cF8,225 Fm-3m 0.63588,0.63588,0.63588,90,90,90 rocksalt family - 11.70 X 35836
Bi-Pu Pu4Bi3 Th3P 4,cI28,220 I-43d 0.94,0.94,0.94,90,90,90 - - 12.82 A 30189
Bi-Rb RbBi CsSb,mP32,14 P121/c1 1.4742,0.7502,1.3921,90,113.033,90 - black 5.52 X 43945
Bi-Rb RbBi2 MgCu2,cF24,227 Fd-3m 0.9625,0.9625,0.9625,90,90,90 Friauf-Laves phase gray silver 7.50 X 43945
Bi-Rb Rb3Bi rt cub BiF3 ,cF16,225 Fm-3m 0.8494,0.8494,0.8494,90,90,90 b.c.c. family - 5.04 X 10990
Bi-Rb Rb3Bi rt hex Na3As,hP8,194 P63/mmc 0.642,0.642,1.146,90,90,120 - gray dark 3.78 X 1311
Bi-Rb Rb3Bi2 Eu3Ga2,mS20,15 C12/c1 0.9735,1.0075,0.9715,90,105.34,90 - gray dark 4.87 A 37249
40 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Rb Rb5Bi4 Rb5As4,mS20,12 C12/m1 1.2945,0.57851,1.2018,90,112.78,90 - - 5.06 X 38697


Bi-Rh RhBi NiAs,hP4,194 P63 /mmc 0.40894,0.40894,0.56642,90,90,120 AlB2 family - 12.63 X 1681
Bi-Rh RhBi2 ht1 RhBi2,aP12,2 P-1 0.6743,0.7030,0.7067,104.76,100.73,105.79 - gray light 11.54 X 31435
Bi-Rh RhBi2 rt CoSb2,mP12,14 P121/c1 0.696,0.683,0.701,90,118.2,90 pyrite-marcasite family - 11.78 X 1747
Bi-Rh RhBi3 NiBi3,oP16,62 Pnma 0.9027,0.424,1.1522,90,90,90 - - 10.99 X 1513
Bi-Rh RhBi4 rt RhBi4,cI120,230 Ia-3d 1.4928,1.4928,1.4928,90,90,90 - - 11.25 X 804
Bi-Rh Rh3Bi14 Rh3Bi14,oF136,70 Fddd 0.68959,1.7379,3.1758,90,90,90 - - 11.29 X 49116
Bi-S Bi2S3 Sb2S3,oP20,62 Pnma 1.1345,0.3994,1.1193,90,90,90 bismuthinite black 6.73 X 42697
Bi-Sb Bi0.969 Sb0.031 As,hR6,166 R-3m 0.454,0.454,1.185,90,90,120 - - 9.72 X 1618
Bi-Sc ScBi NaCl,cF8,225 Fm-3m 0.5954,0.5954,0.5954,90,90,90 rocksalt family - 7.99 X 1753
Bi-Sc Sc5Bi3 Yb5Sb3,oP32,62 Pnma 1.1236,0.8873,0.7761,90,90,90 - gray dark 7.31 X 39471
Bi-Se BiSe m NaCl,cF8,225 Fm-3m 0.599,0.599,0.599,90,90,90 rocksalt family - 8.90 X 641
Bi-Se BiSe BiSe,hP12,164 P-3m1 0.4212,0.4212,2.2942,90,90,120 - - 8.14 X 30794
Bi-Se Bi0.7Se0.3 m As,hR6,166 R-3m 0.454,0.454,1.183,90,90,120 - - 8.02 A 17007
Bi-Se Bi2Se3 hp1 Bi2Te3,mS20,12 C12/m1 1.3938,0.38506,0.85086,90,91.829,90 - - 9.53 X 59652
Bi-Se Bi2Se3 hp2 Sb2S3,oP20,62 Pnma 1.1706,0.41417,1.16082,90,90,90 - - 7.73 X 59652
Bi-Se Bi2Se3 hp3 Zn3P 2,tP40,137 P42 /nmc 0.923,0.923,1.27,90,90,90 fluorite family - 8.04 A 8578
Bi-Se Bi2Se3 hp4 Os2Al3,tI10,139 I4/mmm 0.3395,0.3395,1.6882,90,90,90 b.c.c. family - 11.18 X 59652
Bi-Se Bi2Se3 hp5 *,cP80,* - 1.298,1.298,1.298,90,90,90 - - - N 8578
Bi-Se Bi2Se3 Bi2Te3,hR15,166 R-3m 0.40483,0.40483,2.7624,90,90,120 paraguanajuatite black 8.32 X 59652
Bi-Se Bi3Se2 *,hP*,* - 0.4256,0.4256,5.872,90,90,120 - - - N 19528
Bi-Se Bi3Se4 In3 Te4,hR21,166 R-3m 0.423,0.423,4.05,90,90,120 - - 7.48 X 641
Bi-Se Bi4Se3 Bi4Se3,hR21,166 R-3m 0.427,0.427,4.00,90,90,120 - - 8.46 X 4056
Bi-Se Bi6Se5 *,hP*,* - 0.4246,0.4246,6.32,90,90,120 - - - N 19528
Bi-Se Bi6Se7 *,hP*,* - 0.4189,0.4189,7.43,90,90,120 - - - N 19528
Bi-Se Bi8Se7 Bi8Se7,hP45,164 P-3m1 0.422,0.422,8.565,90,90,120 - - 8.39 X 6264
Bi-Se Bi8Se9 Bi8Se9,hR51,166 R-3m 0.416,0.416,9.71,90,90,120 - - 8.16 X 6264
Bi-Sm SmBi hp CuTi,tP2,123 P4/mmm 0.3775,0.3775,0.325,90,90,90 b.c.c. family - 12.89 X 54851
Bi-Sm SmBi rt NaCl,cF8,225 Fm-3m 0.6364,0.6364,0.6364,90,90,90 rocksalt family black gray 9.26 X 54851
Bi-Sm SmBi2 rt *,o**,* - 0.642,1.164,1.28,90,90,90 - - - N 18133
Bi-Sm Sm2Bi La2Sb,tI12,139 I4/mmm 0.452,0.452,1.76,90,90,90 - - 9.42 A 18133
Bi-Sm Sm4Bi3 Th3P 4,cI28,220 I-43d 0.94,0.94,0.94,90,90,90 - gray silver 9.82 A 18151
Bi-Sm Sm5Bi3 Mn5Si3,hP16,193 P63 /mcm 0.9268,0.9268,0.6456,90,90,120 - - 9.54 A 46240
Bi-Sn Sn0.00125 Bi0.99875 As,hR6,166 R-3m 0.4534,0.4534,1.1814,90,90,120 - - 9.89 X 1618
Bi-Sn Sn0.3 Bi0.7 hp-ht As,hR6,166 R-3m 0.4456,0.4456,1.175,90,90,120 - - 8.97 A 12764
Bi-Sn Sn0.5 Bi0.5 hp-ht Sn,tI4,141 I41/amd 0.6052,0.6052,0.3251,90,90,90 - - 9.14 X 12764
Bi-Sn Sn0.60 Bi0.40 hp1 (Sn0.6 Bi0.4),oS16,64 Cmce 1.07345,0.6327,0.63115,90,90,90 - - 9.60 X 42182
Bi-Sn Sn0.60 Bi0.40 hp2 W,cI2,229 Im-3m 0.36336,0.36336,0.36336,90,90,90 b.c.c. family - 10.72 X 42182
Bi-Sn Sn0.95 Bi0.05 rt Sn,tI4,141 I41/amd 0.5858,0.5858,0.3191,90,90,90 - - 7.47 X 636
Bi-Sr SrBi3 Cu3Au,cP4,221 Pm-3m 0.5042,0.5042,0.5042,90,90,90 close-packed structure - 9.26 X 1524
Bi-Sr Sr11Bi10 Ho11Ge10,tI84,139 I4/mmm 1.2765,1.2765,1.8407,90,90,90 - - 6.76 X 40462
Bi-Sr Sr16Bi11 Ca16Sb11,tP56,113 P-42 1m 1.3152,1.3152,1.1934,90,90,90 - - 5.95 A 33066
Bi-Sr Sr2Bi La2Sb,tI12,139 I4/mmm 0.501,0.501,1.768,90,90,90 - - 5.75 X 9486
Bi-Sr Sr2Bi3 Sr2Bi3,oP20,52 Pnna 1.5631,0.6793,0.6599,90,90,90 - - 7.60 X 29247
Bi-Sr Sr4Bi3 Th3P 4,cI28,220 I-43d 1.0101,1.0101,1.0101,90,90,90 - - 6.30 X 41566
Bi-Sr Sr5Bi3 (H) Yb5Sb3,oP32,62 Pnma 1.337,1.0233,0.889,90,90,90 - - 5.82 A 11624
Bi-Sr Sr5Bi3 rt Mn5Si3,hP16,193 P63 /mcm 0.963,0.963,0.763,90,90,120 - - 5.77 X 9486
Bi-Tb TbBi lt NiO,hR6,166 R-3m 0.44217,0.44217,1.08694,90,90,120 - - 9.96 X 12039
Bi-Tb TbBi rt NaCl,cF8,225 Fm-3m 0.62755,0.62755,0.62755,90,90,90 rocksalt family - 9.89 X 12039
Bi-Tb Tb4Bi3 Th3P 4,cI28,220 I-43d 0.93215,0.93215,0.93215,90,90,90 - - 10.35 A 9099
Bi-Tb Tb5Bi3 Tb+ Y5Bi3,oP32,62 Pnma 0.817,0.9487,1.1968,90,90,90 - - 10.18 X 38857
Bi-Tb Tb5Bi3 Tb- Mn5Si3,hP16,193 P63 /mcm 0.91006,0.91006,0.63651,90,90,120 - - 10.34 A 9099
Bi-Te BiTe m cub NaCl,cF8,225 Fm-3m 0.647,0.647,0.647,90,90,90 rocksalt family - 8.25 X 641
Bi-Te BiTe BiSe,hP12,164 P-3m1 0.4422,0.4422,2.405,90,90,120 tsumoite white silver8.23 X 11353
Bi-Te Bi0.1 Te0.9 Se,hP3,152 P3121 0.4453,0.4453,0.5905,90,90,120 - - 6.67 A 19005
Bi-Te Bi0.4 Te0.6 hp3 W,cI2,229 Im-3m 0.3571,0.3571,0.3571,90,90,90 b.c.c. family - 11.68 X 57227
Bi-Te Bi0.5 Te0.5 m rhom As,hR6,166 R-3m 0.443,0.443,1.175,90,90,120 - - 8.40 A 19005
Bi-Te Bi0.9985 Te0.0015 As,hR6,166 R-3m 0.4534,0.4534,1.1814,90,90,120 - - 9.89 X 1618
Bi-Te Bi2Te Sb2Te,hP9,164 P-3m1 0.44688,0.44688,1.79216,90,90,120 - - 8.77 X 58954
Bi-Te Bi2Te3 hp1 Bi2Te3,mS20,12 C12/m1 1.4645,0.4096,0.90195,90,90.384,90 - - 9.83 X 57227
Bi-Te Bi2Te3 hp2 Bi2Te3,mS20,15 C12/c1 1.0233,0.6955,0.77719,90,110.154,90 - - 10.24 X 57227
Bi-Te Bi2Te3 ht-hp Bi2Te3,hR15,160 R3m 0.4417,0.4417,2.984,90,90,120 - - 7.91 X 4270
Bi-Te Bi2Te3 Bi2Te3,hR15,166 R-3m 0.43896,0.43896,3.05019,90,90,120 tellurobismuthite - 7.84 X 59345
Bi-Te Bi3Te4 In3 Te4,hR21,166 R-3m 0.4389,0.4389,4.2,90,90,120 rucklidgeite - 8.09 A 24476
Bi-Te Bi4Te3 Bi4Se3,hR21,166 R-3m 0.4451,0.4451,4.1888,90,90,120 pilsenite - 8.45 X 12095
Bi-Te Bi4Te5 *,h**,* - 0.44106,0.44106,5.433,90,90,120 - - - N 4072
Bi-Te Bi6Te7 *,h**,* - 0.44214,0.44214,7.8195,90,90,120 - - - N 4072
Bi-Te Bi8Te9 Bi8Se9,hR51,166 R-3m 0.441,0.441,10.3,90,90,120 - - 8.10 X 27872
Bi-Th ThBi m CsCl,cP2,221 Pm-3m 0.3909,0.3909,0.3909,90,90,90 b.c.c. family - 12.26 X 15251
Bi-Th ThBi2 UAs2,tP6,129 P4/nmm 0.4492,0.4492,0.9298,90,90,90 - - 11.51 X 841
Bi-Th Th3Bi4 Th3P 4,cI28,220 I-43d 0.9559,0.9559,0.9559,90,90,90 - - 11.65 X 841
Bi-Th Th5Bi3 Mn5Si3,hP16,193 P63 /mcm 0.959,0.959,0.6632,90,90,120 - - 11.24 A 15251
Bi-Ti Ti0.9965 Bi0.0035 rt Mg,hP2,194 P63 /mmc 0.2933,0.2933,0.4669,90,90,120 close-packed structure - 4.63 X 1320
Bi-Ti Ti2Bi (O) Ti2Bi,tI12,139 I4/mmm 0.408,0.408,1.457,90,90,90 - - 8.35 X 993
Bi-Ti Ti8Bi9 V7.5 Sb9,tP34,129 P4/nmm 1.0277,1.0277,0.7375,90,90,90 - - 9.65 X 33528
Bi-Tl TlBi cub CsCl,cP2,221 Pm-3m 0.398,0.398,0.398,90,90,90 b.c.c. family - 10.89 X 12
Bi-Tl Tl0.44 Bi0.56 Ti,hP3,191 P6/mmm 0.5653,0.5653,0.3379,90,90,120 - - 11.02 X 345
Bi-Tl Tl0.75 Bi0.25 rt Mg,hP2,194 P63 /mmc 0.352,0.352,0.516,90,90,120 close-packed structure - 12.33 X 25837
Handbook of Inorganic Substances – Edition 2015 : Data 41

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Tl Tl0.8 Bi0.2 Cu,cF4,225 Fm-3m 0.4921,0.4921,0.4921,90,90,90 close-packed structure - 11.44 X 8025
Bi-Tm TmBi NaCl,cF8,225 Fm-3m 0.6188,0.6188,0.6188,90,90,90 rocksalt family - 10.59 X 42129
Bi-Tm Tm5 Bi3 Y5Bi3,oP32,62 Pnma 0.8061,0.9286,1.1724,90,90,90 - - 11.14 A 42129
Bi-U UBi rt NaCl,cF8,225 Fm-3m 0.63627,0.63627,0.63627,90,90,90 rocksalt family - 11.53 X 27908
Bi-U UBi2 UAs2,tP6,129 P4/nmm 0.4445,0.4445,0.8908,90,90,90 - - 12.38 X 3703
Bi-U UBix stab Cu,cF4,225 Fm-3m 0.489,0.489,0.489,90,90,90 close-packed structure - 13.52 X 7286
Bi-U U3Bi4 Th3P 4,cI28,220 I-43d 0.935,0.935,0.935,90,90,90 - - 12.60 X 408
Bi-Y YBi NaCl,cF8,225 Fm-3m 0.62597,0.62597,0.62597,90,90,90 rocksalt family - 8.07 X 4700
Bi-Y Y5Bi3 Y5Bi3,oP32,62 Pnma 0.8179,0.9401,1.1957,90,90,90 - - 7.74 X 9539
Bi-Yb YbBi2 ZrSi2,oS12,63 Cmcm 0.456,1.668,0.428,90,90,90 close-packed structure - 12.06 A 18097
Bi-Yb Yb16 Bi11 Ca16 Sb11,tP56,113 P-421m 1.23694,1.23694,1.1548,90,90,90 - - 9.53 A 33066
Bi-Yb Yb4Bi3 Th3P 4,cI28,220 I-43d 0.9573,0.9573,0.9573,90,90,90 - gray 9.99 A 22641
Bi-Yb Yb5Bi2 *,oP*,33 Pna21 1.236,0.828,0.966,90,90,90 - - - N 18097
Bi-Yb Yb5Bi3 hex Mn5 Si3,hP16,193 P63/mcm 0.91852,0.91852,0.70391,90,90,120 - - 9.64 A 46240
Bi-Yb Yb5Bi3 orth Yb5Sb3,oP32,62 Pnma 1.26375,0.97243,0.84117,90,90,90 - - 9.59 X 49771
Bi-Yb Yb5Bi4 ht *,tI*,139 I4/mmm 1.193,1.193,1.713,90,90,90 - - - N 18097
Bi-Zr ZrBi ZrSb,oS24,63 Cmcm 0.3858,1.077,1.4325,90,90,90 - - 10.05 X 44067
Bi-Zr ZrBi2 TiAs2,oP24,58 Pnnm 1.018,1.549,0.397,90,90,90 - - 10.81 X 4309
Bi-Zr Zr3Bi Ni3P,tI32,82 I-4 1.152,1.152,0.572,90,90,90 - - 8.45 A 4309
Bi-Zr Zr3Bi5 Ir3Ga5,tP32,118 P-4n2 0.6958,0.6958,1.73,90,90,90 chimney-ladder structure - 10.46 X 47486
Bi-Zr Zr5Bi3 Mn5 Si3,hP16,193 P63/mcm 0.87351,0.87351,0.59908,90,90,120 - - 9.09 X 39471
Bi-Zr Zr8Bi13 Zr8Bi13,tP84,116 P-4c2 0.6958,0.6958,4.498,90,90,90 - - 10.51 X 47486
Bk-Br BkBr3 ht1 BiI3,hR24,148 R-3 0.7263,0.7263,1.92308,90,90,120 - - 5.52 A 9124
Bk-Br BkBr3 ht2 AlCl3,mS16,12 C12/m1 0.683,1.253,0.723,90,110.6,90 - - 5.58 A 9124
Bk-Br BkBr3 rt PuBr3,oS16,63 Cmcm 0.403,1.271,0.912,90,90,90 - - 6.92 A 9124
Bk-Cl BkCl3 UCl3,hP8,176 P63/m 0.7382,0.7382,0.4127,90,90,120 - green lime 6.03 A 4144
Bk-F BkF4 ZrF4 ,mS60,15 C12/c1 1.247,1.046,0.813,90,126.1,90 - - 7.51 A 16438
Bk-H BkH2 CaF2 ,cF12,225 Fm-3m 0.5248,0.5248,0.5248,90,90,90 fluorite family - 11.44 X 18088
Bk-H BkH3 Na3As,hP8,194 P63/mmc 0.3729,0.3729,0.6665,90,90,120 - - 10.35 A 18088
Bk-Ir BkIr2 MgCu2,cF24,227 Fd-3m 0.75204,0.75204,0.75204,90,90,90 Friauf-Laves phase - 19.72 X 23689
Bk-N BkN NaCl,cF8,225 Fm-3m 0.4951,0.4951,0.4951,90,90,90 rocksalt family - 14.29 X 13380
Bk-O BkO NaCl,cF8,225 Fm-3m 0.5002,0.5002,0.5002,90,90,90 rocksalt family - 13.96 X 23688
Bk-O BkO2 CaF2 ,cF12,225 Fm-3m 0.5336,0.5336,0.5336,90,90,90 fluorite family tan 12.20 X 13375
Bk-O Bk2O3 ht1 Sm2 O3,mS30,12 C12/m1 1.4197,0.3606,0.8846,90,100.23,90 - - 12.12 A 7523
Bk-O Bk2O3 ht2 La2O3,hP5,164 P-3m1 0.3754,0.3754,0.5958,90,90,120 - - 12.38 A 7523
Bk-O Bk2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.089,1.089,1.089,90,90,90 - tan 11.15 A 23688
Bk-P BkP NaCl,cF8,225 Fm-3m 0.5669,0.5669,0.5669,90,90,90 rocksalt family - 10.13 X 13380
Bk-Pt BkPt5 CaCu5,hP6,191 P6/mmm 0.527,0.527,0.4423,90,90,120 - - 19.08 X 23689
Bk-Rh BkRh3 Cu3Au,cP4,221 Pm-3m 0.4013,0.4013,0.4013,90,90,90 close-packed structure - 14.28 X 23689
Bk-Sb BkSb NaCl,cF8,225 Fm-3m 0.6188,0.6188,0.6188,90,90,90 rocksalt family - 10.34 X 13380
Br-C CBr4 ht CBr4,cF516,225 Fm-3m 0.882,0.882,0.882,90,90,90 - - 3.21 X 17685
Br-C CBr4 rt CBr4,mS160,15 C12/c1 2.143,1.212,2.102,90,110.88,90 - - 3.45 X 10467
Br-C C6Br6 *,mP24,14 P121/c1 0.839,0.401,1.71385,90,116.266,90 - - - N 1198
Br-C [C60 ]Br24[Br2] rhom1 [C60 ]Br24[Br2],hR294,148 R-3 1.2874,1.2874,3.2659,90,90,120 fullerene family orange 2.97 X 26690
Br-C [C60 ]Br24[Br2]2 rt [C60 ]Br24[Br2]2,aP88,2 P-1 1.2471,1.27687,1.2867,60.395,62.754,84.716 fullerene family orange 3.15 X 30135
Br-C [C70 ]Br10 [C70 ]Br10,mP320,14 P121/c1 1.8579,1.2313,1.968,90,98.64,90 fullerene family orange 2.45 X 41122
Br-C [C70 ]Br10[Br2]3 [C70 ]Br10[Br2]3,aP172,2 P-1 1.14,1.3973,1.8165,111.78,93.19,96.42 fullerene family orange 2.65 X 41122
Br-C [C70 ]Br14 *,mP*,* - 1.8135,1.0731,3.07092,90,102.558,90 fullerene family orange - N 33824
Br-Ca CaBr2 ht TiO2 ,tP6,136 P42/mnm 0.68109,0.68109,0.44177,90,90,90 - - 3.24 X 43777
Br-Ca CaBr2 rt CaCl2,oP6,58 Pnnm 0.66531,0.68875,0.43773,90,90,90 - - 3.31 X 43777
Br-Cd CdBr2 12R PbI2 ,hR18,166 R-3m 0.3985,0.3985,3.7682,90,90,120 CdI2-PbI2 polytype - 5.23 X 13035
Br-Cd CdBr2 4H CdI2 ,hP6,186 P63mc 0.3985,0.3985,1.2561,90,90,120 CdI2-PbI2 polytype - 5.23 X 1792
Br-Cd CdBr2 6R CdCl2,hR9,166 R-3m 0.3985,0.3985,1.8841,90,90,120 - - 5.23 X 1792
Br-Ce CeBr3 UCl3,hP8,176 P63/m 0.7952,0.7952,0.4444,90,90,120 - - 5.18 A 287
Br-Ce Ce2Br5 Pr2I5 ,mP14,11 P121/m1 0.78889,0.41916,1.3362,90,88.738,90 - black 5.11 X 24618
Br-Cf CfBr3 rt AlCl3,mS16,12 C12/m1 0.7214,1.2423,0.6825,90,110.7,90 - green 5.70 X 9124
Br-Cl BrCl IBr,oS8,36 Cmc21 0.6449,0.4547,0.835,90,90,90 - yellow 3.13 X 59466
Br-Cm CmBr3 PuBr3,oS16,63 Cmcm 0.404,1.27,0.9135,90,90,90 - green 6.90 X 9124
Br-Co CoBr2 CdI2 ,hP3,164 P-3m1 0.3685,0.3685,0.612,90,90,120 CdI2-PbI2 polytype - 5.05 X 23
Br-Cr CrBr2 hp1 CrBr2,mS6,12 C12/m1 0.7114,0.3649,0.6217,90,93.88,90 - - 4.37 X 1610
Br-Cr CrBr3 rt BiI3,hR24,148 R-3 0.626,0.626,1.82,90,90,120 - black 4.71 X 46
Br-Cs CsBr lt NaCl,cF8,225 Fm-3m 0.7253,0.7253,0.7253,90,90,90 rocksalt family - 3.70 X 32731
Br-Cs CsBr rt CsCl,cP2,221 Pm-3m 0.4291,0.4291,0.4291,90,90,90 b.c.c. family - 4.47 X 31478
Br-Cs Cs[Br3] Cs[I3],oP16,62 Pnma 1.0037,0.6522,0.9539,90,90,90 - - 3.96 X 4359
Br-Cu CuBr hp1 PbO,tP4,129 P4/nmm 0.39411,0.39411,0.50054,90,90,90 - - 6.13 X 29368
Br-Cu CuBr hp2 CuCl,cP16,205 Pa-3 0.66674,0.66674,0.66674,90,90,90 - - 6.43 X 29368
Br-Cu CuBr hp3 NaCl,cF8,225 Fm-3m 0.51701,0.51701,0.51701,90,90,90 rocksalt family colorless 6.89 X 29368
Br-Cu CuBr ht1 ZnO,hP4,186 P63mc 0.4096,0.4096,0.6713,90,90,120 adamantane structure - 4.88 X 10616
Br-Cu CuBr ht2 VH0.5 ,cI14,229 Im-3m 0.4601,0.4601,0.4601,90,90,90 - - 4.89 X 10616
Br-Cu CuBr rt ZnS,cF8,216 F-43m 0.5498,0.5498,0.5498,90,90,90 adamantane structure - 5.73 X 29368
Br-Cu CuBr tf *,tP2,136 P42/mnm 0.302,0.302,0.424,90,90,90 - - - N 3241
Br-Cu CuBr2 CuBr2,mS6,12 C12/m1 0.72096,0.34742,0.70475,90,119.61,90 - brown dark 4.83 X 38292
Br-D DBr lt1 HCl,cF52,225 Fm-3m 0.57958,0.57958,0.57958,90,90,90 close-packed structure - 2.79 X 27851
Br-D DBr lt2 HBr,oS12,64 Cmce 0.60924,0.55441,0.56322,90,90,90 - - 2.86 X 27851
Br-D DBr lt3 HCl,oS8,36 Cmc21 0.61178,0.54289,0.5628,90,90,90 - - 2.91 X 27851
Br-Dy DyBr2 SrI2,oP24,61 Pbca 0.71791,1.39864,0.74768,90,90,90 - - 5.70 A 28128
Br-Dy DyBr3 hp PuBr3,oS16,63 Cmcm 0.3923,1.277,0.9118,90,90,90 - - 5.85 A 12808
Br-Dy DyBr3 BiI3,hR24,148 R-3 0.7107,0.7107,1.9161,90,90,120 - - 4.78 A 4121
42 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Er ErBr ZrCl,hR12,166 R-3m 0.377,0.377,2.8826,90,90,120 - - 6.94 A 13789


Br-Er ErBr3 BiI3,hR24,148 R-3 0.7045,0.7045,1.9148,90,90,120 - - 4.93 A 4121
Br-Eu EuBr2 SrBr2,tP30,85 P4/n 1.1567,1.1567,0.7094,90,90,90 - gray 5.45 X 5772
Br-Eu EuBr2.99 PuBr3,oS16,63 Cmcm 0.4045,1.286,0.917,90,90,90 - - 5.44 A 18044
Br-F BrF3 rt BrF3,oS16,36 Cmc21 0.5315,0.7305,0.6624,90,90,90 - - 3.54 X 25367
Br-F BrF5 BrF5,oS24,36 Cmc21 0.6422,0.7245,0.7846,90,90,90 - - 3.18 X 884
Br-Fe FeBr2 CdI2,hP3,164 P-3m1 0.3776,0.3776,0.6227,90,90,120 CdI2 -PbI2 polytype yellow 4.66 X 39653
Br-Fe FeBr3 BiI3,hR24,148 R-3 0.6397,0.6397,1.8375,90,90,120 - black 4.52 X 38169
Br-Ga GaBr2 ht GaI2,hR108,161 R3c 2.1634,2.1634,0.8692,90,90,120 - - 3.89 X 20922
Br-Ga GaBr2 rt GaCl2,oP24,52 Pnna 0.7528,0.9972,1.001,90,90,90 - - 4.06 X 20923
Br-Ga GaBr3 InI3,mP16,14 P121/c1 0.8874,0.5637,1.1006,90,107.81,90 - - 3.92 X 44054
Br-Ga Ga2Br3 Ga2Br3,oP84,62 Pnma 1.2537,1.5474,1.2534,90,90,90 - colorless 4.14 X 19235
Br-Gd GdBr rt ZrCl,hR12,166 R-3m 0.38692,0.38692,2.9164,90,90,120 - - 6.25 A 13789
Br-Gd GdBr3 hp PuBr3,oS16,63 Cmcm 0.3987,1.2746,0.9109,90,90,90 - - 5.70 A 16678
Br-Gd GdBr3 AlCl3,mS16,12 C12/m1 0.7224,1.2512,0.684,90,110.6,90 - - 4.56 X 7127
Br-Gd Gd2Br3 Gd2Cl3,mS20,12 C12/m1 1.6418,0.3983,1.0753,90,119.27,90 - bronze 6.00 X 12819
Br-Gd Gd5Br8 Tb5Br8,mS26,12 C12/m1 1.99097,0.3884,1.3553,90,129.756,90 - - 5.88 A 13696
Br-Ge GeBr2 GeBr2,mP24,14 P121/c1 1.168,0.912,0.702,90,101.9,90 - - 4.22 X 11079
Br-Ge GeBr4 lt SnBr4,mP20,14 P121/c1 1.0183,0.6779,1.0292,90,102.53,90 - colorless 3.76 X 45828
Br-Ge GeBr4 rt SnI4,cP40,205 Pa-3 1.1172,1.1172,1.1172,90,90,90 - colorless 3.74 X 45827
Br-H HBr lt1 Cu,cF4,225 Fm-3m 0.5809,0.5809,0.5809,90,90,90 close-packed structure - 2.74 X 21998
Br-H HBr lt2 HBr,cP4,205 Pa-3 0.57907,0.57907,0.57907,90,90,90 - colorless 2.77 X 21998
Br-H HBr lt3 HBr,oS12,64 Cmce 0.6086,0.5555,0.5648,90,90,90 - - 2.81 A 5610
Br-H HBr lt4 HCl,oS8,36 Cmc21 0.6111,0.5462,0.5643,90,90,90 - - 2.85 A 5610
Br-Hf HfBr ZrBr,hR12,166 R-3m 0.34732,0.34732,2.8226,90,90,120 - - 8.73 A 12681
Br-Hf HfBr2 *,tP48,* - 0.7556,0.7556,1.82,90,90,90 - black 8.65 N 12667
Br-Hf HfBr4 SnI4,cP40,205 Pa-3 1.091,1.091,1.091,90,90,90 - - 5.10 A 1993
Br-Hg HgBr rt HgCl,tI8,139 I4/mmm 0.465,0.465,1.11,90,90,90 kuzminite - 7.76 X 11
Br-Hg HgBr2 hp3 HgBr2,hP9,143 P3 0.67569,0.67569,0.56589,90,90,120 - - 8.02 X 43820
Br-Hg HgBr2 hp4 *,h**,* - 0.6787,0.6787,1.113,90,90,120 - - - N 43820
Br-Hg HgBr2 HgBr2,oS12,36 Cmc21 0.4628,0.6802,1.2476,90,90,90 - colorless 6.10 X 23994
Br-Ho HoBr rt ZrCl,hR12,166 R-3m 0.3774,0.3774,2.8834,90,90,120 - - 6.86 A 13789
Br-Ho HoBr3 hp1 PuBr3,oS16,63 Cmcm 0.3898,1.2773,0.9125,90,90,90 - - 5.92 A 12808
Br-Ho HoBr3 BiI3,hR24,148 R-3 0.7072,0.7072,1.915,90,90,120 - - 4.86 A 4121
Br-I IBr hp IBr,mS4,12 C12/m1 0.391,0.486,0.391,90,92.3,90 - - 9.25 X 18018
Br-I IBr IBr,oS8,36 Cmc21 0.6993,0.4903,0.8931,90,90,90 - - 4.49 X 3840
Br-I [I2]0.35 [Br2 ]0.65 [I2],oS8,64 Cmce 0.6876,0.4619,0.9016,90,90,90 - - 4.47 A 1040
Br-I [I2]0.75 [Br2 ]0.25 lt [I2],oS8,64 Cmce 0.7073,0.4697,0.9457,90,90,90 - - 4.87 A 1040
Br-In InBr TlI,oS8,63 Cmcm 0.4466,1.2368,0.4739,90,90,90 CrB(TlI)-FeB orange red 4.94 X 20829
Br-In InBr2 GaCl2,oP24,52 Pnna 0.7986,1.0385,1.0425,90,90,90 - colorless 4.22 X 20829
Br-In InBr3 AlCl3,mS16,12 C12/m1 0.6696,1.1641,0.6633,90,108.99,90 - colorless 4.82 X 21952
Br-In In2Br3 In2Br3,oP84,19 P212121 1.2855,1.2938,1.6399,90,90,90 - yellow 4.57 X 23032
Br-In In4Br7 lt In4Br7,mS88,15 C12/c1 1.3066,0.752,3.1105,90,98.2,90 - - 4.47 X 41964
Br-In In4Br7 rt In4Br7,hR66,166 R-3m 0.7583,0.7583,4.6607,90,90,120 - colorless 4.37 X 41964
Br-In In5Br7 mon In5Br7,mS192,15 C12/c1 1.8673,1.867,1.918,90,103.96,90 - yellow 4.64 X 36658
Br-In In5Br7 tet In5Br7,tP192,92 P41212 1.3189,1.3189,3.7238,90,90,90 - yellow 4.65 X 36658
Br-In In7Br9 In7Cl9,cP64,205 Pa-3 1.2681,1.2681,1.2681,90,90,90 - orange 4.96 X 31199
Br-Ir IrBr3 AlCl3,mS16,12 C12/m1 0.63,1.098,0.634,90,108.7,90 - green 6.91 X 4097
Br-K KBr hp CsCl,cP2,221 Pm-3m 0.374,0.374,0.374,90,90,90 b.c.c. family - 3.78 X 2267
Br-K KBr rt NaCl,cF8,225 Fm-3m 0.6578,0.6578,0.6578,90,90,90 rocksalt family colorless 2.78 X 11138
Br-La LaBr rt ZrCl,hR12,166 R-3m 0.41333,0.41333,2.9715,90,90,120 - - 4.96 X 13789
Br-La LaBr2 NbS2,hP6,194 P63 /mmc 0.40988,0.40988,1.39,90,90,120 - black 4.91 X 23013
Br-La LaBr3 UCl3,hP8,176 P63 /m 0.79648,0.79648,0.45119,90,90,120 - colorless 5.07 X 23013
Br-La La2Br5 Pr2I5,mP14,11 P121/m1 0.78909,0.42489,1.3423,90,88.4,90 - black 5.00 X 23013
Br-Li LiBr hex ZnO,hP4,186 P63 mc 0.41509,0.41509,0.66502,90,90,120 adamantane structure - 2.91 X 49786
Br-Li LiBr rt NaCl,cF8,225 Fm-3m 0.549,0.549,0.549,90,90,90 rocksalt family - 3.49 X 19305
Br-Lu LuBr3 BiI3,hR24,148 R-3 0.695,0.695,1.9109,90,90,120 - - 5.17 A 4121
Br-Mg MgBr2 ht CdCl2,hR9,166 R-3m 0.39152,0.39152,1.942,90,90,120 - - 3.56 A 25862
Br-Mg MgBr2 rt CdI2,hP3,164 P-3m1 0.3815,0.3815,0.6256,90,90,120 CdI2 -PbI2 polytype - 3.88 X 23
Br-Mn MnBr2 ht CdCl2,hR9,166 R-3m 0.39224,0.39224,1.9167,90,90,120 - - 4.19 X 25862
Br-Mn MnBr2 rt CdI2,hP3,164 P-3m1 0.3868,0.3868,0.6272,90,90,120 CdI2 -PbI2 polytype - 4.39 X 1003
Br-Mo MoBr2 MoCl2,oS72,64 Cmce 1.4767,1.1771,1.1787,90,90,90 Chevrel phase red 4.97 X 35317
Br-Mo MoBr2.2 m *,tP*,* - 0.56,0.56,1.545,90,90,90 - brown - N 22822
Br-Mo MoBr3 hex TiCl3,hP8,193 P63 /mcm 0.6595,0.6595,0.606,90,90,120 - black 4.88 X 2327
Br-Mo MoBr3 rt RuBr3,oP16,59 Pmmn 0.6077,1.1442,0.6605,90,90,90 - - 4.85 X 42817
Br-Mo Mo2Br5 rt *,hP7,* - 0.66,0.66,0.606,90,90,120 - - 4.30 N 21752
Br-N Br[N3] Br[N3],tI64,110 I41cd 1.31873,1.31873,0.7266,90,90,90 - yellow 2.56 X 57544
Br-Na NaBr NaCl,cF8,225 Fm-3m 0.59735,0.59735,0.59735,90,90,90 rocksalt family colorless 3.21 X 19459
Br-Nb NbBr4 *,oS40,* - 1.285,1.222,0.7179,90,90,90 - blue - N 2341
Br-Nb NbBr5 ht NbBr5,oP48,62 Pnma 1.2888,1.8690,0.6149,90,90,90 - black 4.42 X 24330
Br-Nb NbBr5 mon NbCl5,mS72,12 C12/m1 1.92,1.855,0.61,90,90.1,90 - - 4.52 A 3442
Br-Nb NbBr5 rt NbBr5,oP24,55 Pbam 0.615,1.288,0.933,90,90,90 - black 4.43 X 16768
Br-Nb NbBr5 tricl UCl5,aP12,2 P-1 0.6461,0.7031,0.9584,108.84,90.89,116.16 - black 4.50 X 49707
Br-Nb Nb3Br8 ht Nb3Br8,hR66,166 R-3m 0.70787,0.70787,3.8957,90,90,120 - black 5.41 X 55607
Br-Nb Nb3Br8 rt Nb3Cl8,hP22,164 P-3m1 0.7227,0.7227,1.293,90,90,120 - gray dark 5.21 A 2774
Br-Nd NdBr2 PbCl2,oP12,62 Pnma 0.80238,0.47849,0.95833,90,90,90 - - 5.49 A 28129
Br-Nd NdBr3 PuBr3,oS16,63 Cmcm 0.4108,1.2637,0.9141,90,90,90 - - 5.37 A 22584
Br-Ni NiBr2 lt2 CdCl2,hR9,166 R-3m 0.365,0.365,1.83,90,90,120 - ochre 5.16 X 18256
Handbook of Inorganic Substances – Edition 2015 : Data 43

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Np NpBr3 hex UCl3,hP8,176 P63/m 0.7917,0.7917,0.4382,90,90,120 - - 6.66 X 322


Br-Np NpBr3 orth PuBr3,oS16,63 Cmcm 0.412,1.268,0.917,90,90,90 - - 6.61 A 287
Br-O Br2O Br2O,oP12,33 Pna21 1.0622,0.3904,0.6822,90,90,90 - brown 4.13 X 33802
Br-O Br2O3 lt *,mP40,14 P121/c1 1.1866,0.7629,0.8693,90,106.4,90 - orange - N 27100
Br-Os OsBr4 TcCl4,oP40,61 Pbca 0.63399,1.21092,1.4615,90,90,90 - black 6.04 X 18648
Br-P PBr3 lt SbCl3,oP16,62 Pnma 0.8014,1.0026,0.6444,90,90,90 - - 3.47 X 12205
Br-P PBr5 PBr5 ,oP24,57 Pbcm 0.5663,1.7031,0.8247,90,90,90 - - 3.60 X 5014
Br-P PBr7 PBr7 ,oP32,62 Pnma 0.935,0.794,1.469,90,90,90 - red 3.60 X 3371
Br-Pa PaBr4 ThCl4,tI20,141 I41/amd 0.8824,0.8824,0.7957,90,90,90 - - 5.90 X 6060
Br-Pa PaBr5 ht UCl5,mP24,14 P121/c1 0.8385,1.1205,1.21462,90,132.547,90 - - 4.98 X 4386
Br-Pa PaBr5 rt *,mP48,14 P121/c1 1.269,1.282,0.992,90,108.,90 - - - N 4386
Br-Pb PbBr2 PbCl2,oP12,62 Pnma 0.8059,0.47319,0.954,90,90,90 - - 6.70 X 19634
Br-Pd PdBr2 PdBr2,mS12,15 C12/c1 1.289,0.396,0.659,90,102.2,90 - black 5.38 X 3287
Br-Po Po0.25 Br NaCl,cF8,225 Fm-3m 0.561,0.561,0.561,90,90,90 rocksalt family red 4.97 X 689
Br-Pr PrBr rt ZrCl,hR12,166 R-3m 0.40302,0.40302,2.9453,90,90,120 - - 5.31 A 13789
Br-Pr PrBr3 ht PuBr3,oS16,63 Cmcm 0.397,1.258,0.957,90,90,90 - - 5.29 A 22366
Br-Pr PrBr3 rt UCl3,hP8,176 P63/m 0.79248,0.79248,0.43886,90,90,120 - green 5.30 X 53514
Br-Pr Pr2Br5 Pr2I5 ,mP14,11 P121/m1 0.7787,0.4169,1.3338,90,88.96,90 - bronze 5.23 X 25111
Br-Pt PtBr2 PtCl2,hR54,166 R-3m 1.385,1.385,0.923,90,90,120 - - 6.92 A 2833
Br-Pt PtBr3 PtBr3,hR144,148 R-3 2.2318,2.2318,0.9034,90,90,120 - green dark 6.67 X 43920
Br-Pu PuBr3 PuBr3,oS16,63 Cmcm 0.410,1.265,0.915,90,90,90 - - 6.77 X 287
Br-Rb RbBr hp CsCl,cP2,221 Pm-3m 0.409,0.409,0.409,90,90,90 b.c.c. family - 4.01 X 2267
Br-Rb RbBr NaCl,cF8,225 Fm-3m 0.6895,0.6895,0.6895,90,90,90 rocksalt family - 3.35 X 5792
Br-Re ReBr3 mon *,mP24,* - 0.81,1.063,0.865,90,111.,90 - black 6.10 N 2326
Br-Re ReBr3 rt ReCl3,hR72,166 R-3m 1.06511,1.06511,2.1302,90,90,120 - - 6.08 A 25558
Br-Rh RhBr3 AlCl3,mS16,12 C12/m1 0.627,1.085,0.635,90,109.,90 - brown red 5.57 X 4083
Br-Ru RuBr3 ht TiCl3,hP8,193 P63/mcm 0.6488,0.6488,0.5859,90,90,120 - - 5.30 X 42817
Br-Ru RuBr3 rt RuBr3,oP16,59 Pmmn 0.5859,1.1235,0.6488,90,90,90 - - 5.30 X 42817
Br-S SBr lt SBr,oS16,41 Aea2 1.349,0.6788,0.5245,90,90,90 - red ruby 3.10 X 16749
Br-Sb SbBr3 orth1 AsBr3,oP16,19 P212121 0.442,1.012,1.23,90,90,90 - - 4.36 X 2254
Br-Sb SbBr3 orth2 SbCl3,oP16,62 Pnma 0.825,0.996,0.668,90,90,90 - - 4.37 X 1687
Br-Sc ScBr3 rt BiI3,hR24,148 R-3 0.6656,0.6656,1.8803,90,90,120 - colorless 3.93 A 2352
Br-Se SeBr lt1 SBr,oS16,41 Aea2 1.4069,0.6744,0.5309,90,90,90 - black 4.19 X 16749
Br-Se SeBr lt2 SeBr,mP16,14 P121/c1 0.7345,1.4282,0.4974,90,97.11,90 - black 4.08 X 16749
Br-Se SeBr4 m TeCl4,mS80,15 C12/c1 1.702,1.039,1.549,90,117.,90 - red 4.34 A 12802
Br-Se SeBr4 rt SeBr4,hP80,159 P31c 1.02,1.02,3.0351,90,90,120 - black 3.87 X 12802
Br-Si SiBr2 SiI2,mP60,14 P121/c1 1.0279,1.4699,1.47972,90,119.78,90 - - 3.22 X 17827
Br-Si SiBr4 lt1 SnI4 ,cP40,205 Pa-3 1.1152,1.1152,1.1152,90,90,90 - colorless 3.33 X 57475
Br-Si SiBr4 lt2 SnBr4,mP20,14 P121/c1 1.0285,0.6763,1.0377,90,103.15,90 - colorless 3.29 X 57483
Br-Sm SmBr2 orth PbCl2,oP12,62 Pnma 0.7977,0.4754,0.9506,90,90,90 - - 5.72 A 7753
Br-Sm SmBr2 tet SrBr2,tP30,85 P4/n 1.1593,1.1593,0.71,90,90,90 - - 5.40 A 7753
Br-Sm SmBr3 PuBr3,oS16,63 Cmcm 0.404,1.265,0.908,90,90,90 - - 5.58 A 287
Br-Sm Sm11 Br24 Sm11 Br24,mP140,14 P121/c1 0.7130,8.162,1.0442,90,132.88,90 - - 5.33 X 11499
Br-Sm Sm5 Br11 Dy5Cl11,mP64,11 P121/m1 0.7121,3.721,0.7652,90,90.26,90 - - 5.34 X 11499
Br-Sm Sm6 Br13 Sm6 Br13,mS76,15 C12/c1 4.492,0.7139,0.7649,90,98.50,90 - - 5.31 X 11499
Br-Sn SnBr2 SnBr2,oP12,62 Pnma 0.83936,0.42369,1.05251,90,90,90 - colorless 4.94 X 37556
Br-Sn SnBr4 hp SnBr4,mP20,14 P121/c1 1.0371,0.7006,1.047,90,102.56,90 - colorless 3.92 X 39577
Br-Sr SrBr2 ht (Th0.025Pb0.975)F2.05 ,cF60,225 Fm-3m 0.75408,0.75408,0.75408,90,90,90 fluorite family - 3.83 X 56908
Br-Sr SrBr2 rt SrBr2,tP30,85 P4/n 1.16042,1.16042,0.71306,90,90,90 - - 4.28 X 56908
Br-Ta TaBr4 *,oS40,* - 0.7143,1.238,1.288,90,90,90 - - - N 2341
Br-Ta TaBr5 NbCl5,mS72,12 C12/m1 1.9433,1.8775,0.62034,90,90.716,90 - orange 5.11 X 53722
Br-Ta Ta2Br5 Ta2Cl5,cI336,230 Ia-3d 2.1309,2.1309,2.1309,90,90,90 - black 6.27 X 36723
Br-Ta Ta3Br7 Nb3Cl7,oS80,64 Cmce 1.4063,1.3177,1.157,90,90,90 Chevrel phase black 6.83 X 31161
Br-Ta Ta6.86 Br20.16 Ta6.86 Br20.16 ,hR168,167 R-3c 1.2986,1.2986,3.3285,90,90,120 - black 5.85 X 54145
Br-Tb TbBr rt ZrCl,hR12,166 R-3m 0.3842,0.3842,2.9028,90,90,120 - - 6.41 X 13789
Br-Tb TbBr3 hp PuBr3,oS16,63 Cmcm 0.3954,1.2794,0.9081,90,90,90 - - 5.76 A 12808
Br-Tb TbBr3 mon AlCl3,mS16,12 C12/m1 0.7167,1.241,0.6829,90,110.47,90 - - 4.65 A 21462
Br-Tb TbBr3 rhom BiI3,hR24,148 R-3 0.7159,0.7159,1.9163,90,90,120 - - 4.67 A 4121
Br-Tb Tb5Br8 Tb5Br8,mS26,12 C12/m1 1.96826,0.3859,1.3367,90,129.784,90 - - 6.10 X 13696
Br-Tb Tb6Br7 Er6I7 ,mS26,12 C12/m1 2.0571,0.3793,1.18,90,124.59,90 - gray 6.63 X 13890
Br-Tc TcBr3 RuBr3,oP16,59 Pmmn 0.59755,1.10618,0.63873,90,90,90 - black 5.31 X 52410
Br-Tc TcBr4 TcCl4,oP40,61 Pbca 0.63237,1.21777,1.47397,90,90,90 - black 4.89 X 52410
Br-Te TeBr4 TeCl4,mS80,15 C12/c1 1.79,1.09,1.59,90,116.5,90 - - 4.28 A 2168
Br-Te Te2Br Te2Br,oP24,62 Pnma 1.4921,0.4005,1.2843,90,90,90 - - 5.80 X 10233
Br-Th ThBr4 ht ThCl4,tI20,141 I41/amd 0.8921,0.8921,0.7912,90,90,90 - - 5.82 X 27120
Br-Th ThBr4 rt ThCl4,tI20,88 I41/a 0.6737,0.6737,1.3601,90,90,90 - - 5.94 X 8287
Br-Ti TiBr2 CdI2 ,hP3,164 P-3m1 0.3629,0.3629,0.6492,90,90,120 CdI2-PbI2 polytype black violet4.66 X 1554
Br-Ti TiBr3 ht BiI3,hR24,148 R-3 0.6478,0.6478,1.8632,90,90,120 - black blue 4.23 X 24029
Br-Ti TiBr3 lt TiBr3,aP8,2 P-1 0.6424,0.6438,0.7236,63.73,63.81,60.12 - - 4.28 X 29428
Br-Ti TiBr3 rt hex TiCl3,hP8,193 P63/mcm 0.6595,0.6595,0.6095,90,90,120 - black green 4.16 A 5332
Br-Ti TiBr4 lt SnBr4,mP20,14 P121/c1 1.017,0.709,1.041,90,101.96,90 - brown red 3.32 A 3289
Br-Ti TiBr4 rt SnI4 ,cP40,205 Pa-3 1.1258,1.1258,1.1258,90,90,90 - amber 3.42 X 24029
Br-Ti Ti7Br16 Ti7Cl16,oP46,58 Pnnm 1.0577,1.5228,0.7276,90,90,90 - black 4.57 X 14683
Br-Tl TlBr rt m NaCl,cF8,225 Fm-3m 0.6594,0.6594,0.6594,90,90,90 rocksalt family - 6.59 X 3225
Br-Tl TlBr tf2 TlI,oS8,63 Cmcm 0.496,1.25,0.439,90,90,90 CrB(TlI)-FeB - 6.94 A 3225
Br-Tl TlBr CsCl,cP2,221 Pm-3m 0.397,0.397,0.397,90,90,90 b.c.c. family - 7.54 X 343
Br-Tl TlBr2 GaCl2,oP24,52 Pnna 0.802,1.035,1.045,90,90,90 - - 5.58 X 1929
Br-Tl Tl2Br3 mon1 Tl2Br3,mS320,15 C12/c1 2.6763,1.5311,2.7375,90,108.63,90 - red dark 6.48 X 40933
44 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Tl Tl2Br3 mon2 *,mP*,11 P121/m1 1.3124,2.555,1.313,90,119.91,90 - red - N 40933


Br-Tm TmBr2 SrI2,oP24,61 Pbca 0.71023,1.38139,0.73809,90,90,90 - - 6.03 A 26873
Br-Tm TmBr3 BiI3,hR24,148 R-3 0.7002,0.7002,1.9111,90,90,120 - - 5.02 A 4121
Br-U UBr3 rt UCl3,hP8,176 P63 /m 0.7935,0.7935,0.444,90,90,120 - - 6.55 X 19126
Br-U UBr4 UBr4,mS20,12 C12/m1 1.104,0.876,0.704,90,94.05,90 - brown 5.45 X 7976
Br-U UBr5 UCl5,aP12,2 P-1 0.6686,0.73555,1.0127,108.399,90.75,116.131 - - 5.07 X 11646
Br-V VBr2 CdI2,hP3,164 P-3m1 0.3751,0.3751,0.6206,90,90,120 CdI2 -PbI2 polytype - 4.63 X 16336
Br-V VBr3 BiI3,hR24,148 R-3 0.64,0.64,1.853,90,90,120 - - 4.41 A 2201
Br-W WBr2 MoCl2,oS72,64 Cmce 1.479,1.1799,1.1813,90,90,90 Chevrel phase yellow 6.64 X 33862
Br-W WBr3 WCl3,hR72,148 R-3 1.572,1.572,0.882,90,90,120 - black 6.71 A 5326
Br-W WBr4 mon NbCl4,mS20,12 C12/m1 1.24341,0.6839,0.8519,90,131.048,90 - - 6.12 X 59320
Br-W WBr4 orth *,o**,* - 0.725,0.849,0.929,90,90,90 - - - N 2189
Br-W WBr5 mon NbCl5,mS72,12 C12/m1 1.9109,1.8594,0.6088,90,90.43,90 - brown dark 5.37 X 35318
Br-W WBr5 tricl UCl5,aP12,2 P-1 0.6446,0.6978,0.954,108.67,90.69,116.29 - - 5.41 X 59320
Br-W WBr6 WCl6,hR21,148 R-3 0.6394,0.6394,1.753,90,90,120 - - 5.32 X 19829
Br-W W2Br5 W2Br5,mP56,14 P121/c1 0.9197,1.0852,1.8012,90,103.81,90 Chevrel phase black 5.84 X 59516
Br-W W3Br7 W3Br7,cP80,201 Pn-3 1.3458,1.3458,1.3458,90,90,90 - black 6.05 X 29505
Br-W W3Br8 W3Br8,oS88,64 Cmce 1.2071,1.4606,1.4262,90,90,90 Chevrel phase black 6.29 X 4287
Br-Y YBr ZrCl,hR12,166 R-3m 0.3806,0.3806,2.9158,90,90,120 - - 4.60 A 13231
Br-Y YBr3 BiI3,hR24,148 R-3 0.7072,0.7072,1.915,90,90,120 - - 3.95 A 4121
Br-Y Y2Br3 Gd2Cl3,mS20,12 C12/m1 1.6463,0.3898,1.0695,90,120.08,90 - - 4.67 A 13231
Br-Yb YbBr2 ht orth1 CaCl2,oP6,58 Pnnm 0.663,0.693,0.437,90,90,90 - - 5.51 X 6337
Br-Yb YbBr2 ht orth2 Fe2N0.94 ,oP12,60 Pbcn 0.66578,0.81383,0.73178,90,90,90 - - 5.58 A 26873
Br-Yb YbBr2 rt SrI2,oP24,61 Pbca 0.7086,1.37875,0.73552,90,90,90 - - 6.15 A 26873
Br-Yb YbBr3 BiI3,hR24,148 R-3 0.6973,0.6973,1.9138,90,90,120 - - 5.10 A 21462
Br-Zn ZnBr2 hp tet ZnI2,tI96,142 I41/acd 1.1389,1.1389,2.1773,90,90,90 - - 4.24 X 17649
Br-Zn ZnBr2 ht CdCl2,hR9,166 R-3m 0.39192,0.39192,1.87276,90,90,120 - - 4.50 A 222
Br-Zr ZrBr ZrBr,hR12,166 R-3m 0.35031,0.35031,2.8071,90,90,120 - black 5.72 X 10634
Br-Zr ZrBr2 hex *,hP6,194 P63 /mmc 0.35257,0.35257,1.3726,90,90,120 - - - N 12348
Br-Zr ZrBr2 rhom ZrCl2,hR54,148 R-3 1.3577,1.3577,0.9287,90,90,120 - - 5.06 X 14150
Br-Zr ZrBr3 TiCl3,hP8,193 P63 /mcm 0.6728,0.6728,0.6299,90,90,120 - green 4.45 X 15141
Br-Zr ZrBr4 SnI4,cP40,205 Pa-3 1.095,1.095,1.095,90,90,90 - - 4.16 A 1738
C-Ca CaC2 ht CaC2,cF36,225 Fm-3m 0.5886,0.5886,0.5886,90,90,90 - - 2.09 X 6039
C-Ca CaC2 m1 ThC2,mS12,15 C12/c1 0.66435,0.41994,0.73307,90,107.257,90 - colorless 2.18 X 38523
C-Ca CaC2 m2 CaC2,mS12,12 C12/m1 0.72286,0.38524,0.73764,90,107.338,90 - gray 2.17 X 38523
C-Ca CaC2 rt CaC2,tI6,139 I4/mmm 0.38863,0.38863,0.63862,90,90,90 - gray 2.21 X 36589
C-Ca CaC6 rhom CaC6,hR21,166 R-3m 0.4333,0.4333,1.3572,90,90,120 - - 2.53 X 45198
C-Ca Ca3.01 [C60 ] Ca3.01 [C60 ],cP152,205 Pa-3 2.7907,2.7907,2.7907,90,90,90 fullerene family - 2.06 X 41365
C-Ca Ca5[C60] *,cP*,* - 1.401,1.401,1.401,90,90,90 fullerene family - - N 26536
C-Ce CeC NaCl,cF8,225 Fm-3m 0.5135,0.5135,0.5135,90,90,90 rocksalt family - 7.46 X 2330
C-Ce CeC2 ht CaC2,cF36,225 Fm-3m 0.5938,0.5938,0.5938,90,90,90 - - 5.21 A 21357
C-Ce CeC2 rt CaC2,tI6,139 I4/mmm 0.3881,0.3881,0.6487,90,90,90 - brass 5.58 X 19255
C-Ce Ce[C82] lt Ce[C82],cP1976,205 Pa-3 1.574,1.574,1.574,90,90,90 fullerene family - 1.92 X 43324
C-Ce Ce2C3 Pu2C3,cI40,220 I-43d 0.84476,0.84476,0.84476,90,90,90 - - 6.97 X 1452
C-Cl C10Cl8 C10Cl8,mP72,14 P121/c1 0.976,0.730,1.948,90,111.55,90 - - 2.08 X 1977
C-Cl C13Cl12 C13Cl12,aP50,2 P-1 0.8415,0.8598,1.541,90.38,97.13,118.58 - colorless 1.99 X 11201
C-Cl C14Cl10 C14Cl10,oP96,60 Pbcn 0.5065,1.7946,1.8554,90,90,90 - yellow 2.06 X 9584
C-Cl C16Cl10 C16Cl10,mP104,14 P121/c1 1.0803,0.7494,2.35514,90,114.468,90 - yellow 2.09 X 9665
C-Cl C19Cl6 C19Cl6,mS400,15 C12/c1 1.53037,2.73861,1.39225,90,108.604,90 - orange 2.12 X 51675
C-Cl C2Cl6 ht C2Cl6,cI28,229 Im-3m 0.749,0.749,0.749,90,90,90 - - 1.87 X 13911
C-Cl C2Cl6 rt C2Cl6,oP32,62 Pnma 1.1568,1.0198,0.6409,90,90,90 - - 2.08 X 12184
C-Cl C28Cl18[CCl4]0.5 C28Cl18[CCl4]0.5 ,mS204,15 C12/c1 2.5794,0.8676,1.7258,90,94.47,90 - red deep 1.81 X 12170
C-Cl C3Cl6 C3Cl6,mP36,14 P121/c1 1.0899,0.619,1.2682,90,112.13,90 - colorless 2.08 X 19822
C-Cl C45Cl16 mon C45Cl16,mS992,15 C12/c1 4.75533,1.49608,2.32785,90,118.218,90 - - 2.02 X 51671
C-Cl C45Cl16 tricl C45Cl16,aP248,2 P-1 1.48335,1.52243,1.6055,94.675,90.174,93.761 - yellow pale 2.04 X 51671
C-Cl C6Cl10 C6Cl10,mP64,14 P121/c1 1.28936,0.67051,1.53753,90,93.858,90 - colorless 2.14 X 57683
C-Cl C7Cl8 C7Cl8,mP60,14 P121/c1 1.0312,1.0832,1.1449,90,112.96,90 - colorless 2.07 X 24439
C-Cl C8Cl10 C8Cl10,oP144,61 Pbca 0.9792,1.6436,1.86,90,90,90 - yellow 2.00 X 11315
C-Cl C8Cl8 C8Cl8,aP64,2 P-1 0.8742,1.0254,1.4912,99.24,99.4,96.39 - yellow 1.96 X 9637
C-Cl [CCl4] lt1 *,hR*,* - 1.98093,1.98093,2.46115,90,90,120 - - - N 43319
C-Cl [CCl4] lt2 CBr4,mS160,15 C12/c1 2.0181,1.135,1.9761,90,111.46,90 - - 1.94 X 12112
C-Cl [CCl4] rt CBr4,cF516,225 Fm-3m 0.838,0.838,0.838,90,90,90 - - 1.74 A 43319
C-Cl [C50]Cl10 [C50]Cl10,mS480,15 C12/c1 1.3665,1.7852,1.2977,90,93.616,90 fullerene family red 2.01 X 49788
C-Cl [C56]Cl10 [C56]Cl10,oS264,63 Cmcm 1.87599,1.34186,1.38694,90,90,90 fullerene family red dark 1.95 X 50518
C-Cl [C60]Cl10 [C60]Cl10,oS560,20 C222 1 0.9997,2.0717,3.9968,90,90,90 fullerene family orange red 1.73 X 54461
C-Cl [C60]Cl30[Cl2]0.09 [C60]Cl30[Cl2]0.09 ,mP184,14 P121/c1 1.2539,1.3507,1.93777,90,119.61,90 fullerene family orange 2.08 X 44161
C-Cl [C60]Cl5 [C60]Cl5,oP524,29 Pca21 1.9579,1.1268,2.9077,90,90,90 fullerene family red 1.86 X 48160
C-Cl [C60]Cl6 [C60]Cl6,oP1080,61 Pbca 1.71965,3.9918,1.95617,90,90,90 fullerene family orange red 1.85 X 52055
C-Cl [C64]Cl4 [C64]Cl4,oP272,62 Pnma 1.66815,1.45131,1.3199,90,90,90 fullerene family black 1.89 X 49788
C-Cl [C76]Cl24 [C76]Cl24,mP460,14 P121/c1 2.2921,1.1476,2.3315,90,103.58,90 fullerene family yellow 1.97 X 56079
C-Cl [C76]Cl26 mon [C76]Cl26,mP460,14 P121/c1 1.1546,3.7895,1.55448,90,114.939,90 fullerene family yellow 1.98 X 56079
C-Cl [C76]Cl26 tricl [C76]Cl26,aP212,2 P-1 1.1535,1.2584,2.2517,101.465,94.609,105.838 fullerene family yellow 2.00 X 56079
C-Cl [C76]Cl28[Cl2]0.27 [C76]Cl28[Cl2]0.27 ,oP880,61 Pbca 1.4573,2.0984,4.119,90,90,90 fullerene family yellow 2.03 X 56079
C-Cl [C76]Cl28[Cl2]0.37 [C76]Cl28[Cl2]0.37 ,mP440,14 P121/c1 1.16025,4.1703,1.54879,90,115.911,90 fullerene family yellow 1.90 X 56079
C-Cl [C76]Cl28[Cl2]0.5 [C76]Cl28[Cl2]0.5 ,mP416,14 P121/c1 1.1575,2.7495,2.2182,90,100.169,90 fullerene family yellow 1.86 X 56079
C-Cl [C76]Cl28[Cl2]0.65 [C76]Cl28[Cl2]0.65 ,mS448,15 C12/c1 2.3108,2.7592,1.1554,90,109.41,90 fullerene family yellow 1.87 X 56079
C-Cl [C76]Cl33[Cl2]0.44 [C76]Cl33[Cl2]0.44 ,mP472,14 P121/c1 1.3777,1.95282,2.8193,90,118.182,90 fullerene family yellow 2.10 X 56079
C-Cl [C76]Cl34 [C76]Cl34,mP440,14 P121/c1 1.3821,1.9569,2.82408,90,117.405,90 fullerene family - 2.07 X 54320
Handbook of Inorganic Substances – Edition 2015 : Data 45

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Cl [C78 ]Cl18 [C78 ]Cl18,hP192,176 P63/m 1.3055,1.3055,1.8762,90,90,120 fullerene family yellow 1.89 X 49791
C-Cl [C78 ]Cl30[Cl2] [C78 ]Cl30[Cl2],tI900,82 I-4 2.07619,2.07619,3.1444,90,90,90 fullerene family orange 2.03 X 53431
C-Cl [C80 ]Cl12 [C80 ]Cl12,mS368,15 C12/c1 2.1043,1.11665,2.151,90,106.235,90 fullerene family orange 1.90 X 51937
C-Cl [C82 ]Cl28[Cl2]0.28 [C82 ]Cl28[Cl2]0.28 ,aP240,2 P-1 1.3403,1.4005,2.0016,93.24,103.04,113.74 fullerene family orange 2.01 X 58228
C-Cl [C84 ]Cl20 [C84 ]Cl20,mP212,13 P12/c1 1.3825,1.4364,1.99271,90,133.446,90 fullerene family - 1.99 X 57853
C-Cl [C84 ]Cl22[Cl2]0.16 [C84 ]Cl22[Cl2]0.16 ,mP236,11 P121/m1 1.283,1.8301,1.3385,90,95.182,90 fullerene family orange 1.91 X 58281
C-Cl [C84 ]Cl32[Cl2]1.73 [C84 ]Cl32[Cl2]1.73 ,aP257,2 P-1 1.478,1.5175,1.8347,68.029,78.323,79.463 fullerene family yellow 2.03 X 53627
C-Cl [C84 ]Cl32.38 [C84 ]Cl32.38 ,mP472,14 P121/c1 1.04728,4.6955,1.53827,90,111.996,90 fullerene family - 2.04 X 57853
C-Cl [C86 ]Cl28 [C86 ]Cl28,mP456,14 P121/c1 2.0941,1.2853,2.9303,90,110.237,90 fullerene family yellow 1.82 X 53627
C-Cl [C90 ]Cl23 [C90 ]Cl23,aP472,2 P-1 1.4387,1.8416,2.7629,96.19,96.84,96.1 fullerene family orange 1.76 X 55871
C-Cl [C90 ]Cl24 mon [C90 ]Cl24,mS540,15 C12/c1 1.4386,2.4817,1.8462,90,102.51,90 fullerene family orange 1.99 X 55871
C-Cl [C90 ]Cl24 tricl [C90 ]Cl24,aP236,2 P-1 1.2698,1.4064,2.0254,85.03,87.8,66.89 fullerene family orange 1.94 X 55871
C-Cl [C90 ]Cl24[Cl2]0.04 [C90 ]Cl24[Cl2]0.04 ,aP232,2 P-1 1.2686,1.4171,2.0363,84.77,87.91,66.95 fullerene family orange 1.92 X 55871
C-Cl [C90 ]Cl28[Cl2]0.25 [C90 ]Cl28[Cl2]0.25 ,aP276,2 P-1 1.2956,1.3027,2.2696,81.8,83.3,67.29 fullerene family orange 1.99 X 55871
C-Cl [C90 ]Cl32 [C90 ]Cl32,mS1048,15 C12/c1 4.7487,1.4961,2.3307,90,118.163,90 fullerene family yellow 2.02 X 55871
C-Cl [C90 ]Cl32[Cl2]0.06 [C90 ]Cl32[Cl2]0.06,mS1008,15 C12/c1 4.7521,1.5032,2.3352,90,118.85,90 fullerene family orange 2.02 X 55871
C-Cl [C96 ]Cl22 [C96 ]Cl22,aP494,2 P-1 1.4603,2.1495,2.2902,68.233,89.815,86.641 fullerene family orange 1.93 X 57563
C-Cl [C96 ]Cl22[Cl2]0.04 [C96 ]Cl22[Cl2]0.04 ,oP504,60 Pbcn 1.28541,2.2104,2.4268,90,90,90 fullerene family yellow 1.86 X 57563
C-Cl [C96 ]Cl22[Cl2]0.06 [C96 ]Cl22[Cl2]0.06 ,mS488,15 C12/c1 1.56571,2.4039,1.8351,90,95.605,90 fullerene family yellow 1.87 X 57563
C-Cl [C96 ]Cl22[Cl2]0.07 [C96 ]Cl22[Cl2]0.07 ,mP956,14 P121/c1 2.2912,1.4155,4.39378,90,107.995,90 fullerene family red 1.90 X 57563
C-Cl [C96 ]Cl22[Cl2]0.6 [C96 ]Cl22[Cl2]0.6 ,oP976,61 Pbca 1.4618,2.3107,3.991,90,90,90 fullerene family yellow 1.95 X 57563
C-Co CoC0.015 ht Cu,cF4,225 Fm-3m 0.3552,0.3552,0.3552,90,90,90 close-packed structure - 8.76 F 6977
C-Co CoC0.33 m Mg,hP2,194 P63/mmc 0.2685,0.2685,0.4335,90,90,120 close-packed structure - 7.72 F 24788
C-Co Co2 C CaCl2,oP6,58 Pnnm 0.43707,0.44465,0.28969,90,90,90 - - 7.66 X 377
C-Co Co3 C Fe3C-b,oP16,62 Pnma 0.5036,0.6735,0.4489,90,90,90 - - 8.24 A 23886
C-Cr CrC m NaCl,cF8,225 Fm-3m 0.402,0.402,0.402,90,90,90 rocksalt family - 6.54 X 27950
C-Cr Cr23 C6 Cr23 C6,cF116,225 Fm-3m 1.06595,1.06595,1.06595,90,90,90 - - 6.95 X 19961
C-Cr Cr3C m Fe3C-b,oP16,62 Pnma 0.512,0.68,0.458,90,90,90 - - 7.00 A 17199
C-Cr Cr3C2 m (V0.3 Cr0.7)3C1.44 ,oS20,63 Cmcm 0.2854,0.9259,0.6965,90,90,90 - - 6.50 X 27950
C-Cr Cr3C2 Cr3C2-b,oP20,62 Pnma 0.55399,0.28327,1.1494,90,90,90 tongbaite - 6.63 X 42518
C-Cr Cr7C3 tf Cr7C3,hP80,186 P63mc 1.398,1.398,0.4523,90,90,120 - - 6.94 X 95
C-Cr Cr7C3 Mn7 C3,oP40,62 Pnma 0.4526,0.701,1.2142,90,90,90 - gray olive 6.90 X 5082
C-Cs CsC RbC,oP16,62 Pnma 0.9254,0.5136,1.0597,90,90,90 - - 3.82 X 39541
C-Cs CsC8 hp1 *,oS*,21 C222 0.524,0.602,5.675,90,90,90 - - - N 51244
C-Cs CsC8 hp2 *,oF*,70 Fddd 0.439,0.92,2.287,90,90,90 - - - N 51244
C-Cs CsC8 rt CsC8,hP27,180 P6222 0.49601,0.49601,1.7847,90,90,120 GIC yellow 3.00 X 51244
C-Cs Cs[C60] ltcub NaCl,cF8,225 Fm-3m 1.413,1.413,1.413,90,90,90 fullerene family - 2.01 X 27961
C-Cs Cs2C2 hex Na2[O2],hP12,189 P-62m 0.8637,0.8637,0.5674,90,90,120 - - 3.94 X 39541
C-Cs Cs3[C60] K3[C60],cF492,225 Fm-3m 1.47615,1.47615,1.47615,90,90,90 fullerene family - 2.31 X 55164
C-Cs Cs4[C60] orth Cs4[C60],oI128,71 Immm 1.14298,1.19255,1.21519,90,90,90 fullerene family - 2.51 X 39915
C-Cs Cs4[C60] rt K4[C60],tI10,139 I4/mmm 1.2237,1.2237,1.1358,90,90,90 fullerene family - 2.45 X 39915
C-Cs Cs6[C60] m Cs6[C60],cI132,204 Im-3 1.179,1.179,1.179,90,90,90 fullerene family - 3.08 X 25222
C-Dy DyC0.25 NaCl,cF8,225 Fm-3m 0.5081,0.5081,0.5081,90,90,90 rocksalt family - 8.38 X 12448
C-Dy DyC2 rt CaC2,tI6,139 I4/mmm 0.3668,0.3668,0.6176,90,90,90 - brass 7.46 X 4113
C-Dy Dy2 C CdCl2,hR9,166 R-3m 0.3584,0.3584,1.789,90,90,120 - - 8.44 X 14304
C-Dy Dy2 C3 Pu2C3,cI40,220 I-43d 0.8189,0.8189,0.8189,90,90,90 - - 8.73 X 11737
C-Dy Dy3 C4 Sc3C4,tP70,128 P4/mnc 0.8084,0.8084,1.5881,90,90,90 - - 8.57 A 34568
C-Dy Dy4 C5 Y4C5,oP18,55 Pbam 0.6574,1.1905,0.36654,90,90,90 - - 8.22 A 33482
C-Er ErC0.6 NaCl,cF8,225 Fm-3m 0.50214,0.50214,0.50214,90,90,90 rocksalt family - 9.15 X 14302
C-Er ErC2 rt CaC2,tI6,139 I4/mmm 0.3622,0.3622,0.6106,90,90,90 - golden 7.93 X 25047
C-Er Er2C3 hp-ht Pu2C3,cI40,220 I-43d 0.81324,0.81324,0.81324,90,90,90 - - 9.15 X 13659
C-Er Er3C4 Sc3C4,tP70,128 P4/mnc 0.7988,0.7988,1.5785,90,90,90 - - 9.07 A 24651
C-Er Er4C7 Lu4C7,mP22,14 P121/c1 0.3682,1.3588,0.6449,90,103.27,90 - gray dark 7.96 A 32688
C-Eu EuC2 ht1 CaC2,tI6,139 I4/mmm 0.415,0.415,0.66273,90,90,90 - - 5.12 X 54322
C-Eu EuC2 ht2 NaCl,cF8,225 Fm-3m 0.61379,0.61379,0.61379,90,90,90 rocksalt family - 5.06 X 54322
C-Eu EuC2 rt ThC2,mS12,15 C12/c1 0.70075,0.44098,0.7591,90,106.918,90 - - 5.21 X 54322
C-Eu EuC2 tet CaC2,tI6,139 I4/mmm 0.4045,0.4045,0.6645,90,90,90 - - 5.38 A 2200
C-Eu EuC6 sta1 BaC6,hP14,194 P63/mmc 0.4314,0.4314,0.9745,90,90,120 GIC - 4.74 A 13152
C-Eu Eu2.82 [C60] Eu2.82 [C60],cP344,205 Pa-3 2.821,2.821,2.821,90,90,90 fullerene family - 2.72 X 35085
C-Eu Eu3[C70] hp Eu3[C70],aP10,1 P1 1.013,1.095,1.4926,96.111,90.,90. fullerene family - 2.62 X 41606
C-Eu Eu3[C70] mon *,mP*,* - 1.095,1.013,1.4926,90,96.111,90 fullerene family - - N 42172
C-Eu Eu6[C60] Cs6[C60],cI132,204 Im-3 1.09292,1.09292,1.09292,90,90,90 fullerene family - 4.15 X 40100
C-Eu Eu9[C70] Eu9[C70],cF64,225 Fm-3m 1.50572,1.50572,1.50572,90,90,90 fullerene family - 4.30 X 41606
C-F CF rt CF,hR12,166 R-3m 0.25406,0.25406,1.4243,90,90,120 - - 3.88 X 37597
C-F CF4 hp CF4,mS20,15 C12/c1 0.84098,0.43022,0.83506,90,119.588,90 - - 2.22 X 28233
C-F C10F8 hp-lt *,mP72,14 P121/c1 1.659,0.4573,1.1057,90,107.843,90 - - - N 11206
C-F C10F8 lt *,mP36,14 P121/c1 0.755,0.496,1.1865,90,96.67,90 - - - N 11206
C-F C11F7 C11F7,mS72,12 C12/m1 0.89294,0.76605,1.32005,90,99.437,90 - colorless 1.98 X 42700
C-F C12F10 C12F10,oF176,43 Fdd2 1.349,2.6542,0.631,90,90,90 - - 1.96 X 9779
C-F C12F12 C12F12,hP48,176 P63/m 0.8966,0.8966,0.8671,90,90,120 - - 2.05 X 10706
C-F C14F10 C14F10,oP192,61 Pbca 0.959,2.734,0.959,90,90,90 - - 1.89 X 12212
C-F C15F18 C15F18,oP280,60 Pbcn 1.7845,1.7998,1.0143,90,90,90 - - 2.13 X 14969
C-F C18F12 C18F12,oF240,43 Fdd2 1.35,2.0228,1.0927,90,90,90 - white 1.98 X 10764
C-F C2F C2F,aP12,1 P1 0.492,0.49205,0.88,90.,90.,118.79 - - 1.53 X 12225
C-F C2F3 C2F3 ,aP40,2 P-1 0.602,0.629,0.727,103.6,107.9,106.4 - - 2.29 X 2455
C-F C2F6 *,c**,* - 0.554,0.554,0.554,90,90,90 - - - N 28292
C-F C20F42 lt2 *,mP124,7 P1c1 2.83,0.57,0.965,90,97.,90 - - - N 24923
C-F C20F42 rt *,hR186,166 R-3m 0.57,0.57,8.5,90,90,120 - - - N 24923
46 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-F C3F6 C3F6,aP18,2 P-1 0.6072,0.6233,0.6569,92.33,108.75,94.31 - - 2.13 X 38281


C-F C5F6 C5F6,mS176,15 C12/c1 1.5368,1.5326,1.0066,90,105.75,90 - - 2.03 X 10399
C-F C6F6 C6F6,mP72,14 P121/c1 0.59042,0.91174,1.73893,90,105.782,90 - - 2.06 X 57863
C-F C8F8 C8F8,mP64,14 P121/c1 0.996,0.704,1.266,90,111.6,90 - - 2.00 X 14994
C-F [CF3]10[C78 ] [CF3]10[C78 ],mS472,15 C12/c1 2.38603,1.11601,2.29338,90,105.447,90 fullerene family red 1.84 X 50510
C-F [CF3]12[C60 ] orth [CF3]12[C60 ],oP480,61 Pbca 1.65102,1.7688,1.72319,90,90,90 fullerene family yellow 2.04 X 48165
C-F [CF3]12[C60 ] rhom [CF3]12[C60 ],hR324,148 R-3 2.072,2.072,0.9729,90,90,120 fullerene family orange 2.13 X 48161
C-F [CF3]12[C70 ] mon1 [CF3]12[C70 ],mP508,14 P121/c1 1.4532,2.1131,2.14664,90,123.463,90 fullerene family orange 2.02 X 46181
C-F [CF3]12[C70 ] mon2 [CF3]12[C70 ],mS968,15 C12/c1 1.66925,1.85411,3.5626,90,99.644,90 fullerene family orange 2.04 X 46181
C-F [CF3]12[C78 ] [CF3]12[C78 ],aP252,2 P-1 1.4305,1.5264,2.0733,97.226,98.956,94.322 fullerene family - 1.33 X 47815
C-F [CF3]14[C60 ] mon [CF3]14[C60 ],mP492,14 P121/c1 1.1219,1.3882,3.55411,90,90.544,90 fullerene family yellow 2.02 X 48165
C-F [CF3]14[C60 ] tricl [CF3]14[C60 ],aP116,1 P1 1.1118,1.11525,1.22892,69.872,70.133,76.892 fullerene family yellow 2.10 X 48165
C-F [CF3]16[C70 ] [CF3]16[C70 ],mP548,14 P121/c1 1.29804,2.087,2.57438,90,117.094,90 fullerene family yellow 2.08 X 46183
C-F [CF3]16[C86 ] mon1 [CF3]16[C86 ],mP600,14 P121/c1 1.5583,3.1104,1.96866,90,128.283,90 fullerene family yellow 1.90 X 52068
C-F [CF3]16[C86 ] mon2 [CF3]16[C86 ],mS648,15 C12/c1 1.5931,2.6851,1.7802,90,94.79,90 fullerene family yellow 1.87 X 52068
C-F [CF3]18[C70 ] [CF3]18[C70 ],aP296,2 P-1 1.33244,1.43768,2.0323,103.674,98.521,114.658 fullerene family brown 2.10 X 46183
C-F [CF3]2[C3F7]2[C60] [CF3]2[C3F7]2[C60],mP176,11 P121/m1 0.99093,1.989,1.0366,90,109.19,90 fullerene family orange 2.06 X 52680
C-F [C2F5]10[C60] [C2F5]10[C60],mP536,14 P121/c1 1.79226,1.67522,2.49009,90,126.322,90 fullerene family brown 2.11 X 54734
C-F [C2F5]10[C70] mon1 [C2F5]10[C70],mP1136,14 P121/c1 2.06075,2.52241,2.83419,90,117.384,90 fullerene family brown 2.06 X 52096
C-F [C2F5]10[C70] mon2 [C2F5]10[C70],mP620,14 P121/c1 1.95072,1.63789,2.63719,90,128.685,90 fullerene family brown 2.05 X 54734
C-F [C2F5]10[C70] tricl [C2F5]10[C70],aP290,2 P-1 1.3028,1.3172,2.1183,82.979,73.435,70.517 fullerene family - 2.05 X 55579
C-F [C2F5]12[C70] [C2F5]12[C70],mP616,14 P121/c1 1.43871,2.22798,2.43473,90,111.114,90 fullerene family red 2.07 X 54734
C-F [C2F5]12[C84] mon [C2F5]12[C84],mP336,4 P1211 1.3388,2.3356,1.3546,90,110.329,90 fullerene family orange 2.04 X 58281
C-F [C2F5]12[C84] tet [C2F5]12[C84],tI1632,142 I41/acd 1.8775,1.8775,4.3194,90,90,90 fullerene family orange 2.13 X 51933
C-F [C2F5]12[C84] tricl1 [C2F5]12[C84],aP344,2 P-1 1.53518,1.58495,1.73527,75.487,82.931,84.561 fullerene family orange 2.00 X 51933
C-F [C2F5]12[C84] tricl2 [C2F5]12[C84],aP358,2 P-1 1.47891,1.59393,1.95724,88.614,69.884,69.707 fullerene family red 2.00 X 51933
C-F [C2F5]8[C70 ] mon1 [C2F5]8[C70 ],mS1104,15 C12/c1 4.71042,1.41042,1.81336,90,104.438,90 fullerene family red 2.04 X 52096
C-F [C2F5]8[C70 ] mon2 [C2F5]8[C70 ],mP520,14 P121/c1 1.88048,1.22411,2.58852,90,100.986,90 fullerene family brown 2.04 X 52096
C-F [C2F5]8[C70 ] orth [C2F5]8[C70 ],oP592,62 Pnma 1.84739,2.55003,1.23008,90,90,90 fullerene family red 2.06 X 52096
C-F [C2F5]8[C70 ] tricl [C2F5]8[C70 ],aP252,2 P-1 0.99629,1.48044,2.17315,109.818,93.576,103.488 fullerene family red 2.06 X 52096
C-F [C3F7]4[C70 ] [C3F7]4[C70 ],mS440,15 C12/c1 1.81127,1.01948,2.81018,90,107.112,90 fullerene family brown 2.03 X 54738
C-F [C3F7]6[C60 ] mon [C3F7]6[C60 ],mP500,14 P121/c1 1.64566,1.43939,2.74516,90,122.49,90 fullerene family brown 2.10 X 52680
C-F [C3F7]6[C60 ] tricl [C3F7]6[C60 ],aP240,2 P-1 1.05013,1.27563,2.1161,88.356,82.921,77.32 fullerene family red 2.10 X 52680
C-F [C3F7]8[C70 ] mon [C3F7]8[C70 ],mS1240,15 C12/c1 3.3918,1.6264,2.8027,90,98.023,90 fullerene family yellow 1.90 X 54738
C-F [C3F7]8[C70 ] tricl [C3F7]8[C70 ],aP304,2 P-1 1.4968,1.5743,1.6905,70.708,86.055,70.317 fullerene family orange 2.06 X 54738
C-F [C4F8][C70 ] [C4F8][C70 ],mP336,7 P1c1 1.7139,1.1117,2.0154,90,107.078,90 fullerene family black 1.88 X 55165
C-F [C4F8]4[C70 ] [C4F8]4[C70 ],oP472,62 Pnma 2.2599,1.653,1.1926,90,90,90 fullerene family orange 2.45 X 55165
C-F [C4F8]5[C70 ] [C4F8]5[C70 ],mP524,14 P121/c1 2.3734,1.1947,2.0846,90,103.37,90 fullerene family orange 2.13 X 55165
C-F [C4F8]6[C70 ] lt1 [C4F8]6[C70 ],aP306,2 P-1 1.2065,1.6414,1.644,92.965,95.77,101.288 fullerene family yellow 2.14 X 55165
C-F [C4F8]6[C70 ] orth [C4F8]6[C70 ],oP1160,61 Pbca 1.973,3.049,2.14,90,90,90 fullerene family yellow 2.11 X 55165
C-F [C60]F18 [C60]F18,mS312,9 C1c1 1.9669,1.1041,1.93432,90,121.178,90 fullerene family brown 1.96 X 48135
C-F [C70]F30 [C70]F30,aP200,2 P-1 1.10257,1.14172,2.04527,82.369,77.01,65.543 fullerene family red 2.05 X 48007
C-Fe FeC m cub NaCl,cF8,225 Fm-3m 0.458,0.458,0.458,90,90,90 rocksalt family - 4.69 X 53040
C-Fe FeC0.016 mart FeC0.05 ,tI4,139 I4/mmm 0.28232,0.28232,0.28678,90,90,90 - - 8.14 X 46391
C-Fe FeC0.063 ht Cu,cF4,225 Fm-3m 0.362,0.362,0.362,90,90,90 close-packed structure - 7.93 F 5460
C-Fe FeC0.09 m FeC0.09 ,oI96,74 Imma 0.402,0.402,3.699,90,90,90 - - 7.59 X 12778
C-Fe FeC0.09 rt W,cI2,229 Im-3m 0.29,0.29,0.29,90,90,90 b.c.c. family - 7.75 F 4
C-Fe Fe3C ht cem Fe3C-b,oP16,62 Pnma 0.50824,0.67329,0.4512,90,90,90 cementite gray 7.72 X 43043
C-Fe Fe3C tf Fe3N,hP8,182 P6322 0.4767,0.4767,0.4354,90,90,120 - - 6.96 X 1120
C-Fe Fe4C Fe4C,cP5,215 P-43m 0.3878,0.3878,0.3878,90,90,90 - - 6.70 X 799
C-Fe Fe5C2 mon Mn5C2,mS28,15 C12/c1 1.15695,0.45725,0.5061,90,97.731,90 - - 7.59 X 59521
C-Fe Fe5C2 tricl Fe5C2,aP28,2 P-1 0.45713,0.50588,1.15695,97.765,90.036,90.116 - - 7.60 X 49662
C-Fe Fe7C3 hp Ca7Au3,oP80,61 Pbca 0.4165,1.298,1.1301,90,90,90 - - 9.28 X 58154
C-Fe Fe7C3 m hex Th7Fe3,hP20,186 P63 mc 0.6882,0.6882,0.454,90,90,120 - - 7.61 X 2210
C-Fe Fe7C3 m orth Mn7C3,oP40,62 Pnma 0.4534,0.6909,1.1857,90,90,90 - - 7.64 A 46391
C-Gd GdC0.03 Mg,hP2,194 P63 /mmc 0.365,0.365,0.587,90,90,120 close-packed structure - 7.73 F 33252
C-Gd GdC0.33 NaCl,cF8,225 Fm-3m 0.5126,0.5126,0.5126,90,90,90 rocksalt family - 7.95 X 975
C-Gd GdC2 rt CaC2,tI6,139 I4/mmm 0.3712,0.3712,0.6275,90,90,90 - - 6.96 A 27454
C-Gd Gd2C0.985 CdCl2,hR9,166 R-3m 0.3648,0.3648,1.779,90,90,120 - - 7.93 A 33252
C-Gd Gd2C3 rt Pu2C3,cI40,220 I-43d 0.8332,0.8332,0.8332,90,90,90 - - 8.05 A 27454
C-Gd Gd4C5 Y4C5,oP18,55 Pbam 0.6667,1.2084,0.37259,90,90,90 - - 7.62 A 33482
C-Hf HfC NaCl,cF8,225 Fm-3m 0.46308,0.46308,0.46308,90,90,90 rocksalt family - 12.74 X 51153
C-Hf HfC0.064 rt NiAs,hP4,194 P63 /mmc 0.3208,0.3208,0.5101,90,90,120 close-packed structure - 13.10 X 7862
C-Ho HoC0.33 NaCl,cF8,225 Fm-3m 0.5061,0.5061,0.5061,90,90,90 rocksalt family - 8.65 X 975
C-Ho HoC2 rt CaC2,tI6,139 I4/mmm 0.3646,0.3646,0.6142,90,90,90 - brass 7.69 X 17249
C-Ho Ho2C rt CdCl2,hR9,166 R-3m 0.3556,0.3556,1.77,90,90,120 - gray 8.79 X 14301
C-Ho Ho2C3 Pu2C3,cI40,220 I-43d 0.8163,0.8163,0.8163,90,90,90 - - 8.94 X 6038
C-Ho Ho3C4 Sc3C4,tP70,128 P4/mnc 0.8043,0.8043,1.586,90,90,90 - - 8.79 A 34593
C-Ho Ho4C5 Y4C5,oP18,55 Pbam 0.653,1.1846,0.3638,90,90,90 - - 8.49 X 33482
C-Ho Ho4C7 ht Lu4C7,mP22,14 P121/c1 0.3711,1.3636,0.651,90,102.76,90 - gray dark 7.69 X 32688
C-Ho Ho4C7 rt Ho4C7,mP44,14 P121/c1 0.36806,1.2518,1.3716,90,98.84,90 - black 7.91 X 29705
C-I CI4 CI4,tI10,121 I-42m 0.6409,0.6409,0.9558,90,90,90 - red ruby 4.40 X 15710
C-I C2I2 C2I2,tP32,86 P42 /n 1.568,1.568,0.43,90,90,90 - - 3.49 X 6411
C-I C2I4 C2I4,mP24,14 P121/c1 1.4932,0.4271,1.2684,90,108.34,90 - - 4.60 X 10380
C-I C4I4 C4I4,mP32,14 P121/c1 0.44362,1.71459,1.27859,90,103.44,90 - yellow 3.90 X 39716
C-I [C60][I2 ]2 [C60][I2 ]2,hP78,147 P-3 0.9962,0.9962,0.9984,90,90,120 fullerene family black 2.38 X 26537
C-K KC rt NaC,tI32,142 I41/acd 0.7594,0.7594,1.4662,90,90,90 - white 1.61 X 36574
C-K KC24 rt sta2 *,h**,* - 0.491,0.491,1.754,90,90,120 - blue dark - N 646
Handbook of Inorganic Substances – Edition 2015 : Data 47

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-K KC36 rt sta3 *,h**,* - 0.491,0.491,1.212,90,90,120 - blue dark - N 646


C-K KC48 rt sta4 *,h**,* - 0.491,0.491,3.098,90,90,120 - black - N 646
C-K KC60 rt sta5 *,h**,* - 0.491,0.491,1.884,90,90,120 fullerene family black - N 646
C-K KC8 rt sta5 *,h**,* - 0.491,0.491,2.164,90,90,120 fullerene family tan - N 646
C-K K[C60] ht NaCl,cF8,225 Fm-3m 1.406,1.406,1.406,90,90,90 fullerene family - 1.82 X 30917
C-K K[C60] lt mon K[C60],mS8,12 C12/m1 1.7092,0.9771,1.71279,90,111.703,90 fullerene family - 1.90 X 30886
C-K K[C60] rt Rb[C60],oP122,58 Pnnm 0.9953,1.4321,0.9109,90,90,90 fullerene family - 1.94 X 34213
C-K K2C2 ht CaF2 ,cF12,225 Fm-3m 0.7553,0.7553,0.7553,90,90,90 fluorite family black gray 1.58 X 36574
C-K K2.4 [C60] K3[C60],cF492,225 Fm-3m 1.4242,1.4242,1.4242,90,90,90 fullerene family - 1.87 X 28525
C-K K3[C60] rt K3[C60],cF492,225 Fm-3m 1.41582,1.41582,1.41582,90,90,90 fullerene family - 1.96 X 29969
C-K K3[C70] *,cF584,225 Fm-3m 1.486,1.486,1.486,90,90,90 fullerene family - - N 27988
C-K K4[C60] K4[C60],tI248,139 I4/mmm 1.184,1.184,1.075,90,90,90 fullerene family - 1.93 X 26312
C-K K4[C70] *,tP148,* - 1.266,1.266,1.098,90,90,90 fullerene family - 1.88 N 42189
C-K K6[C60] Cs6[C60],cI132,204 Im-3 1.13365,1.13365,1.13365,90,90,90 fullerene family - 2.18 X 29969
C-K K9[C70] cub K9[C70],cF40,216 F-43m 1.569,1.569,1.569,90,90,90 fullerene family - 2.05 X 27988
C-K K9[C70] rhom *,hR*,* - 1.00771,1.00771,2.71186,90,90,120 fullerene family - - N 27988
C-La LaC2 ht CaC2,cF36,225 Fm-3m 0.6022,0.6022,0.6022,90,90,90 - - 4.96 X 3843
C-La LaC2 rt CaC2,tI6,139 I4/mmm 0.3937,0.3937,0.658,90,90,90 - - 5.31 X 25047
C-La La2C3 Pu2C3,cI40,220 I-43d 0.868,0.868,0.868,90,90,90 - - 6.38 X 45484
C-Li LiC12 rt *,hP*,* - 0.429,0.429,0.7029,90,90,120 - red copper - N 2760
C-Li LiC18 *,hP*,* - 0.428,0.428,1.044,90,90,120 - blue steel - N 2760
C-Li LiC6 rt LiC6 ,hP7,191 P6/mmm 0.429,0.429,0.3737,90,90,120 GIC brass 2.20 X 2760
C-Li Li2C2 ht CaF2 ,cF12,225 Fm-3m 0.5965,0.5965,0.5965,90,90,90 fluorite family - 1.19 X 36585
C-Li Li2C2 rt Rb2[O2],oI8,71 Immm 0.3652,0.48312,0.54344,90,90,90 - - 1.31 X 36585
C-Li Li4[C60] Li4[C60],mS128,12 C12/m1 1.75567,0.90478,0.93264,90,121.115,90 fullerene family - 1.96 X 43053
C-Li Lix[C60] Lix[C60],oP120,58 Pnnm 0.9843,1.4745,0.9092,90,90,90 fullerene family - 1.81 X 39236
C-Lu LuC0.33 NaCl,cF8,225 Fm-3m 0.4965,0.4965,0.4965,90,90,90 rocksalt family - 9.71 X 975
C-Lu LuC2 ht CaC2,cF36,225 Fm-3m 0.5505,0.5505,0.5505,90,90,90 - - 7.92 A 3507
C-Lu LuC2 rt CaC2,tI6,139 I4/mmm 0.3563,0.3563,0.5964,90,90,90 - - 8.73 X 1451
C-Lu Lu2C3 hp-ht Pu2C3,cI40,220 I-43d 0.80354,0.80354,0.80354,90,90,90 - - 9.88 X 13659
C-Lu Lu3C4 Sc3C4,tP70,128 P4/mnc 0.78496,0.78496,1.5633,90,90,90 - - 9.88 A 24651
C-Lu Lu4C7 Lu4C7,mP22,14 P121/c1 0.3604,1.3514,0.629,90,104.97,90 - gray dark 8.80 X 32688
C-Mg MgC2 rt MgC2,tP6,136 P42/mnm 0.39342,0.39342,0.5021,90,90,90 - - 2.07 X 35799
C-Mg Mg2 C3 Mg2 C3,oP10,58 Pnnm 0.52786,0.64108,0.37283,90,90,90 - - 2.23 X 25975
C-Mn MnC0.07 rt Mn,cI58,217 I-43m 0.8969,0.8969,0.8969,90,90,90 - - 7.45 F 7702
C-Mn MnC0.21 ht NiAs,hP4,194 P63/mmc 0.2709,0.2709,0.44229,90,90,120 AlB2 family - 6.79 X 7702
C-Mn Mn23 C6 rt Cr23 C6,cF116,225 Fm-3m 1.0595,1.0595,1.0595,90,90,90 - - 7.46 X 24337
C-Mn Mn3 C ht Fe3C-b,oP16,62 Pnma 0.508,0.6772,0.453,90,90,90 - - 7.54 A 17199
C-Mn Mn5 C2 ht Mn5 C2,mS28,15 C12/c1 1.16724,0.45864,0.50969,90,97.719,90 - - 7.34 X 24337
C-Mn Mn7 C3 Mn7 C3,oP40,62 Pnma 0.4543,0.69544,1.1973,90,90,90 - - 7.39 X 24337
C-Mo MoC hex TiP,hP8,194 P63/mmc 0.2932,0.2932,1.097,90,90,120 - - 8.78 X 452
C-Mo MoC ht-hp NaCl,cF8,225 Fm-3m 0.427,0.427,0.427,90,90,90 rocksalt family - 9.21 X 47772
C-Mo MoC rt WC,hP2,187 P-6m2 0.29,0.29,0.282,90,90,120 AlB2 family - 8.73 X 47772
C-Mo MoC0.005 W,cI2,229 Im-3m 0.31486,0.31486,0.31486,90,90,90 b.c.c. family - 10.21 F 54539
C-Mo MoC0.49 tf NaCl,cF8,225 Fm-3m 0.4254,0.4254,0.4254,90,90,90 rocksalt family - 8.79 X 6368
C-Mo MoC0.5 ht2 NiAs,hP4,194 P63/mmc 0.30128,0.30128,0.47357,90,90,120 AlB2 family - 9.10 X 38933
C-Mo MoC0.51 ht1 MoC0.5,oP16,60 Pbcn 0.4732,0.6037,0.5204,90,90,90 - - 9.12 X 10331
C-Mo MoC0.594 ht MoC0.67 ,hP12,194 P63/mmc 0.30105,0.30105,1.46112,90,90,120 - - 8.96 X 47371
C-Mo MoC0.681 ht NaCl,cF8,225 Fm-3m 0.42665,0.42665,0.42665,90,90,90 rocksalt family - 8.91 X 59007
C-Mo Mo2 C rt *,o*768,* - 0.9466,2.4152,4.1675,90,90,90 - - - N 21851
C-N CN7 CN7 ,oP128,60 Pbcn 1.81289,0.82128,1.14021,90,90,90 - colorless 1.72 X 55629
C-N C[CN]4 C[CN]4,hR54,161 R3c 0.9062,0.9062,1.1635,90,90,120 - - 1.40 X 7934
C-N C2N[CN]2 C2N[CN]2,oP112,61 Pbca 1.009,1.2141,1.385,90,90,90 - colorless 1.41 X 53109
C-N C2N2 C2N2,oP16,61 Pbca 0.619,0.708,0.631,90,90,90 - - 1.25 X 1832
C-N C2N2[N3] C2N2[N3],hP44,176 P63/m 1.02163,1.02163,0.59707,90,90,120 - yellow pale 1.74 X 43060
C-N C2[CN]4 ht C2[CN]4,mP20,14 P121/c1 0.7,0.621,0.96061,90,129.133,90 - - 1.31 X 1339
C-N C2[CN]4 rt C2[CN]4,cI60,204 Im-3 0.9736,0.9736,0.9736,90,90,90 - - 1.38 X 5656
C-N C3N3[CN]3 C3N3[CN]3,mP50,4 P1211 0.846,0.904,0.9741,90,90.75,90 - colorless 1.39 X 36716
C-N C3N4 m hex *,h**,* - 0.487,0.487,0.641,90,90,120 - brown - N 51657
C-N C6[CN]6 C6[CN]6,cP72,205 Pa-3 1.0781,1.0781,1.0781,90,90,90 - yellow 1.21 X 15869
C-N C6[N3]3[CN]3 C6[N3]3[CN]3,oP84,19 P212121 0.597,1.1318,1.6878,90,90,90 - brown 1.61 X 59573
C-Na NaC rt NaC,tI32,142 I41/acd 0.67572,0.67572,1.27015,90,90,90 - white 1.60 X 40937
C-Na Na2C2 ht CaF2 ,cF12,225 Fm-3m 0.6756,0.6756,0.6756,90,90,90 fluorite family colorless 1.51 X 36574
C-Na Na2C2 orth Rb2[O2],oI8,71 Immm 0.41893,0.53862,0.64007,90,90,90 - - 1.61 X 40937
C-Na Na2[C60] rt CaF2 ,cF12,225 Fm-3m 1.4189,1.4189,1.4189,90,90,90 fullerene family - 1.78 X 26538
C-Na Na3[C60] ht K3[C60],cF492,225 Fm-3m 1.4183,1.4183,1.4183,90,90,90 fullerene family - 1.84 A 26311
C-Na Na4[C60] rt Na4[C60],mS248,12 C12/m1 1.43873,1.171,1.025,90,129.027,90 fullerene family - 2.01 X 39335
C-Na Na6[C60] ht CeH3,cF44,225 Fm-3m 1.4248,1.4248,1.4248,90,90,90 fullerene family - 1.97 X 26538
C-Na Na7.7 [C70] trig *,hP*,164 P-3m1 1.0617,1.0617,2.5998,90,90,120 fullerene family - - N 40115
C-Na Na9.7 [C60] Na9.7 [C60],cF48,202 Fm-3 1.459,1.459,1.459,90,90,90 fullerene family - 2.02 X 26542
C-Nb NbC NaCl,cF8,225 Fm-3m 0.44544,0.44544,0.44544,90,90,90 niobocarbide - 7.89 X 51153
C-Nb NbC0.05 W,cI2,229 Im-3m 0.3304,0.3304,0.3304,90,90,90 b.c.c. family - 8.61 F 647
C-Nb NbC0.5 ht2 NiAs,hP4,194 P63/mmc 0.3123,0.3123,0.5022,90,90,120 AlB2 family - 7.74 X 52496
C-Nb NbC0.75 rt Sc0.67 Te,hR24,166 R-3m 0.314,0.314,3.01,90,90,120 - - 7.90 A 4978
C-Nb NbC0.76 Mo0.75 N0.50 ,cP8,221 Pm-3m 0.44412,0.44412,0.44412,90,90,90 - - 7.74 X 52496
C-Nb Nb1.91 C rt Nb1.91 C,mP12,6 P1m1 0.49819,0.30989,1.09391,90,90,90 - - 7.45 X 27211
C-Nb Nb2 C ht1 Fe2N,hP9,162 P-31m 0.524,0.524,0.492,90,90,120 - - 8.42 X 23679
C-Nb Nb6 C5 rt Nb6C5,mS22,12 C12/m1 0.546,0.9457,0.546,90,109.47,90 - - 7.72 X 18549
48 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Nd NdC2 rt CaC2,tI6,139 I4/mmm 0.3827,0.3827,0.6407,90,90,90 - brass 5.96 X 19255


C-Nd Nd2C3 Pu2C3,cI40,220 I-43d 0.8517,0.8517,0.8517,90,90,90 - - 6.98 X 11737
C-Ni NiC0.22 NaCl,cF8,225 Fm-3m 0.354,0.354,0.354,90,90,90 close-packed structure - 9.18 X 52089
C-Ni NiC0.33 tf NiAs,hP4,194 P63 /mmc 0.2697,0.2697,0.4334,90,90,120 AlB2 family - 7.62 X 46359
C-Ni Ni3C rt FeF3,hR24,167 R-3c 0.45889,0.45889,1.29895,90,90,120 - - 7.91 X 59147
C-Np NpC0.93 NaCl,cF8,225 Fm-3m 0.4992,0.4992,0.4992,90,90,90 rocksalt family - 13.25 X 4769
C-Np Np2C3 Pu2C3,cI40,220 I-43d 0.8103,0.8103,0.8103,90,90,90 - - 12.74 A 5384
C-O CO2 hp6 SiO2,tI12,122 I-42d 0.35601,0.35601,0.58931,90,90,90 - - 3.91 X 59201
C-O C3O2 lt C3O2,oP40,62 Pnma 0.9869,1.206,0.516,90,90,90 - - 1.47 X 39550
C-O [CO] hp1-lt [O2],cP64,223 Pm-3n 0.6136,0.6136,0.6136,90,90,90 - - 1.61 A 19175
C-O [CO] hp2-lt [N2],hR48,167 R-3c 0.8244,0.8244,1.125,90,90,120 - - 1.69 A 19175
C-O [CO] lt1 [N2]-b,hP24,194 P63 /mmc 0.3615,0.3615,0.588,90,90,120 - - 1.40 X 15800
C-O [CO] lt3 [CO],cP8,198 P213 0.563,0.563,0.563,90,90,90 - - 1.04 X 29
C-O [C60][OCO]0.80 cub [C60][OCO]0.80 ,cF40,225 Fm-3m 1.4224,1.4224,1.4224,90,90,90 fullerene family - 1.74 X 35055
C-O [C60][OCO]0.80 mon [C60][OCO]0.80 ,mP126,14 P121/c1 0.97438,0.97473,1.75076,90,123.426,90 fullerene family - 1.81 X 35055
C-O [C60][O2] lt [C60][O2],cF272,202 Fm-3 1.4152,1.4152,1.4152,90,90,90 fullerene family - 1.76 X 28911
C-O [OCO] hp1 [CS2],oS12,64 Cmce 0.433,0.4657,0.5963,90,90,90 - - 2.43 A 29448
C-O [OCO] hp2 [OCO],hR72,167 R-3c 0.8628,0.8628,1.0604,90,90,120 - - 2.57 X 53258
C-O [OCO] hp3 KrF2,tP6,136 P42 /mnm 0.3543,0.3543,0.41544,90,90,90 - - 2.80 X 49239
C-O [OCO] hp4 [OCO],tP8,136 P42 /mnm 0.34284,0.34284,0.40259,90,90,90 - - 3.09 X 49239
C-O [OCO] hp5 [OCO],oP12,60 Pbcn 0.4344,0.6111,0.4285,90,90,90 - - 2.57 X 42185
C-O [OCO] lt [OCO],cP12,205 Pa-3 0.54942,0.54942,0.54942,90,90,90 - colorless 1.76 X 34085
C-Os OsC WC,hP2,187 P-6m2 0.29077,0.29077,0.28218,90,90,120 AlB2 family - 16.25 X 1250
C-P P 8[C60] P 8[C60],hP25,191 P6/mmm 1.00838,1.00838,1.01048,90,90,120 fullerene family black 1.81 X 28561
C-Pa PaC NaCl,cF8,225 Fm-3m 0.50608,0.50608,0.50608,90,90,90 rocksalt family - 12.46 X 4746
C-Pa PaC2 CaC2,tI6,139 I4/mmm 0.361,0.361,0.611,90,90,90 - - 10.64 A 4746
C-Pd PdC0.03 Cu,cF4,225 Fm-3m 0.3908,0.3908,0.3908,90,90,90 close-packed structure - 11.88 F 10090
C-Pd PdC0.049 NaCl,cF8,225 Fm-3m 0.39234,0.39234,0.39234,90,90,90 rocksalt family - 11.77 X 38370
C-Pr PrC2 rt CaC2,tI6,139 I4/mmm 0.3852,0.3852,0.6425,90,90,90 - brass 5.75 X 3602
C-Pr Pr2C3 Pu2C3,cI40,220 I-43d 0.8572,0.8572,0.8572,90,90,90 - - 6.70 X 11737
C-Pt PtC hp NaCl,cF8,225 Fm-3m 0.4814,0.4814,0.4814,90,90,90 rocksalt family - 12.33 X 45529
C-Pu PuC NaCl,cF8,225 Fm-3m 0.49619,0.49619,0.49619,90,90,90 rocksalt family - 13.92 X 11619
C-Pu PuC2 ht CaC2,cF36,225 Fm-3m 0.569,0.569,0.569,90,90,90 - - 9.66 A 5306
C-Pu PuC2 rt CaC2,tI6,139 I4/mmm 0.363,0.363,0.6094,90,90,90 - - 11.09 A 2466
C-Pu Pu2C3 Pu2C3,cI40,220 I-43d 0.8132,0.8132,0.8132,90,90,90 - - 12.95 X 5379
C-Rb RbC hex RbC,hP11,189 P-62m 0.8526,0.8526,0.517,90,90,120 - - 2.98 X 39541
C-Rb RbC orth RbC,oP16,62 Pnma 0.90484,0.48365,0.99322,90,90,90 - - 2.98 X 39541
C-Rb RbC24 GIC-2 *,h**,* - 0.491,0.491,1.808,90,90,120 - blue dark - N 646
C-Rb RbC36 GIC-3 *,h**,* - 0.491,0.491,1.236,90,90,120 - blue dark - N 646
C-Rb RbC48 GIC-4 *,h**,* - 0.491,0.491,3.156,90,90,120 - black - N 646
C-Rb RbC60 GIC-5 *,h**,* - 0.491,0.491,1.912,90,90,120 - black - N 646
C-Rb RbC8 rt *,h**,* - 0.491,0.491,2.265,90,90,120 - tan - N 646
C-Rb Rb[C60] lt cub NaCl,cF8,225 Fm-3m 1.4072,1.4072,1.4072,90,90,90 fullerene family - 1.92 X 29380
C-Rb Rb0.91 [C60 ] rt Rb[C60],oP122,58 Pnnm 1.0107,1.4233,0.9138,90,90,90 fullerene family - 2.02 X 29277
C-Rb Rb3[C60] lt K3[C60],cF492,225 Fm-3m 1.442,1.442,1.442,90,90,90 fullerene family - 2.16 X 26312
C-Rb Rb4[C60] hp Rb4[C60],oI10,71 Immm 1.1109,1.1549,1.181,90,90,90 fullerene family - 2.33 X 47351
C-Rb Rb4[C60] rt K4[C60],tI248,139 I4/mmm 1.19783,1.19783,1.1035,90,90,90 fullerene family black 2.23 X 54311
C-Rb Rb6[C60] Cs6[C60],cI132,204 Im-3 1.154,1.154,1.154,90,90,90 fullerene family - 2.67 X 26312
C-Rb Rb8.8 [C84] Rb8.8 [C84],cP48,205 Pa-3 1.687,1.687,1.687,90,90,90 fullerene family - 2.44 X 45472
C-Re ReC hp cub NaCl,cF8,225 Fm-3m 0.4005,0.4005,0.4005,90,90,90 rocksalt family - 20.50 X 8696
C-Re ReC hp hex TiP,hP8,194 P63 /mmc 0.284,0.284,0.985,90,90,120 - - 19.14 A 5912
C-Re ReC0.5 tf NiAs,hP4,194 P63 /mmc 0.302,0.302,0.476,90,90,120 AlB2 family - 16.98 X 4674
C-Re Re2C rt NbS2,hP6,194 P63 /mmc 0.28425,0.28425,0.98599,90,90,120 - - 18.51 X 51594
C-Ru RuC WC,hP2,187 P-6m2 0.29079,0.29079,0.28219,90,90,120 AlB2 family - 9.09 X 1250
C-Ru Ru2C CdI2,hP3,164 P-3m1 0.2534,0.2534,0.4147,90,90,120 CdI2 -PbI2 polytype - 15.42 X 58636
C-S C2S C2S,mP48,4 P1211 0.39074,1.65628,1.1154,90,94.18,90 - red dark 2.07 X 45905
C-S C2S3 m C2S3,mP20,14 P121/c1 0.5805,0.6638,1.07791,90,109.164,90 - yellow 2.04 X 46306
C-S C2S3 C2S3,mP40,14 P121/c1 0.7644,1.0459,0.9901,90,105.92,90 - brown dark 2.10 X 46306
C-S C3S4 C3S4,mP56,14 P121/c1 0.8046,0.9797,1.3818,90,105.76,90 - orange 2.08 X 27324
C-S C3S8 C3S8,aP22,2 P-1 0.44204,0.9136,1.1762,101.61,96.2,92.28 - yellow 2.10 X 27024
C-S S12[CS2] S12[CS2],hR45,166 R-3m 1.0668,1.0668,1.1551,90,90,120 - colorless 2.02 X 14694
C-S [CS2] [CS2],oS12,64 Cmce 0.60864,0.52866,0.94623,90,90,90 - - 1.66 X 14952
C-S [C60]S8[CS2] rt [C60][S8][CS2],oP48,62 Pnma 0.9973,1.3356,2.8654,90,90,90 fullerene family red brown 1.83 X 27839
C-S [C60][S8]2 [C60][S8]2,mS304,15 C12/c1 2.0867,2.1062,1.0508,90,111.25,90 fullerene family - 1.90 X 27111
C-S [C70]S48 [C70]S48,oS568,38 Amm2 3.7953,2.0241,1.0226,90,90,90 fullerene family black 2.01 X 27279
C-S [C76]S48 [C76]S48,mS704,8 C1m1 1.0410,2.0500,1.9480,90,98.8,90 fullerene family black 1.98 X 28496
C-Sc ScC rt NaCl,cF8,225 Fm-3m 0.45615,0.45615,0.45615,90,90,90 rocksalt family - 3.99 X 56471
C-Sc ScC0.5 NaCl,cF8,225 Fm-3m 0.4747,0.4747,0.4747,90,90,90 rocksalt family - 3.16 X 56471
C-Sc ScCx rt Mg,hP2,194 P63 /mmc 0.31802,0.31802,0.49911,90,90,120 close-packed structure - 3.42 X 55051
C-Sc ScCx *,oP*,47 Pmmm 0.38846,0.93885,1.56487,90,90,90 - - - N 56471
C-Sc Sc13C10 ht2 (Ge) *,cI*,* - 0.8514,0.8514,0.8514,90,90,90 - - - N 4716
C-Sc Sc2C rt Ti2C,cF48,227 Fd-3m 0.944,0.944,0.944,90,90,90 - - 3.22 X 3668
C-Sc Sc2C3 Pu2C3,cI40,220 I-43d 0.7205,0.7205,0.7205,90,90,90 - - 4.47 X 3668
C-Sc Sc2[C84] *,hP*,194 P63 /mmc 1.12,1.12,1.83,90,90,120 fullerene family - - N 29276
C-Sc Sc3C4 Sc3C4,tP70,128 P4/mnc 0.74873,0.74873,1.5026,90,90,90 - gray light 3.61 X 24651
C-Sc Sc4C3 ht1 Th3P 4,cI28,220 I-43d 0.7207,0.7207,0.7207,90,90,90 - - 3.83 X 4612
C-Se Se2C [CS2],oS12,64 Cmce 0.67666,0.59513,0.88451,90,90,90 - golden 3.17 X 15902
C-Si SiC 105R SiC,hR210,160 R3m 0.3078,0.3078,26.439,90,90,120 adamantane structure - 3.22 X 2097
Handbook of Inorganic Substances – Edition 2015 : Data 49

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Si SiC 10H SiC,hP20,156 P3m1 0.3079,0.3079,2.5184,90,90,120 adamantane structure - 3.22 X 365
C-Si SiC 111R SiC,hR222,160 R3m 0.3078,0.3078,27.95,90,90,120 adamantane structure green light 3.22 X 1788
C-Si SiC 120R SiC,hR240,160 R3m 0.308,0.308,30.24,90,90,120 adamantane structure - 3.22 X 3817
C-Si SiC 126R SiC,hR252,160 R3m 0.3078,0.3078,31.68,90,90,120 adamantane structure - 3.23 X 11126
C-Si SiC 141R SiC,hR282,160 R3m 0.3079,0.3079,35.5049,90,90,120 adamantane structure blue gray 3.22 X 623
C-Si SiC 147R SiC,hR294,160 R3m 0.3079,0.3079,37.03,90,90,120 adamantane structure - 3.22 X 7838
C-Si SiC 14H SiC,hP28,156 P3m1 0.3079,0.3079,3.5252,90,90,120 adamantane structure - 3.22 X 3180
C-Si SiC 150R1 SiC-a,hR300,160 R3m 0.3079,0.3079,37.77,90,90,120 adamantane structure - 3.22 X 12919
C-Si SiC 150R2 SiC-b,hR300,160 R3m 0.3079,0.3079,37.77,90,90,120 adamantane structure - 3.22 X 12919
C-Si SiC 15R SiC,hR30,160 R3m 0.308,0.308,3.7817,90,90,120 adamantane structure green 3.21 X 289
C-Si SiC 174R SiC,hR348,160 R3m 0.3078,0.3078,43.67,90,90,120 adamantane structure black 3.23 X 1269
C-Si SiC 189R SiC,hR378,160 R3m 0.308,0.308,47.628,90,90,120 adamantane structure black 3.22 X 7117
C-Si SiC 19H SiC,hP38,156 P3m1 0.30792,0.30792,4.78495,90,90,120 adamantane structure blue dark 3.22 X 500
C-Si SiC 21H SiC,hP42,156 P3m1 0.307,0.307,5.287,90,90,120 adamantane structure green 3.24 X 16941
C-Si SiC 21R SiC,hR42,160 R3m 0.3079,0.3079,5.289,90,90,120 adamantane structure - 3.22 X 241
C-Si SiC 24R SiC,hR48,160 R3m 0.3082,0.3082,6.049,90,90,120 adamantane structure - 3.21 X 2447
C-Si SiC 261R SiC,hR522,160 R3m 0.308,0.308,65.76,90,90,120 adamantane structure - 3.22 X 15192
C-Si SiC 27H SiC,hP54,156 P3m1 0.3079,0.3079,6.7996,90,90,120 adamantane structure black 3.22 X 1034
C-Si SiC 27R SiC,hR54,160 R3m 0.3079,0.3079,6.7996,90,90,120 adamantane structure - 3.22 X 412
C-Si SiC 2H ZnO,hP4,186 P63mc 0.3079,0.3079,0.5053,90,90,120 adamantane structure black 3.21 X 12772
C-Si SiC 33R SiC,hR66,160 R3m 0.3076,0.3076,8.312,90,90,120 adamantane structure blue 3.23 X 47689
C-Si SiC 36H SiC,hP72,156 P3m1 0.3078,0.3078,9.065,90,90,120 adamantane structure - 3.22 X 1898
C-Si SiC 393R SiC,hR786,160 R3m 0.308,0.308,99.,90,90,120 adamantane structure - 3.22 X 16896
C-Si SiC 3C ZnS,cF8,216 F-43m 0.43588,0.43588,0.43588,90,90,90 adamantane structure black 3.22 X 11775
C-Si SiC 411R SiC,hR822,160 R3m 0.308,0.308,103.5,90,90,120 adamantane structure - 3.22 X 16896
C-Si SiC 45R1 SiC-a,hR90,160 R3m 0.3079,0.3079,11.331,90,90,120 adamantane structure - 3.22 X 6874
C-Si SiC 45Rb SiC-b,hR90,160 R3m 0.308,0.308,11.34,90,90,120 adamantane structure - 3.22 X 14823
C-Si SiC 4H SiC,hP8,186 P63mc 0.30799,0.30799,1.00822,90,90,120 adamantane structure black 3.22 X 53163
C-Si SiC 519R SiC,hR1038,160 R3m 0.308,0.308,130.5,90,90,120 adamantane structure - 3.22 X 16896
C-Si SiC 51R1 SiC-a,hR102,160 R3m 0.3079,0.3079,12.8437,90,90,120 adamantane structure - 3.22 X 267
C-Si SiC 51R2 SiC-b,hR102,160 R3m 0.3079,0.3079,12.8437,90,90,120 adamantane structure black 3.22 X 412
C-Si SiC 51R3 SiC-c,hR102,160 R3m 0.308,0.308,12.844,90,90,120 adamantane structure - 3.22 X 25458
C-Si SiC 57R SiC,hR114,160 R3m 0.3078,0.3078,14.3526,90,90,120 adamantane structure green light 3.22 X 1595
C-Si SiC 69R1 SiC-a,hR138,160 R3m 0.30806,0.30806,17.385,90,90,120 adamantane structure - 3.22 X 2381
C-Si SiC 69R2 SiC-b,hR138,160 R3m 0.3077,0.3077,17.375,90,90,120 adamantane structure - 3.22 X 4998
C-Si SiC 6H SiC,hP12,186 P63mc 0.3081,0.3081,1.51248,90,90,120 moissanite colorless 3.21 X 48040
C-Si SiC 75R SiC,hR150,160 R3m 0.3079,0.3079,18.8878,90,90,120 adamantane structure - 3.22 X 412
C-Si SiC 84R SiC,hR168,160 R3m 0.3079,0.3079,21.1543,90,90,120 adamantane structure - 3.22 X 412
C-Si SiC 87R SiC,hR174,160 R3m 0.3079,0.3079,21.9099,90,90,120 adamantane structure blue dark 3.22 X 267
C-Si SiC 8H SiC,hP16,186 P63mc 0.3079,0.3079,2.0147,90,90,120 adamantane structure yellow 3.22 X 412
C-Si SiC 90R SiC,hR180,160 R3m 0.3078,0.3078,22.66,90,90,120 adamantane structure - 3.22 X 1984
C-Si SiC 93R1 SiC-a,hR186,160 R3m 0.308,0.308,23.43,90,90,120 adamantane structure - 3.22 X 15192
C-Si SiC 93R2 SiC-b,hR186,160 R3m 0.307,0.307,23.417,90,90,120 adamantane structure green 3.24 X 16941
C-Si SiC 96R SiC,hR192,160 R3m 0.3079,0.3079,24.183,90,90,120 adamantane structure - 3.22 X 3188
C-Si SiC 9H SiC,hP18,156 P3m1 0.3079,0.3079,2.2662,90,90,120 adamantane structure - 3.22 X 6042
C-Si SiC hp NaCl,cF8,225 Fm-3m 0.3684,0.3684,0.3684,90,90,90 rocksalt family - 5.33 X 27978
C-Si Si1.25 C0.75 FeSi,cP8,198 P213 0.4523,0.4523,0.4523,90,90,90 - - 3.17 X 30119
C-Sm SmC0.33 ht NaCl,cF8,225 Fm-3m 0.5172,0.5172,0.5172,90,90,90 rocksalt family - 7.41 X 975
C-Sm SmC2 rt CaC2,tI6,139 I4/mmm 0.3761,0.3761,0.6317,90,90,90 - - 6.48 A 27454
C-Sm SmC6 LiC6 ,hP7,191 P6/mmm 0.431,0.431,0.494,90,90,120 GIC - 4.65 A 8943
C-Sm Sm2 C3 Pu2C3,cI40,220 I-43d 0.8425,0.8425,0.8425,90,90,90 - - 7.48 A 27454
C-Sm Sm2.75 [C60] cub Eu2.82 [C60],cP344,205 Pa-3 2.82,2.82,2.82,90,90,90 fullerene family - 2.69 X 38034
C-Sm Sm2.75 [C60] orth Yb2.75 [C60],oP144,61 Pbca 2.81609,2.8235,2.8197,90,90,90 fullerene family - 2.69 X 37462
C-Sm Sm3 [C60] cub Sm3 [C60],cP8,200 Pm-3 1.112,1.112,1.112,90,90,90 fullerene family - 2.83 X 38034
C-Sm Sm3 [C60] orth Yb2.75 [C60],oP144,61 Pbca 2.807,2.817,2.827,90,90,90 fullerene family - 2.79 A 30912
C-Sm Sm3 [C70] hp Eu3[C70],aP10,1 P1 0.9723,1.0592,1.4408,96.205,90,90 fullerene family - 2.91 X 42172
C-Sm Sm3 [C70] Sm3 [C70],mP10,3 P121 1.093,1.009,1.488,90,96.16,90 fullerene family - 2.63 X 37255
C-Sm Sm6 [C60] Cs6[C60],cI132,204 Im-3 1.089,1.089,1.089,90,90,90 fullerene family - 4.17 X 36475
C-Sn SnC60 *,cF*,* - 1.4242,1.4242,1.4242,90,90,90 - - - N 26741
C-Sn Snx[C60] *,tI*,141 I41/amd 0.5778,0.5778,0.3194,90,90,90 fullerene family - - N 46293
C-Sr SrC2 ht NaCl,cF8,225 Fm-3m 0.62134,0.62134,0.62134,90,90,90 rocksalt family gray faint 3.09 X 37616
C-Sr SrC2 lt ThC2,mS12,15 C12/c1 0.70455,0.44681,0.76836,90,107.22,90 - gray faint 3.21 X 37616
C-Sr SrC2 rt CaC2,tI6,139 I4/mmm 0.41157,0.41157,0.6741,90,90,90 - colorless 3.25 X 36589
C-Sr SrC6 BaC6,hP14,194 P63/mmc 0.4316,0.4316,0.988,90,90,120 GIC yellow 3.33 A 8943
C-Sr Sr2.08 [C60] Sr2.08 [C60],cF280,202 Fm-3 1.4144,1.4144,1.4144,90,90,90 fullerene family - 2.12 X 28560
C-Sr Sr3[C60] Sr3[C60],cP126,200 Pm-3 1.1140,1.1140,1.1140,90,90,90 fullerene family - 2.36 X 28560
C-Sr Sr6[C60] Cs6[C60],cI132,204 Im-3 1.0975,1.0975,1.0975,90,90,90 fullerene family - 3.13 X 28560
C-Ta TaC NaCl,cF8,225 Fm-3m 0.4453,0.4453,0.4453,90,90,90 tantalcarbide black 14.52 X 51153
C-Ta TaC0.5 ht NiAs,hP4,194 P63/mmc 0.3116,0.3116,0.4886,90,90,120 AlB2 family - 15.11 X 49065
C-Ta Ta2C rt CdI2 ,hP3,164 P-3m1 0.31059,0.31059,0.49464,90,90,120 CdI2-PbI2 polytype - 15.03 X 39623
C-Ta Ta4C2.67 rt In3 Te4,hR21,166 R-3m 0.31216,0.31216,3.0058,90,90,120 - - 14.85 X 49065
C-Tb TbC0.33 NaCl,cF8,225 Fm-3m 0.5107,0.5107,0.5107,90,90,90 rocksalt family - 8.12 X 975
C-Tb TbC2 ht CaC2,cF36,225 Fm-3m 0.5691,0.5691,0.5691,90,90,90 - - 6.59 A 3507
C-Tb TbC2 rt CaC2,tI6,139 I4/mmm 0.3678,0.3678,0.6206,90,90,90 - brass 7.24 X 3602
C-Tb Tb2C CdCl2,hR9,166 R-3m 0.3584,0.3584,1.804,90,90,120 - gray 8.19 X 14304
C-Tb Tb2C3 Pu2C3,cI40,220 I-43d 0.82526,0.82526,0.82526,90,90,90 - - 8.36 X 1452
C-Tb Tb4C5 Y4C5,oP18,55 Pbam 0.6608,1.1973,0.36871,90,90,90 - - 7.92 X 33482
C-Tc TcC0.11 Mg,hP2,194 - 0.29848,0.29848,0.4447,90,90,120 - - 9.61 F 12917
50 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Tc TcC0.21 cub2 Cu,cF4,225 - 0.39844,0.39844,0.39844,90,90,90 close-packed structure - - F 12917


C-Th ThC NaCl,cF8,225 Fm-3m 0.53221,0.53221,0.53221,90,90,90 rocksalt family - 10.75 X 19435
C-Th ThC0.18 rt Cu,cF4,225 Fm-3m 0.516,0.516,0.516,90,90,90 close-packed structure - 11.32 F 1011
C-Th ThC0.91 ht2 NaCl,cF8,225 Fm-3m 0.5335,0.5335,0.5335,90,90,90 rocksalt family - 10.63 X 3575
C-Th ThC2 ht1 CoO,tI4,139 I4/mmm 0.4221,0.4221,0.5394,90,90,90 rocksalt family - 8.85 X 3805
C-Th ThC2 rt ThC2,mS12,15 C12/c1 0.6684,0.4220,0.6735,90,103.91,90 - - 9.22 X 20371
C-Th Th2C3 hp Pu2C3,cI40,220 I-43d 0.85527,0.85527,0.85527,90,90,90 - - 10.62 A 5310
C-Ti TiC hp NiO,hR6,166 R-3m 0.29442,0.29442,0.73353,90,90,120 rocksalt family - 5.42 X 35904
C-Ti TiC NaCl,cF8,225 Fm-3m 0.4328,0.4328,0.4328,90,90,90 khamrabaevite black 4.91 X 11170
C-Ti TiC0.016 rt Mg,hP2,194 P63 /mmc 0.2955,0.2955,0.4703,90,90,120 close-packed structure - 4.49 F 535
C-Ti TiC0.62 ht1 MgO,cF64,227 Fd-3m 0.8624,0.8624,0.8624,90,90,90 - - 4.59 X 40666
C-Ti TiC2 TiC2,cP7,221 Pm-3m 0.313,0.313,0.313,90,90,90 - - 3.89 X 1660
C-Ti Ti0.96 C0.62 rt Ti0.96 C0.62 ,hR12,160 R3m 0.306,0.306,1.491,90,90,120 rocksalt family - 4.40 X 29994
C-Tm TmC0.33 NaCl,cF8,225 Fm-3m 0.5016,0.5016,0.5016,90,90,90 rocksalt family - 9.10 X 975
C-Tm TmC2 rt CaC2,tI6,139 I4/mmm 0.3601,0.3601,0.6062,90,90,90 - brass 8.15 X 5341
C-Tm Tm2C3 hp-ht Pu2C3,cI40,220 I-43d 0.80917,0.80917,0.80917,90,90,90 - - 9.38 X 13659
C-Tm Tm3C4 Sc3C4,tP70,128 P4/mnc 0.793,0.793,1.573,90,90,90 - - 9.31 A 24651
C-Tm Tm4C7 Lu4C7,mP22,14 P121/c1 0.365,1.3564,0.6361,90,104.36,90 - - 8.27 A 32688
C-U UC hp *,oP*,* - 0.3043,0.3518,0.473,90,90,90 - - - N 19135
C-U UC rt NaCl,cF8,225 Fm-3m 0.49606,0.49606,0.49606,90,90,90 rocksalt family gray dark 13.61 X 19441
C-U UC0.1 m Cu,cF4,225 Fm-3m 0.489,0.489,0.489,90,90,90 close-packed structure - 13.59 F 7286
C-U UC2 hp *,hP12,* - 0.5674,0.5674,0.4767,90,90,120 - - 13.10 N 27389
C-U UC2 ht1 CaC2,tI6,139 I4/mmm 0.3522,0.3522,0.5988,90,90,90 - - 11.72 X 20371
C-U UC2 ht2 NaCl,cF8,225 Fm-3m 0.5488,0.5488,0.5488,90,90,90 rocksalt family - 10.53 X 2933
C-U U2C3 ht Pu2C3,cI40,220 I-43d 0.8089,0.8089,0.8089,90,90,90 - - 12.85 X 5379
C-V VC rt NaCl,cF8,225 Fm-3m 0.41629,0.41629,0.41629,90,90,90 rocksalt family black 5.80 X 51153
C-V VC0.042 W,cI2,229 Im-3m 0.3028,0.3028,0.3028,90,90,90 b.c.c. family - 6.15 F 3097
C-V VC0.5 ht NiAs,hP4,194 P63 /mmc 0.29043,0.29043,0.45793,90,90,120 AlB2 family - 5.65 X 2497
C-V VC0.67 rt Sc0.67 Te,hR24,166 R-3m 0.2917,0.2917,2.783,90,90,120 - - 5.73 X 4978
C-V V2C rt Fe2N0.94 ,oP12,60 Pbcn 0.4577,0.5742,0.5037,90,90,90 - - 5.71 X 3203
C-V V6C5 rt V6C5,hP33,151 P3112 0.509,0.509,1.440,90,90,120 rocksalt family - 5.64 X 4219
C-V V8C7 rt V8C7,cP60,213 P4132 0.83403,0.83403,0.83403,90,90,90 rocksalt family - 5.63 X 34502
C-W WC rt WC,hP2,187 P-6m2 0.29017,0.29017,0.28486,90,90,120 qusongite gray steel 15.66 X 51393
C-W WC0.46 ht2 NiAs,hP4,194 P63 /mmc 0.29947,0.29947,0.4728,90,90,120 AlB2 family - 17.13 X 49131
C-W WC0.82 ht NaCl,cF8,225 Fm-3m 0.4215,0.4215,0.4215,90,90,90 rocksalt family - 17.18 X 2657
C-W WCx W,cI2,229 Im-3m 0.31649,0.31649,0.31649,90,90,90 b.c.c. family - 19.26 X 7861
C-W W2C ht1 W2C,hP11,162 P-31m 0.5188,0.5188,0.47273,90,90,120 - - 17.17 X 49372
C-W W2C orth Fe2N0.94 ,oP12,60 Pbcn 0.4721,0.603,0.518,90,90,90 - - 17.10 X 4252
C-W W2C trig CdI2,hP3,164 P-3m1 0.298,0.298,0.471,90,90,120 CdI2 -PbI2 polytype - 17.41 X 1319
C-W W3C0.375 tf Cr3Si,cP8,223 Pm-3n 0.5041,0.5041,0.5041,90,90,90 Frank-Kasper phase - 14.42 X 17962
C-Y YC0.44 ht NaCl,cF8,225 Fm-3m 0.5115,0.5115,0.5115,90,90,90 rocksalt family brass 4.68 X 4730
C-Y YC2 rt CaC2,tI6,139 I4/mmm 0.3663,0.3663,0.6171,90,90,90 - golden 4.53 X 17249
C-Y YCx rt Mg,hP2,194 P63 /mmc 0.3662,0.3662,0.5723,90,90,120 close-packed structure - 4.44 X 2815
C-Y Y[C82] Y[C82],mP4,4 P1211 1.1265,1.1281,1.8355,90,107.624,90 fullerene family - 1.60 X 30807
C-Y Y2C rt CdCl2,hR9,166 R-3m 0.36248,0.36248,1.7964,90,90,120 - brass 4.63 X 41646
C-Y Y2C3 hp-ht Pu2C3,cI40,220 I-43d 0.82372,0.82372,0.82372,90,90,90 - - 5.08 X 45429
C-Y Y3C4 rt Sc3C4,tP70,128 P4/mnc 0.8049,0.8049,1.6037,90,90,90 - - 5.03 A 24651
C-Y Y4C5 rt Y4C5,oP18,55 Pbam 0.65735,1.1918,0.36692,90,90,90 - - 4.80 X 33482
C-Y Y4C7 ht Lu4C7,mP22,14 P121/c1 0.3726,1.3692,0.6527,90,103.04,90 - - 4.50 X 34568
C-Y Y4C7 rt Ho4C7,mP44,14 P121/c1 0.37008,1.2589,1.3791,90,98.85,90 - - 4.60 A 29705
C-Yb YbC0.5 ht NaCl,cF8,225 Fm-3m 0.5001,0.5001,0.5001,90,90,90 rocksalt family - 9.51 X 5297
C-Yb YbC0.5 rt Sc0.685 S,hR12,166 R-3m 0.35371,0.35371,1.74572,90,90,120 - - 9.43 A 5297
C-Yb YbC2 rt CaC2,tI6,139 I4/mmm 0.363,0.363,0.6101,90,90,90 - golden 8.14 X 5340
C-Yb YbC6 BaC6,hP14,194 P63 /mmc 0.432,0.432,0.9147,90,90,120 GIC - 5.51 A 13152
C-Yb Yb2C3 hp-ht Pu2C3,cI40,220 I-43d 0.80723,0.80723,0.80723,90,90,90 - - 9.65 X 13659
C-Yb Yb2.75 [C60 ] Yb2.75 [C60 ],oP144,61 Pbca 2.78733,2.79804,2.78743,90,90,90 fullerene family - 2.92 X 30804
C-Yb Yb3C4 Sc3C4,tP70,128 P4/mnc 0.79096,0.79096,1.5521,90,90,90 - gray silver 9.70 A 24651
C-Yb Yb3[C70] *,mP*,* - 1.0897,0.9991,1.4774,90,96.072,90 fullerene family - - N 42172
C-Zr ZrC0.02 NiAs,hP4,194 P63 /mmc 0.32358,0.32358,0.5161,90,90,120 AlB2 family - 6.49 X 7749
C-Zr ZrC0.92 NaCl,cF8,225 Fm-3m 0.4698,0.4698,0.4698,90,90,90 rocksalt family - 6.55 X 23113
C-Zr Zr2C Ti2C,cF48,227 Fd-3m 0.93236,0.93236,0.93236,90,90,90 - - 6.37 X 58325
Ca-Cd CaCd CsCl,cP2,221 Pm-3m 0.3839,0.3839,0.3839,90,90,90 b.c.c. family - 4.48 X 6645
Ca-Cd CaCd2 ht KHg2,oI12,74 Imma 0.48863,0.7541,0.8513,90,90,90 AlB2 family gray silver 5.61 X 53597
Ca-Cd CaCd2 rt MgZn2,hP12,194 P63 /mmc 0.59971,0.59971,0.9627,90,90,120 Friauf-Laves phase gray silver 5.87 X 53597
Ca-Cd CaCd6 Cd6Y,cI184,204 Im-3 1.568,1.568,1.568,90,90,90 - - 7.39 A 6645
Ca-Cd Ca13Cd76 Ca13Cd76,cP792,205 Pa-3 2.53395,2.53395,2.53395,90,90,90 - - 7.40 X 38363
Ca-Cd Ca14Cd51 Ag51Gd14,hP68,175 P6/m 1.3465,1.3465,0.9787,90,90,120 - - 6.80 A 6645
Ca-Cd Ca3Cd2 Gd3Al2,tP20,102 P42nm 0.8864,0.8864,0.802,90,90,90 - - 3.64 A 9928
Ca-Cl CaCl2 hp1 Fe2N0.94 ,oP12,60 Pbcn 0.611,0.762,0.702,90,90,90 - - 2.26 A 34737
Ca-Cl CaCl2 hp2 SrI2,oP24,61 Pbca 0.6481,1.2661,0.6762,90,90,90 - - 2.66 A 34737
Ca-Cl CaCl2 hp3 EuI2,mP12,14 P121/c1 0.6411,0.6677,0.689,90,100.1,90 - - 2.54 A 34737
Ca-Cl CaCl2 hp4 PbCl2,oP12,62 Pnma 0.7029,0.4172,0.8366,90,90,90 - - 3.00 X 34737
Ca-Cl CaCl2 ht TiO2,tP6,136 P42 /mnm 0.63831,0.63831,0.42041,90,90,90 - - 2.15 X 45498
Ca-Cl CaCl2 rt CaCl2,oP6,58 Pnnm 0.62877,0.64376,0.41782,90,90,90 - - 2.18 X 45498
Ca-Cu CaCu ht CaCu,oP40,62 Pnma 3.880,0.4271,0.5894,90,90,90 CrB(TlI)-FeB - 3.52 X 14027
Ca-Cu CaCu rt CaCu,mP20,11 P121/m1 0.5880,0.4271,1.947,90,94.3,90 CrB(TlI)-FeB - 3.53 X 14027
Ca-Cu CaCu5 CaCu5,hP6,191 P6/mmm 0.5108,0.5108,0.4057,90,90,120 - - 6.48 X 26689
Ca-Cu Ca2Cu Ca2Cu,oP12,62 Pnma 0.6126,0.4161,1.453,90,90,90 - - 2.58 X 14913
Handbook of Inorganic Substances – Edition 2015 : Data 51

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-D CaD2 rt PbCl2,oP12,62 Pnma 0.59475,0.35933,0.68018,90,90,90 - gray white 2.02 X 48615


Ca-F CaF2 hp PbCl2,oP12,62 Pnma 0.6018,0.3614,0.7023,90,90,90 - - 3.40 X 39062
Ca-F CaF2 CaF2 ,cF12,225 Fm-3m 0.54712,0.54712,0.54712,90,90,90 fluorite colorless 3.17 X 31524
Ca-Ga CaGa TlI,oS8,63 Cmcm 0.4193,1.1447,0.43847,90,90,90 CrB(TlI)-FeB - 3.47 X 52438
Ca-Ga CaGa2 ht AlB2 ,hP3,191 P6/mmm 0.44296,0.44296,0.4074,90,90,120 AlB2 family - 4.31 X 51936
Ca-Ga CaGa2 rt CaIn2,hP6,194 P63/mmc 0.44627,0.44627,0.7364,90,90,120 AlB2 family gray silver 4.69 X 49752
Ca-Ga CaGa4 CaGa4,mS10,12 C12/m1 0.6181,0.6130,0.6117,90,118.94,90 - - 5.22 X 22423
Ca-Ga Ca0.96 Ga2.26 Ca0.96 Ga2.24 ,hP9,191 P6/mmm 0.4319,0.4319,0.4329,90,90,120 - - 4.66 X 22423
Ca-Ga Ca11 Ga7 Ca11 Ga7,cF144,225 Fm-3m 1.6109,1.6109,1.6109,90,90,90 - - 2.95 X 23038
Ca-Ga Ca28 Ga11 Ca28 Ga11,oI78,44 Imm2 0.5324,6.1445,0.7488,90,90,90 - - 2.56 X 18816
Ca-Ga Ca3Ga5 Ca3Ga5,oS32,63 Cmcm 0.4463,1.0799,1.5025,90,90,90 - - 4.30 X 19706
Ca-Ga Ca3Ga8 Eu3Ga8,oI22,71 Immm 0.4323,0.4323,2.5843,90,90,90 - - 4.66 A 22002
Ca-Ga Ca5Ga3 Cr5B3,tI32,140 I4/mcm 0.7954,0.7954,1.5084,90,90,90 - - 2.85 A 11624
Ca-Ge CaGe TlI,oS8,63 Cmcm 0.4575,1.0845,0.4001,90,90,90 CrB(TlI)-FeB gray silver 3.77 X 715
Ca-Ge CaGe2 hex (Li0.1 Ca0.9)(Li0.03 Ge0.97)2,hP6,186 P63mc 0.39966,0.39966,1.0211,90,90,120 - - 4.36 X 48946
Ca-Ge CaGe2 rhom CaSi2,hR18,166 R-3m 0.39872,0.39872,3.0583,90,90,120 - - 4.38 X 48946
Ca-Ge CaGe3 YbSi3,tI32,139 I4/mmm 0.7692,0.7692,1.13314,90,90,90 - - 5.11 X 58332
Ca-Ge Ca2Ge Co2Si-b,oP12,62 Pnma 0.7734,0.4834,0.9069,90,90,90 - - 2.99 X 713
Ca-Ge Ca2.91 Ge0.09 Ti2C,cF48,227 Fd-3m 1.019,1.019,1.019,90,90,90 - - 3.09 X 2031
Ca-Ge Ca5Ge 3 Cr5B3,tI32,140 I4/mcm 0.77156,0.77156,1.4885,90,90,90 - - 3.13 X 39140
Ca-Ge Ca7Ge CuPt7,cF32,225 Fm-3m 0.945,0.945,0.945,90,90,90 close-packed structure - 2.78 X 2031
Ca-Ge Ca7Ge 6 rt Ca7Sn6,oP52,62 Pnma 0.7375,2.2362,0.812,90,90,90 - - 3.55 X 40243
Ca-H CaH2 hp Co1.75 Ge,hP6,194 P63/mmc 0.3571,0.3571,0.4667,90,90,120 AlB2 family - 2.71 X 49329
Ca-H CaH2 PbCl2,oP12,62 Pnma 0.59696,0.36022,0.68336,90,90,90 - white light 1.90 X 54446
Ca-Hg CaHg CsCl,cP2,221 Pm-3m 0.3759,0.3759,0.3759,90,90,90 b.c.c. family - 7.52 X 7485
Ca-Hg CaHg11 BaHg11,cP36,221 Pm-3m 0.96,0.96,0.96,90,90,90 - - 12.65 X 11414
Ca-Hg CaHg2 Cd2Ce,hP3,164 P-3m1 0.49,0.49,0.357,90,90,120 AlB2 family - 9.87 A 27411
Ca-Hg CaHg3 Mg3 Cd,hP8,194 P63/mmc 0.6635,0.6635,0.502,90,90,120 close-packed structure - 11.14 A 7485
Ca-Hg Ca10.9 Hg54.1 Ca9(Ca0.95 Hg0.05 )2Hg54,hP65,174 P-6 1.3389,1.3389,0.9615,90,90,120 - - 12.56 X 50397
Ca-Hg Ca2Hg Co2Si-b,oP12,62 Pnma 0.786,0.489,0.987,90,90,90 - - 4.92 A 7485
Ca-Hg Ca3Hg cub Cu3Au,cP4,221 Pm-3m 0.492,0.492,0.492,90,90,90 close-packed structure gray silver 4.47 X 24511
Ca-Hg Ca3Hg orth Fe3C-b,oP16,62 Pnma 0.8161,1.015,0.6828,90,90,90 - - 3.77 A 7485
Ca-Hg Ca3Hg2 U3Si2,tP10,127 P4/mbm 0.8476,0.8476,0.4197,90,90,90 - - 5.74 A 7485
Ca-Hg Ca4Hg9 Cu9Al4,cP52,215 P-43m 1.113,1.113,1.113,90,90,90 γ-brass - 9.47 A 13877
Ca-Hg Ca5Hg3 Cr5B3,tI32,140 I4/mcm 0.8189,0.8189,1.4701,90,90,90 - gray silver 5.40 X 29534
Ca-I CaI2 CdI2 ,hP3,164 P-3m1 0.448,0.448,0.696,90,90,120 CdI2-PbI2 polytype white 4.03 X 68
Ca-In CaIn PuGa,tI16,139 I4/mmm 0.737,0.737,0.8401,90,90,90 b.c.c. family gray silver 4.51 X 45726
Ca-In CaIn2 CaIn2,hP6,194 P63/mmc 0.4892,0.4892,0.7739,90,90,120 AlB2 family gray silver 5.58 X 45726
Ca-In Ca2In Co2Si-b,oP12,62 Pnma 0.7275,0.5371,0.999,90,90,90 - gray silver 3.32 X 44112
Ca-In Ca8In3 Ca8In3,aP22,2 P-1 0.9606,0.9712,0.9782,99.01,101.15,119.60 - - 2.97 X 20993
Ca-Ir CaIr2 MgCu2,cF24,227 Fd-3m 0.7545,0.7545,0.7545,90,90,90 Friauf-Laves phase - 13.13 X 938
Ca-Ir Ca5Ir Ca5Ir,oP24,62 Pnma 0.7656,1.5917,0.6793,90,90,90 - - 3.15 X 48617
Ca-Li Li2Ca cub MgCu2,cF24,227 Fd-3m 0.8856,0.8856,0.8856,90,90,90 Friauf-Laves phase - 1.03 X 42342
Ca-Li Li2Ca hex MgZn2,hP12,194 P63/mmc 0.6268,0.6268,1.0219,90,90,120 Friauf-Laves phase gray silver 1.03 X 27419
Ca-Mg CaMg2 MgZn2,hP12,194 P63/mmc 0.62613,0.62613,1.0157,90,90,120 Friauf-Laves phase gray silver 1.71 X 41507
Ca-Mn Ca0.03 Mn0.97 rt Mn,cI58,217 I-43m 0.895,0.895,0.895,90,90,90 - - 7.32 X 7746
Ca-N Ca[N2] CaC2,tI6,139 I4/mmm 0.35747,0.35747,0.59844,90,90,90 - - 2.96 X 58275
Ca-N Ca[N3]2 Sr[N3]2,oF56,70 Fddd 0.5954,1.1036,1.1331,90,90,90 - colorless 2.21 X 42494
Ca-N Ca11 N8 Ca11 N8,tP38,136 P42/mnm 1.445,1.445,0.360,90,90,90 - red brown 2.44 X 4396
Ca-N Ca2N CdCl2,hR9,166 R-3m 0.36271,0.36271,1.8972,90,90,120 - red dark 2.17 X 38441
Ca-N Ca3N2 hp1 Sm2 O3,mS30,12 C12/m1 1.4095,0.3651,0.891,90,98.252,90 - - 3.26 X 54827
Ca-N Ca3N2 hp2 Ni2Al3,hP5,164 P-3m1 0.3938,0.3938,0.4921,90,90,120 - - 3.73 X 54827
Ca-N Ca3N2 ht (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.14786,1.14786,1.14786,90,90,90 - brown 2.60 X 39530
Ca-N Ca3N2 m orth *,oP40,* - 0.358,1.156,1.782,90,90,90 - yellow - N 4244
Ca-N Ca3N2 m rhom Al2O3,hR30,167 R-3c 0.61988,0.61988,1.66296,90,90,120 - - 2.67 X 51938
Ca-N Ca4N3 Th3P 4,cI28,220 I-43d 0.77212,0.77212,0.77212,90,90,90 - red dark 2.92 X 56449
Ca-Ni CaNi2 MgCu2,cF24,227 Fd-3m 0.7251,0.7251,0.7251,90,90,90 Friauf-Laves phase - 5.49 X 13569
Ca-Ni CaNi3 PuNi3,hR36,166 R-3m 0.50522,0.50522,2.4451,90,90,120 Laves-CaCu5 - 5.98 A 37340
Ca-Ni CaNi5 CaCu5,hP6,191 P6/mmm 0.49735,0.49735,0.3958,90,90,120 - - 6.53 X 34600
Ca-Ni Ca2Ni7 Gd2Co 7,hR54,166 R-3m 0.5009,0.5009,3.606,90,90,120 Laves-CaCu5 - 6.24 A 8307
Ca-O CaO NaCl,cF8,225 Fm-3m 0.48171,0.48171,0.48171,90,90,90 lime colorless 3.33 X 56868
Ca-O Ca[O2] CaC2,tI6,139 I4/mmm 0.35426,0.35426,0.592,90,90,90 - - 3.22 X 207
Ca-P CaP 3 CaP 3,aP8,2 P-1 0.5590,0.5618,0.5665,69.96,79.49,74.78 - black 2.75 X 7717
Ca-P Ca2P 2 Na2[O2],hP12,189 P-62m 0.7633,0.7633,0.5733,90,90,120 - black 2.45 X 32602
Ca-P Ca5P 8 Ca5P 8,mS26,12 C12/m1 0.6899,1.1883,0.7484,90,108.25,90 - brown red 2.55 X 29503
Ca-Pb CaPb CuAu,tP2,123 P4/mmm 0.362,0.362,0.4491,90,90,90 close-packed structure - 6.98 X 9914
Ca-Pb CaPb3 Cu3Au,cP4,221 Pm-3m 0.49,0.49,0.49,90,90,90 close-packed structure - 9.34 X 7542
Ca-Pb Ca2Pb Co2Si-b,oP12,62 Pnma 0.8072,0.51,0.9647,90,90,90 - - 4.81 X 1539
Ca-Pb Ca3Pb Cu3Au,cP4,221 Pm-3m 0.4853,0.4853,0.4853,90,90,90 close-packed structure - 4.76 X 2031
Ca-Pb Ca5Pb3 Ca5Pb3,hP48,186 P63mc 1.623,1.623,0.704,90,90,120 - - 5.10 X 2031
Ca-Pd CaPd CsCl,cP2,221 Pm-3m 0.3516,0.3516,0.3516,90,90,90 b.c.c. family - 5.60 X 59029
Ca-Pd CaPd2 MgCu2,cF24,227 Fd-3m 0.7652,0.7652,0.7652,90,90,90 Friauf-Laves phase - 7.50 X 15263
Ca-Pd CaPd5 CaCu5,hP6,191 P6/mmm 0.5147,0.5147,0.4224,90,90,120 - - 9.80 X 24051
Ca-Pd Ca3Pd Fe3C-b,oP16,62 Pnma 0.7699,0.9937,0.6691,90,90,90 - - 2.94 A 15263
Ca-Pd Ca3Pd2 Er3Ni2,hR45,148 R-3 0.8939,0.8939,1.69,90,90,120 - - 4.26 A 15263
Ca-Pd Ca5Pd2 Mn5 C2,mS28,15 C12/c1 1.6694,0.6708,0.7704,90,97.3,90 - - 3.21 A 15263
Ca-Po CaPo NaCl,cF8,225 Fm-3m 0.6514,0.6514,0.6514,90,90,90 rocksalt family gray 5.99 X 1261
Ca-Pt CaPt2 MgCu2,cF24,227 Fd-3m 0.7629,0.7629,0.7629,90,90,90 Friauf-Laves phase - 12.87 X 938
52 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-Pt CaPt5 CaCu5,hP6,191 P6/mmm 0.5322,0.5322,0.4368,90,90,120 - - 15.74 X 1780


Ca-Pt Ca3Pt2 Er3Ni2,hR45,148 R-3 0.8786,0.8786,1.6786,90,90,120 - - 6.80 A 14268
Ca-Pt Ca5Pt2 Mn5C2,mS28,15 C12/c1 1.6154,0.6627,0.7662,90,97.47,90 - - 4.82 A 14268
Ca-Pt Ca5Pt3 W5Si3,tI32,140 I4/mcm 1.1563,1.1563,0.5753,90,90,90 - - 6.78 A 14268
Ca-Rh CaRh2 MgCu2,cF24,227 Fd-3m 0.7525,0.7525,0.7525,90,90,90 Friauf-Laves phase - 7.67 X 938
Ca-Rh Ca5Rh Ca5Ir,oP24,62 Pnma 0.7569,1.6067,0.6725,90,90,90 - - 2.46 A 48617
Ca-S CaS NaCl,cF8,225 Fm-3m 0.569,0.569,0.569,90,90,90 oldhamite gray 2.60 X 26024
Ca-Sb CaSb2 CaSb2,mP6,11 P121/m1 0.4746,0.4177,0.89913,90,104.14,90 - gray 5.45 X 10246
Ca-Sb Ca11Sb10 Ho11Ge10,tI84,139 I4/mmm 1.194,1.194,1.74,90,90,90 - gray 4.44 X 10304
Ca-Sb Ca16Sb11 Ca16Sb11,tP56,113 P-42 1m 1.2253,1.2253,1.1313,90,90,90 - - 3.87 X 33066
Ca-Sb Ca2Sb (O) La2Sb,tI12,139 I4/mmm 0.467,0.467,1.628,90,90,90 - red 3.78 X 8665
Ca-Sb Ca5Sb3 (H) Yb5Sb3,oP32,62 Pnma 1.2502,0.9512,0.8287,90,90,90 - black 3.81 X 7892
Ca-Sb Ca5Sb3 rt Mn5Si3,hP16,193 P63 /mcm 0.90312,0.90312,0.70254,90,90,120 - - 3.79 X 46240
Ca-Se CaSe rt NaCl,cF8,225 Fm-3m 0.5916,0.5916,0.5916,90,90,90 rocksalt family gray 3.82 X 29362
Ca-Si CaSi TlI,oS8,63 Cmcm 0.45594,1.0731,0.389,90,90,90 CrB(TlI)-FeB gray silver 2.38 X 32497
Ca-Si CaSi2 3-lay CaSi2,hR9,166 R-3m 0.38295,0.38295,1.5904,90,90,120 - gray 2.37 X 35287
Ca-Si CaSi2 6-lay CaSi2,hR18,166 R-3m 0.3855,0.3855,3.06,90,90,120 - gray 2.44 X 12522
Ca-Si CaSi2 hp-ht ThSi2,tI12,141 I41/amd 0.4283,0.4283,1.353,90,90,90 - brown red 2.58 X 15756
Ca-Si CaSi3 YbSi3,tI32,139 I4/mmm 0.72676,0.72676,1.13501,90,90,90 - - 2.76 X 58432
Ca-Si Ca14Si19 ht Ca14Si19,hR198,167 R-3c 0.86785,0.86785,6.8528,90,90,120 - gray 2.44 X 32465
Ca-Si Ca2Si Co2Si-b,oP12,62 Pnma 0.7691,0.48174,0.90477,90,90,90 - gray silver 2.14 X 48201
Ca-Si Ca3Si4 rt Ca3Si4,hP42,176 P63 /m 0.8541,0.8541,1.4906,90,90,120 - - 2.46 X 37140
Ca-Si Ca5Si3 Cr5B3,tI32,140 I4/mcm 0.76495,0.76495,1.4835,90,90,90 - - 2.18 X 39140
Ca-Sn CaSn TlI,oS8,63 Cmcm 0.4821,1.152,0.4349,90,90,90 CrB(TlI)-FeB gray white 4.37 X 715
Ca-Sn CaSn3 Cu3Au,cP4,221 Pm-3m 0.4741,0.4741,0.4741,90,90,90 close-packed structure - 6.17 X 37420
Ca-Sn Ca0.15 Sn0.85 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3151,0.3151,0.2994,90,90,120 - - 6.90 X 2985
Ca-Sn Ca2Sn PbCl2,oP12,62 Pnma 0.7992,0.5037,0.9554,90,90,90 - - 3.43 A 37420
Ca-Sn Ca31Sn20 Pu31Pt20,tI204,140 I4/mcm 1.25267,1.25267,3.9912,90,90,90 - black 3.84 X 27308
Ca-Sn Ca36Sn23 Yb36Sn23,tP118,127 P4/mbm 1.2499,1.2499,2.2883,90,90,90 - - 3.88 X 37420
Ca-Sn Ca5Sn3 rt Cr5B3,tI32,140 I4/mcm 0.8117,0.8117,1.5429,90,90,90 - - 3.64 A 37420
Ca-Sn Ca7Sn6 Ca7Sn6,oP52,62 Pnma 0.7867,2.3818,0.8465,90,90,90 - - 4.16 X 37420
Ca-Sr Sr0.5 Ca0.5 ht W,cI2,229 Im-3m 0.475,0.475,0.475,90,90,90 b.c.c. family - 1.98 X 989
Ca-Sr Sr0.5 Ca0.5 rt Cu,cF4,225 Fm-3m 0.586,0.586,0.586,90,90,90 close-packed structure - 2.11 X 989
Ca-Sr Sr0.5 Ca0.5 stab Mg,hP2,194 P63 /mmc 0.416,0.416,0.679,90,90,120 close-packed structure - 2.08 X 989
Ca-Te CaTe hp CsCl,cP2,221 Pm-3m 0.3388,0.3388,0.3388,90,90,90 b.c.c. family - 7.16 X 18416
Ca-Te CaTe rt NaCl,cF8,225 Fm-3m 0.6348,0.6348,0.6348,90,90,90 rocksalt family - 4.35 X 29362
Ca-Tl CaTl CsCl,cP2,221 Pm-3m 0.3855,0.3855,0.3855,90,90,90 b.c.c. family - 7.09 X 2996
Ca-Tl CaTl3 Cu3Au,cP4,221 Pm-3m 0.4803,0.4803,0.4803,90,90,90 close-packed structure - 9.79 X 2996
Ca-Tl Ca3Tl BiF3,cF16,225 Fm-3m 0.785,0.785,0.785,90,90,90 b.c.c. family - 4.46 X 2996
Ca-Tl Ca3Tl5 Pu3Pd5,oS32,63 Cmcm 1.0231,0.8362,1.0623,90,90,90 - - 8.35 X 53439
Ca-Zn CaZn TlI,oS8,63 Cmcm 0.4202,1.161,0.4442,90,90,90 CrB(TlI)-FeB - 3.23 X 14269
Ca-Zn CaZn11 BaCd11,tI48,141 I41/amd 1.06811,1.06811,0.68281,90,90,90 - gray silver 6.47 X 49745
Ca-Zn CaZn13 NaZn13,cF112,226 Fm-3c 1.21543,1.21543,1.21543,90,90,90 - - 6.59 X 46673
Ca-Zn CaZn2 hp MgZn2,hP12,194 P63 /mmc 0.56363,0.56363,0.8994,90,90,120 Friauf-Laves phase - 4.59 X 50985
Ca-Zn CaZn2 KHg2,oI12,74 Imma 0.4585,0.73662,0.76653,90,90,90 AlB2 family gray silver 4.38 X 50917
Ca-Zn CaZn5 CaCu5,hP6,191 P6/mmm 0.53899,0.53899,0.42456,90,90,120 - gray silver 5.71 X 49745
Ca-Zn Ca3Zn Re3B,oS16,63 Cmcm 0.415,1.3258,1.0186,90,90,90 - - 2.20 X 14269
Ca-Zn Ca3.33 Zn10.11 Ca3.33 Zn10.11 ,hP32,194 P63 /mmc 0.9168,0.9168,0.7327,90,90,120 - - 4.95 X 12975
Ca-Zn Ca5Zn3 Cr5B3,tI32,140 I4/mcm 0.7962,0.7962,1.54,90,90,90 - gray silver 2.70 X 27464
Cd-Ce CdCe lt1 CuTi,tP2,123 P4/mmm 0.382,0.382,0.389,90,90,90 b.c.c. family - 7.39 X 21588
Cd-Ce CdCe rt CsCl,cP2,221 Pm-3m 0.3855,0.3855,0.3855,90,90,90 b.c.c. family - 7.32 X 21588
Cd-Ce Cd11Ce BaHg11,cP36,221 Pm-3m 0.93228,0.93228,0.93228,90,90,90 - - 8.46 X 55070
Cd-Ce Cd17Ce2 ht Th2Ni17,hP38,194 P63 /mmc 1.0012,1.0012,0.9815,90,90,120 CaCu5-Zr4Al3 - 8.54 A 18309
Cd-Ce Cd2Ce Cd2Ce,hP3,164 P-3m1 0.5073,0.5073,0.3450,90,90,120 AlB2 family - 7.88 X 612
Cd-Ce Cd3Ce BiF3,cF16,225 Fm-3m 0.7223,0.7223,0.7223,90,90,90 b.c.c. family - 8.41 X 22369
Cd-Ce Cd37Ce6 Cd37Ce6,cP188,201 Pn-3 1.5808,1.5808,1.5808,90,90,90 - gray silver 8.41 X 37381
Cd-Ce Cd58Ce13 Zn58Gd13,hP142,194 P63 /mmc 1.577,1.577,1.557,90,90,120 - - 8.26 X 7472
Cd-Ce Cd58.68 Ce12.60 Cd58.68 Ce12.60 ,oS368,63 Cmcm 1.57592,2.72789,1.55816,90,90,90 - - 8.29 X 50385
Cd-Cl CdCl2 CdCl2,hR9,166 R-3m 0.38459,0.38459,1.74931,90,90,120 - - 4.08 X 25117
Cd-Cs CsCd13 NaZn13,cF112,226 Fm-3c 1.392,1.392,1.392,90,90,90 - - 7.85 X 46673
Cd-Cu Cu0.975 Cd0.025 Cu,cF4,225 Fm-3m 0.3632,0.3632,0.3632,90,90,90 close-packed structure - 8.98 X 16521
Cd-Cu Cu1.5 Cd5 Co2Al5,hP28,194 P63 /mmc 0.8118,0.8118,0.8751,90,90,120 - - 8.74 X 15732
Cd-Cu Cu160Cd121 Cu136(Cu0.5 Cd0.5 )48Cd97,cF1124,216 F-43m 2.5871,2.5871,2.5871,90,90,90 - - 9.12 X 3377
Cd-Cu Cu2Cd MgZn2,hP12,194 P63 /mmc 0.496,0.496,0.799,90,90,120 Friauf-Laves phase - 9.35 X 438
Cd-Cu Cu5Cd8 Cu5Zn8,cI52,217 I-43m 0.9615,0.9615,0.9615,90,90,90 γ-brass - 9.09 X 7911
Cd-Dy CdDy rt CsCl,cP2,221 Pm-3m 0.3714,0.3714,0.3714,90,90,90 b.c.c. family gray silver 8.91 X 18569
Cd-Dy Cd2Dy Cd2Ce,hP3,164 P-3m1 0.491,0.491,0.3442,90,90,120 AlB2 family - 8.95 X 4094
Cd-Dy Cd3Dy Cd3Er,oS16,63 Cmcm 0.7052,1.0828,0.4833,90,90,90 close-packed structure - 8.99 X 7472
Cd-Dy Cd45Dy11 Cd45Sm11,cF448,216 F-43m 2.1512,2.1512,2.1512,90,90,90 Nasicon family - 9.14 A 7472
Cd-Dy Cd6Dy Cd6Y,cI184,204 Im-3 1.5491,1.5491,1.5491,90,90,90 - - 8.97 X 59028
Cd-Er CdEr CsCl,cP2,221 Pm-3m 0.3681,0.3681,0.3681,90,90,90 b.c.c. family gray silver 9.31 X 8311
Cd-Er Cd2Er Cd2Ce,hP3,164 P-3m1 0.4856,0.4856,0.3425,90,90,120 AlB2 family - 9.31 X 3053
Cd-Er Cd3Er Cd3Er,oS16,63 Cmcm 0.7094,1.0678,0.4804,90,90,90 close-packed structure - 9.21 X 6455
Cd-Er Cd45Er11 Cd45Sm11,cF448,216 F-43m 2.145,2.145,2.145,90,90,90 Nasicon family - 9.29 A 7472
Cd-Er Cd6Er Cd6Y,cI184,204 Im-3 1.5399,1.5399,1.5399,90,90,90 - - 9.19 X 47785
Cd-Eu Cd0.9 Eu1.1 CsCl,cP2,221 Pm-3m 0.3955,0.3955,0.3955,90,90,90 b.c.c. family gray silver 7.20 X 10886
Cd-Eu Cd11Eu BaCd11,tI48,141 I41/amd 1.191,1.191,0.765,90,90,90 - - 8.50 X 2861
Cd-Eu Cd2Eu KHg2,oI12,74 Imma 0.5053,0.792,0.8447,90,90,90 AlB2 family - 7.40 X 2861
Handbook of Inorganic Substances – Edition 2015 : Data 53

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cd-Eu Cd25 Eu4 Cd25 Eu4,cF1456,203 Fd-3 3.18718,3.18718,3.18718,90,90,90 - - 8.42 X 42769


Cd-Eu Cd51 Eu14 Ag51 Gd14,hP68,175 P6/m 1.361,1.361,0.983,90,90,120 - - 8.28 A 6032
Cd-Eu Cd58 Eu13 Zn58 Gd13,hP142,194 P63/mmc 1.597,1.597,1.585,90,90,120 - - 8.06 X 7472
Cd-F CdF2 hp1 PbCl2,oP12,62 Pnma 0.553,0.3444,0.6722,90,90,90 - - 7.80 X 57286
Cd-F CdF2 CaF2 ,cF12,225 Fm-3m 0.5393,0.5393,0.5393,90,90,90 fluorite family - 6.37 X 43591
Cd-Gd CdGd rt CsCl,cP2,221 Pm-3m 0.375,0.375,0.375,90,90,90 b.c.c. family - 8.49 X 20291
Cd-Gd Cd0.15 Gd0.85 ht W,cI2,229 Im-3m 0.3965,0.3965,0.3965,90,90,90 b.c.c. family - 8.02 X 6029
Cd-Gd Cd2Gd rt Cd2Ce,hP3,164 P-3m1 0.4942,0.4942,0.3469,90,90,120 AlB2 family - 8.65 X 4094
Cd-Gd Cd3Gd Mg3 Cd,hP8,194 P63/mmc 0.6621,0.6621,0.4933,90,90,120 close-packed structure - 8.77 X 6029
Cd-Gd Cd45 Gd11 Cd45 Sm11,cF448,216 F-43m 2.1603,2.1603,2.1603,90,90,90 Nasicon family - 8.94 A 6029
Cd-Gd Cd58 Gd13 Zn58 Gd13,hP142,194 P63/mmc 1.54,1.54,1.528,90,90,120 - - 9.06 X 6029
Cd-Gd Cd6Gd Cd6Y,cI184,204 Im-3 1.5536,1.5536,1.5536,90,90,90 - - 8.84 A 59028
Cd-Hf CdHf CdTi,tP4,129 P4/nmm 0.312,0.312,0.867,90,90,90 close-packed structure - 11.45 A 2862
Cd-Hf CdHf2 CuZr2,tI6,139 I4/mmm 0.328,0.328,1.199,90,90,90 close-packed structure - 12.09 A 2862
Cd-Hg CdHg2 lt MoSi2,tI6,139 I4/mmm 0.3965,0.3965,0.8607,90,90,90 b.c.c. family - 12.61 X 2984
Cd-Hg Cd0.55 Hg0.45 rt Pa,tI2,139 I4/mmm 0.3928,0.3928,0.2884,90,90,90 b.c.c. family - 11.35 X 12464
Cd-Hg Cd0.863 Hg0.137 Mg,hP2,194 P63/mmc 0.29732,0.29732,0.56635,90,90,120 close-packed structure - 9.54 X 6950
Cd-Hg Cd2Hg lt MoSi2,tI6,139 I4/mmm 0.3915,0.3915,0.86355,90,90,90 b.c.c. family - 10.67 X 12464
Cd-Ho CdHo CsCl,cP2,221 Pm-3m 0.3701,0.3701,0.3701,90,90,90 b.c.c. family gray silver 9.08 X 8311
Cd-Ho Cd2Ho Cd2Ce,hP3,164 P-3m1 0.4895,0.4895,0.3433,90,90,120 AlB2 family - 9.09 A 3053
Cd-Ho Cd3Ho Cd3Er,oS16,63 Cmcm 0.7077,1.0765,0.4818,90,90,90 close-packed structure - 9.09 X 7472
Cd-Ho Cd45 Ho11 Cd45 Sm11,cF448,216 F-43m 2.1478,2.1478,2.1478,90,90,90 Nasicon family - 9.22 A 7472
Cd-Ho Cd6Ho Cd6Y,cI184,204 Im-3 1.5332,1.5332,1.5332,90,90,90 - - 9.28 X 47785
Cd-I CdI2 102R1 CdI2 -a,hR153,160 R3m 0.424,0.424,34.8585,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 102R2 CdI2 -b,hR153,160 R3m 0.424,0.424,34.8585,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 108R1 CdI2 -a,hR162,160 R3m 0.424,0.424,36.909,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 108R2 CdI2 -b,hR162,160 R3m 0.424,0.424,36.909,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 10H1 CdI2 -a,hP15,156 P3m1 0.424,0.424,3.4175,90,90,120 CdI2-PbI2 polytype - 5.71 X 828
Cd-I CdI2 10H2 CdI2 -b,hP15,164 P-3m1 0.424,0.424,3.418,90,90,120 CdI2-PbI2 polytype - 5.71 X 9463
Cd-I CdI2 10H3 CdI2 -d,hP15,156 P3m1 0.424,0.424,3.4175,90,90,120 CdI2-PbI2 polytype - 5.71 X 17656
Cd-I CdI2 10H4 PbI2 -a,hP15,156 P3m1 0.424,0.424,3.4175,90,90,120 CdI2-PbI2 polytype - 5.71 X 17656
Cd-I CdI2 10H5 CdI2 -e,hP15,164 P-3m1 0.424,0.424,3.4175,90,90,120 CdI2-PbI2 polytype - 5.71 X 17656
Cd-I CdI2 10H6 CdI2 -f,hP15,156 P3m1 0.424,0.424,3.4175,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 120R1 CdI2 -a,hR180,160 R3m 0.424,0.424,41.01,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 120R2 CdI2 -b,hR180,160 R3m 0.424,0.424,41.01,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 12H1 CdI2 -a,hP18,156 P3m1 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 828
Cd-I CdI2 12H10 CdI2 -j,hP18,156 P3m1 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 12H2 CdI2 -b,hP18,156 P3m1 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 828
Cd-I CdI2 12H3 CdI2 -c,hP18,156 P3m1 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 828
Cd-I CdI2 12H4 CdI2 -d,hP18,156 P3m1 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 6358
Cd-I CdI2 12H5 CdI2 -a,hP18,164 P-3m1 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 6358
Cd-I CdI2 12H6 CdI2 -b,hP18,164 P-3m1 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 8652
Cd-I CdI2 12H7 CdI2 -g,hP18,156 P3m1 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 17656
Cd-I CdI2 12H8 CdI2 -h,hP18,156 P3m1 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 17656
Cd-I CdI2 12H9 CdI2 -c,hP18,164 P-3m1 0.424,0.424,4.1004,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 12R PbI2 ,hR18,166 R-3m 0.424,0.424,4.101,90,90,120 CdI2-PbI2 polytype - 5.71 X 3862
Cd-I CdI2 14H1 CdI2 -a,hP21,156 P3m1 0.424,0.424,4.7845,90,90,120 CdI2-PbI2 polytype - 5.71 X 828
Cd-I CdI2 14H2 CdI2 -b,hP21,156 P3m1 0.424,0.424,4.7845,90,90,120 CdI2-PbI2 polytype - 5.71 X 5685
Cd-I CdI2 14H3 CdI2 -c,hP21,156 P3m1 0.424,0.424,4.786,90,90,120 CdI2-PbI2 polytype - 5.71 X 8652
Cd-I CdI2 14H4 CdI2 -d,hP21,156 P3m1 0.424,0.424,4.785,90,90,120 CdI2-PbI2 polytype - 5.71 X 9463
Cd-I CdI2 14H5 CdI2 -e,hP21,156 P3m1 0.424,0.424,4.785,90,90,120 CdI2-PbI2 polytype - 5.71 X 11245
Cd-I CdI2 14H6 PbI2 ,hP21,156 P3m1 0.424,0.424,4.785,90,90,120 CdI2-PbI2 polytype - 5.71 X 14965
Cd-I CdI2 14H7 CdI2 -g,hP21,156 P3m1 0.424,0.424,4.7845,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 14H8 CdI2 -h,hP21,156 P3m1 0.424,0.424,4.7845,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 14H9 CdI2 -i,hP21,156 P3m1 0.424,0.424,4.784,90,90,120 CdI2-PbI2 polytype - 5.72 X 17655
Cd-I CdI2 16H1 CdI2 -a,hP24,156 P3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 5685
Cd-I CdI2 16H10 CdI2 -j,hP24,156 P3m1 0.424,0.424,5.568,90,90,120 CdI2-PbI2 polytype - 5.61 X 15876
Cd-I CdI2 16H11 CdI2 -k,hP24,156 P3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 16H12 CdI2 -l,hP24,156 P3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 16872
Cd-I CdI2 16H2 CdI2 -b,hP24,156 P3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 5685
Cd-I CdI2 16H3 CdI2 -c,hP24,156 P3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 5685
Cd-I CdI2 16H4 CdI2 -d,hP24,156 P3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 7130
Cd-I CdI2 16H5 CdI2 ,hP24,164 P-3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 8652
Cd-I CdI2 16H6 CdI2 -f,hP24,156 P3m1 0.424,0.424,5.46,90,90,120 CdI2-PbI2 polytype - 5.72 X 9462
Cd-I CdI2 16H7 CdI2 -g,hP24,156 P3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 9465
Cd-I CdI2 16H8 CdI2 ,hP24,186 P63mc 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 11245
Cd-I CdI2 16H8b CdI2 -h,hP24,156 P3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 16H9 CdI2 -i,hP24,156 P3m1 0.424,0.424,5.468,90,90,120 CdI2-PbI2 polytype - 5.71 X 14966
Cd-I CdI2 18H1 CdI2 -a,hP27,156 P3m1 0.424,0.424,6.1515,90,90,120 CdI2-PbI2 polytype - 5.71 X 4330
Cd-I CdI2 18H10 CdI2 -j,hP27,156 P3m1 0.424,0.424,6.1515,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 18H11 CdI2 -k,hP27,156 P3m1 0.424,0.424,6.1515,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 18H12 CdI2 -l,hP27,156 P3m1 0.424,0.424,6.1515,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 18H13 CdI2 -m,hP27,156 P3m1 0.424,0.424,6.1515,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 18H2 CdI2 -c,hP27,156 P3m1 0.424,0.424,6.1515,90,90,120 CdI2-PbI2 polytype - 5.71 X 4991
Cd-I CdI2 18H3 CdI2 ,hP27,164 P-3m1 0.424,0.424,6.1515,90,90,120 CdI2-PbI2 polytype - 5.71 X 6363
Cd-I CdI2 18H4 CdI2 -d,hP27,156 P3m1 0.424,0.424,6.152,90,90,120 CdI2-PbI2 polytype - 5.71 X 7130
Cd-I CdI2 18H5 CdI2 -e,hP27,156 P3m1 0.424,0.424,6.152,90,90,120 CdI2-PbI2 polytype - 5.71 X 9463
Cd-I CdI2 18H6 CdI2 -f,hP27,156 P3m1 0.424,0.424,6.1515,90,90,120 CdI2-PbI2 polytype - 5.71 X 10319
54 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cd-I CdI2 18H6b CdI2-x,hP27,156 P3m1 0.424,0.424,6.152,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11246
Cd-I CdI2 18H7 CdI2-g,hP27,156 P3m1 0.424,0.424,6.152,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15876
Cd-I CdI2 18H8 CdI2-h,hP27,156 P3m1 0.424,0.424,6.1515,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15803
Cd-I CdI2 18H9 CdI2-i,hP27,156 P3m1 0.424,0.424,6.1515,90,90,120 CdI2 -PbI2 polytype - 5.71 X 16871
Cd-I CdI2 18R1 CdI2,hR27,166 R-3m 0.424,0.424,6.152,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11245
Cd-I CdI2 20H1 CdI2-a,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 4999
Cd-I CdI2 20H10 CdI2-j,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11245
Cd-I CdI2 20H11 CdI2-k,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11245
Cd-I CdI2 20H12 CdI2-l,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15865
Cd-I CdI2 20H13 CdI2-m,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15803
Cd-I CdI2 20H14 CdI2-n,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 17656
Cd-I CdI2 20H15 CdI2-o,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 16808
Cd-I CdI2 20H2 CdI2-b,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 4999
Cd-I CdI2 20H3 CdI2-c,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 5685
Cd-I CdI2 20H4 PbI2,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 9464
Cd-I CdI2 20H5 CdI2-e,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 9464
Cd-I CdI2 20H6 CdI2-f,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 9464
Cd-I CdI2 20H7 CdI2-g,hP30,156 P3m1 0.424,0.424,6.84,90,90,120 CdI2 -PbI2 polytype - 5.71 X 10044
Cd-I CdI2 20H7b CdI2-x,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 9937
Cd-I CdI2 20H8 CdI2-h,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 9937
Cd-I CdI2 20H9 CdI2,hP30,156 P3m1 0.424,0.424,6.835,90,90,120 CdI2 -PbI2 polytype - 5.71 X 10319
Cd-I CdI2 22H1 CdI2-a,hP33,156 P3m1 0.424,0.424,7.518,90,90,120 CdI2 -PbI2 polytype - 5.72 X 1796
Cd-I CdI2 22H10 CdI2-j,hP33,156 P3m1 0.424,0.424,7.519,90,90,120 CdI2 -PbI2 polytype - 5.71 X 16872
Cd-I CdI2 22H11 CdI2-k,hP33,156 P3m1 0.424,0.424,7.519,90,90,120 CdI2 -PbI2 polytype - 5.71 X 16872
Cd-I CdI2 22H12 CdI2-l,hP33,156 P3m1 0.424,0.424,7.519,90,90,120 CdI2 -PbI2 polytype - 5.71 X 20867
Cd-I CdI2 22H13 CdI2-m,hP33,156 P3m1 0.424,0.424,7.519,90,90,120 CdI2 -PbI2 polytype - 5.71 X 20867
Cd-I CdI2 22H2 CdI2-b,hP33,156 P3m1 0.424,0.424,7.52,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11246
Cd-I CdI2 22H3 CdI2-c,hP33,156 P3m1 0.424,0.424,7.52,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11246
Cd-I CdI2 22H4 CdI2-d,hP33,156 P3m1 0.424,0.424,7.5174,90,90,120 CdI2 -PbI2 polytype - 5.72 X 14965
Cd-I CdI2 22H5 PbI2,hP33,156 P3m1 0.424,0.424,7.5174,90,90,120 CdI2 -PbI2 polytype - 5.72 X 14965
Cd-I CdI2 22H6 CdI2-f,hP33,156 P3m1 0.424,0.424,7.5185,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15865
Cd-I CdI2 22H7 CdI2-g,hP33,156 P3m1 0.424,0.424,7.5185,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15865
Cd-I CdI2 22H8 CdI2-h,hP33,156 P3m1 0.424,0.424,7.5185,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15865
Cd-I CdI2 22H9 CdI2-i,hP33,156 P3m1 0.424,0.424,7.5185,90,90,120 CdI2 -PbI2 polytype - 5.71 X 16808
Cd-I CdI2 24H1 CdI2,hP36,186 P63 mc 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 3382
Cd-I CdI2 24H10 CdI2-x,hP36,156 P3m1 0.424,0.424,8.2008,90,90,120 CdI2 -PbI2 polytype - 5.72 X 14965
Cd-I CdI2 24H11 CdI2-j,hP36,156 P3m1 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 14966
Cd-I CdI2 24H12 CdI2-k,hP36,156 P3m1 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15876
Cd-I CdI2 24H13 CdI2-l,hP36,156 P3m1 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 17656
Cd-I CdI2 24H2 CdI2-b,hP36,156 P3m1 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 9465
Cd-I CdI2 24H3 CdI2-c,hP36,156 P3m1 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11245
Cd-I CdI2 24H4 CdI2-d,hP36,156 P3m1 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11245
Cd-I CdI2 24H5 CdI2-e,hP36,156 P3m1 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11245
Cd-I CdI2 24H6 CdI2-f,hP36,156 P3m1 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11245
Cd-I CdI2 24H7 CdI2-g,hP36,156 P3m1 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11246
Cd-I CdI2 24H8 CdI2-h,hP36,156 P3m1 0.424,0.424,8.2008,90,90,120 CdI2 -PbI2 polytype - 5.72 X 14965
Cd-I CdI2 24H9 CdI2-i,hP36,156 P3m1 0.424,0.424,8.2008,90,90,120 CdI2 -PbI2 polytype - 5.72 X 14965
Cd-I CdI2 24R1 CdI2,hR36,160 R3m 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 4991
Cd-I CdI2 24R2 CdI2,hR36,166 R-3m 0.424,0.424,8.2,90,90,120 CdI2 -PbI2 polytype - 5.72 X 11245
Cd-I CdI2 24R3 CdI2-c,hR36,166 R-3m 0.424,0.424,8.202,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15865
Cd-I CdI2 26H1 CdI2-a,hP39,156 P3m1 0.424,0.424,8.88,90,90,120 CdI2 -PbI2 polytype - 5.72 X 2599
Cd-I CdI2 26H2 CdI2-b,hP39,156 P3m1 0.424,0.424,8.88,90,90,120 CdI2 -PbI2 polytype - 5.72 X 2599
Cd-I CdI2 26H3 CdI2-c,hP39,156 P3m1 0.424,0.424,8.879,90,90,120 CdI2 -PbI2 polytype - 5.72 X 9462
Cd-I CdI2 26H4 CdI2-d,hP39,156 P3m1 0.424,0.424,8.8842,90,90,120 CdI2 -PbI2 polytype - 5.72 X 14965
Cd-I CdI2 26H5 CdI2-e,hP39,156 P3m1 0.424,0.424,8.8855,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15865
Cd-I CdI2 26H6 CdI2-f,hP39,156 P3m1 0.424,0.424,8.8855,90,90,120 CdI2 -PbI2 polytype - 5.71 X 16871
Cd-I CdI2 28H1 CdI2-a,hP42,156 P3m1 0.424,0.424,9.569,90,90,120 CdI2 -PbI2 polytype - 5.71 X 2086
Cd-I CdI2 28H2 CdI2-b,hP42,156 P3m1 0.424,0.424,9.569,90,90,120 CdI2 -PbI2 polytype - 5.71 X 7130
Cd-I CdI2 28H3 CdI2-c,hP42,156 P3m1 0.424,0.424,9.569,90,90,120 CdI2 -PbI2 polytype - 5.71 X 7130
Cd-I CdI2 28H4 CdI2-d,hP42,156 P3m1 0.424,0.424,9.569,90,90,120 CdI2 -PbI2 polytype - 5.71 X 9465
Cd-I CdI2 28H5 CdI2-e,hP42,156 P3m1 0.424,0.424,9.569,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11246
Cd-I CdI2 28H6 CdI2-f,hP42,156 P3m1 0.424,0.424,9.569,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15865
Cd-I CdI2 28H7 CdI2-g,hP42,156 P3m1 0.424,0.424,9.569,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15803
Cd-I CdI2 28H8 CdI2-h,hP42,156 P3m1 0.424,0.424,9.569,90,90,120 CdI2 -PbI2 polytype - 5.71 X 16871
Cd-I CdI2 2H CdI2,hP3,164 P-3m1 0.424,0.424,0.684,90,90,120 CdI2 -PbI2 polytype yellow 5.71 X 2
Cd-I CdI2 30H1 CdI2-a,hP45,156 P3m1 0.424,0.424,10.252,90,90,120 CdI2 -PbI2 polytype - 5.72 X 4991
Cd-I CdI2 30H2 CdI2-b,hP45,156 P3m1 0.424,0.424,10.252,90,90,120 CdI2 -PbI2 polytype - 5.72 X 9464
Cd-I CdI2 30H3 CdI2-c,hP45,156 P3m1 0.424,0.424,10.252,90,90,120 CdI2 -PbI2 polytype - 5.72 X 9464
Cd-I CdI2 30H4 CdI2-d,hP45,156 P3m1 0.424,0.424,10.252,90,90,120 CdI2 -PbI2 polytype - 5.72 X 9464
Cd-I CdI2 30H5 CdI2-e,hP45,156 P3m1 0.424,0.424,10.252,90,90,120 CdI2 -PbI2 polytype - 5.72 X 11246
Cd-I CdI2 30H6 CdI2-g,hP45,156 P3m1 0.424,0.424,10.254,90,90,120 CdI2 -PbI2 polytype - 5.71 X 15876
Cd-I CdI2 30R1 CdI2-a,hR45,160 R3m 0.424,0.424,10.2525,90,90,120 CdI2 -PbI2 polytype - 5.71 X 3334
Cd-I CdI2 30R2 CdI2-b,hR45,166 R-3m 0.424,0.424,10.253,90,90,120 CdI2 -PbI2 polytype - 5.71 X 11245
Cd-I CdI2 30R3 CdI2-c,hR45,160 R3m 0.424,0.424,10.2525,90,90,120 CdI2 -PbI2 polytype - 5.71 X 17656
Cd-I CdI2 30R4 CdI2-d,hR45,166 R-3m 0.424,0.424,10.2525,90,90,120 CdI2 -PbI2 polytype - 5.71 X 17656
Cd-I CdI2 30R5 PbI2,hR45,166 R-3m 0.424,0.424,10.2525,90,90,120 CdI2 -PbI2 polytype - 5.71 X 16871
Cd-I CdI2 32H1 CdI2-a,hP48,156 P3m1 0.424,0.424,10.797,90,90,120 CdI2 -PbI2 polytype - 5.79 X 5623
Cd-I CdI2 32H2 CdI2-b,hP48,156 P3m1 0.424,0.424,10.9344,90,90,120 CdI2 -PbI2 polytype - 5.72 X 14965
Handbook of Inorganic Substances – Edition 2015 : Data 55

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cd-I CdI2 32H3 CdI2 -c,hP48,156 P3m1 0.424,0.424,10.938,90,90,120 CdI2-PbI2 polytype - 5.71 X 15876
Cd-I CdI2 34H1 CdI2 -a,hP51,156 P3m1 0.424,0.424,11.619,90,90,120 CdI2-PbI2 polytype - 5.72 X 9462
Cd-I CdI2 34H4 CdI2 -d,hP51,156 P3m1 0.424,0.424,11.6178,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 34H5 CdI2 -e,hP51,156 P3m1 0.424,0.424,11.6195,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 34H6 CdI2 -f,hP51,156 P3m1 0.424,0.424,11.6195,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 36H1 CdI2 -a,hP54,156 P3m1 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 7130
Cd-I CdI2 36H2 CdI2 -b,hP54,156 P3m1 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 36H3 CdI2 -c,hP54,156 P3m1 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 36R1 CdI2 -a,hR54,160 R3m 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 4991
Cd-I CdI2 36R2 CdI2 -b,hR54,160 R3m 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 7836
Cd-I CdI2 36R3 CdI2 -c,hR54,160 R3m 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 11246
Cd-I CdI2 36R5 CdI2 -e,hR54,160 R3m 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 36R6 CdI2 -f,hR54,160 R3m 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 36R7 CdI2 -g,hR54,160 R3m 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 36R8 CdI2 -h,hR54,160 R3m 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 36R9 CdI2 -i,hR54,166 R-3m 0.424,0.424,12.303,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 38H1 CdI2 -a,hP57,156 P3m1 0.424,0.424,12.9846,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 38H2 CdI2 -b,hP57,156 P3m1 0.424,0.424,12.9865,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 40H1 CdI2 -a,hP60,156 P3m1 0.424,0.424,13.67,90,90,120 CdI2-PbI2 polytype - 5.71 X 7130
Cd-I CdI2 40H2 CdI2 -b,hP60,156 P3m1 0.424,0.424,13.67,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 40H3 CdI2 -c,hP60,156 P3m1 0.424,0.424,13.67,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 42H1 CdI2 -a,hP63,156 P3m1 0.424,0.424,14.3514,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 42H2 CdI2 -b,hP63,156 P3m1 0.424,0.424,14.3535,90,90,120 CdI2-PbI2 polytype - 5.71 X 17656
Cd-I CdI2 42R1 CdI2 -a,hR63,160 R3m 0.424,0.424,14.3535,90,90,120 CdI2-PbI2 polytype - 5.71 X 3334
Cd-I CdI2 42R2 CdI2 -b,hR63,160 R3m 0.424,0.424,14.3535,90,90,120 CdI2-PbI2 polytype - 5.71 X 17656
Cd-I CdI2 42R3 CdI2 -c,hR63,160 R3m 0.424,0.424,14.3535,90,90,120 CdI2-PbI2 polytype - 5.71 X 16871
Cd-I CdI2 42R4 CdI2 -d,hR63,160 R3m 0.424,0.424,14.3535,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 42R5 CdI2 -e,hR63,160 R3m 0.424,0.424,14.3535,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 42R6 CdI2 -f,hR63,160 R3m 0.424,0.424,14.3535,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 44H1 CdI2 ,hP66,156 P3m1 0.424,0.424,15.037,90,90,120 CdI2-PbI2 polytype - 5.71 X 14966
Cd-I CdI2 48R1 CdI2 -a,hR72,160 R3m 0.424,0.424,16.4016,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 48R2 CdI2 -b,hR72,160 R3m 0.424,0.424,16.404,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 48R3 CdI2 -c,hR72,160 R3m 0.424,0.424,16.404,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 50H1 CdI2 ,hP75,156 P3m1 0.424,0.424,17.085,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 50H3 *,hP75,156 P3m1 0.424,0.424,17.1,90,90,120 - - - N 2495
Cd-I CdI2 54R1 CdI2 -a,hR81,160 R3m 0.424,0.424,18.4518,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 54R2 CdI2 -b,hR81,160 R3m 0.424,0.424,18.4518,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 54R3 CdI2 -c,hR81,160 R3m 0.424,0.424,18.4545,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 58H1 CdI2 ,hP87,156 P3m1 0.424,0.424,19.8186,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 60R CdI2 -a,hR90,160 R3m 0.424,0.424,20.505,90,90,120 CdI2-PbI2 polytype - 5.71 X 5636
Cd-I CdI2 60R2 CdI2 -b,hR90,166 R-3m 0.424,0.424,20.502,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 66R1 CdI2 -a,hR99,160 R3m 0.424,0.424,22.5555,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 66R2 CdI2 -b,hR99,160 R3m 0.424,0.424,22.5555,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 66R3 CdI2 -c,hR99,160 R3m 0.424,0.424,22.5555,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 66R4 CdI2 -d,hR99,160 R3m 0.424,0.424,22.5555,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 66R5 CdI2 -e,hR99,160 R3m 0.424,0.424,22.5555,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 66R6 CdI2 -f,hR99,160 R3m 0.424,0.424,22.5555,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 66R7 CdI2 -g,hR99,160 R3m 0.424,0.424,22.5555,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 6H1 CdI2 ,hP9,156 P3m1 0.424,0.424,2.0505,90,90,120 CdI2-PbI2 polytype - 5.71 X 828
Cd-I CdI2 6H2 CdI2 ,hP9,164 P-3m1 0.424,0.424,2.05,90,90,120 CdI2-PbI2 polytype - 5.72 X 208
Cd-I CdI2 72R1 CdI2 -a,hR108,160 R3m 0.424,0.424,24.606,90,90,120 CdI2-PbI2 polytype - 5.71 X 5636
Cd-I CdI2 72R2 CdI2 -b,hR108,160 R3m 0.424,0.424,24.6024,90,90,120 CdI2-PbI2 polytype - 5.72 X 14965
Cd-I CdI2 72R3 CdI2 -c,hR108,160 R3m 0.424,0.424,24.606,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 78R1 CdI2 -a,hR117,160 R3m 0.424,0.424,26.6565,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 78R2 CdI2 -b,hR117,160 R3m 0.424,0.424,26.6565,90,90,120 CdI2-PbI2 polytype - 5.71 X 17656
Cd-I CdI2 84R1 CdI2 -a,hR126,160 R3m 0.424,0.424,28.707,90,90,120 CdI2-PbI2 polytype - 5.71 X 8312
Cd-I CdI2 84R2 CdI2 -b,hR126,160 R3m 0.424,0.424,28.707,90,90,120 CdI2-PbI2 polytype - 5.71 X 8312
Cd-I CdI2 84R3 CdI2 -c,hR126,160 R3m 0.424,0.424,28.707,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 84R4 CdI2 -d,hR126,160 R3m 0.424,0.424,28.707,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 84R5 CdI2 -e,hR126,160 R3m 0.424,0.424,28.707,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 84R6 CdI2 -f,hR126,160 R3m 0.424,0.424,28.707,90,90,120 CdI2-PbI2 polytype - 5.71 X 16808
Cd-I CdI2 8H CdI2 ,hP12,156 P3m1 0.424,0.424,2.734,90,90,120 CdI2-PbI2 polytype - 5.71 X 828
Cd-I CdI2 8H2 CdI2 ,hP12,186 P63mc 0.424,0.424,2.734,90,90,120 CdI2-PbI2 polytype - 5.71 X 3382
Cd-I CdI2 8H3 CdI2 ,hP12,164 P-3m1 0.424,0.424,2.734,90,90,120 CdI2-PbI2 polytype - 5.71 X 5685
Cd-I CdI2 90R CdI2 ,hR135,160 R3m 0.424,0.424,30.7575,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 96R1 CdI2 -a,hR144,160 R3m 0.424,0.424,32.808,90,90,120 CdI2-PbI2 polytype - 5.71 X 15865
Cd-I CdI2 96R2 CdI2 -b,hR144,160 R3m 0.424,0.424,32.808,90,90,120 CdI2-PbI2 polytype - 5.71 X 15803
Cd-I CdI2 ht CdI2 ,hP6,186 P63mc 0.424,0.424,1.37,90,90,120 CdI2-PbI2 polytype - 5.70 X 249
Cd-In Cd0.035 In0.965 In,tI2,139 I4/mmm 0.3268,0.3268,0.4872,90,90,90 close-packed structure - 7.32 X 3709
Cd-In Cd0.1 In0.9 Cu,cF4,225 Fm-3m 0.46937,0.46937,0.46937,90,90,90 close-packed structure - 7.36 X 6344
Cd-K KCd13 NaZn13,cF112,226 Fm-3c 1.3792,1.3792,1.3792,90,90,90 - - 7.60 X 46673
Cd-K K0.4 Cd2 K0.4 Cd2,tI12,140 I4/mcm 0.9169,0.9169,0.28779,90,90,90 - - 6.60 X 34377
Cd-K K3Cd16 K3Cd16,tP38,126 P4/nnc 0.9152,0.9152,1.159,90,90,90 - - 6.55 X 55459
Cd-La CdLa lt CuTi,tP2,123 P4/mmm 0.385,0.385,0.3977,90,90,90 b.c.c. family - 7.08 X 21588
Cd-La CdLa rt CsCl,cP2,221 Pm-3m 0.3907,0.3907,0.3907,90,90,90 b.c.c. family - 7.00 X 21588
Cd-La Cd0.15 La0.85 ht2 W,cI2,229 Im-3m 0.414,0.414,0.414,90,90,90 b.c.c. family - 6.32 X 7470
Cd-La Cd11 La BaHg11,cP36,221 Pm-3m 0.93272,0.93272,0.93272,90,90,90 - - 8.44 X 55070
Cd-La Cd17 La2 Th2Ni17,hP38,194 P63/mmc 1.0042,1.0042,0.9825,90,90,120 CaCu5-Zr4Al3 - 8.47 X 7472
56 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cd-La Cd2La Cd2Ce,hP3,164 P-3m1 0.5075,0.5075,0.3458,90,90,120 AlB2 family - 7.83 X 612


Cd-La Cd58La13 Zn58Gd13,hP142,194 P63 /mmc 1.585,1.585,1.563,90,90,120 - - 8.13 X 7472
Cd-Li LiCd hp CsCl,cP2,221 Pm-3m 0.312,0.312,0.312,90,90,90 b.c.c. family - 6.53 X 34780
Cd-Li LiCd rt NaTl,cF16,227 Fd-3m 0.654,0.654,0.654,90,90,90 b.c.c. family - 5.67 X 34780
Cd-Li Li0.222 Cd0.778 rt Mg,hP2,194 P63 /mmc 0.29802,0.29802,0.56187,90,90,120 close-packed structure - 6.84 X 4174
Cd-Li Li0.75 Cd0.25 rt Cu,cF4,225 Fm-3m 0.425,0.425,0.425,90,90,90 close-packed structure - 2.88 X 99
Cd-Li Li0.975 Cd0.025 rt W,cI2,229 Im-3m 0.34921,0.34921,0.34921,90,90,90 b.c.c. family - 0.75 X 4488
Cd-Lu CdLu CsCl,cP2,221 Pm-3m 0.364,0.364,0.364,90,90,90 b.c.c. family gray silver 9.89 X 2673
Cd-Lu Cd2Lu Cd2Ce,hP3,164 P-3m1 0.4865,0.4865,0.3382,90,90,120 AlB2 family - 9.58 A 4094
Cd-Lu Cd3Lu Cd3Er,oS16,63 Cmcm 0.714,1.0517,0.4771,90,90,90 close-packed structure - 9.50 X 7472
Cd-Lu Cd45Lu11 Cd45Sm11,cF448,216 F-43m 2.1402,2.1402,2.1402,90,90,90 Nasicon family - 9.46 A 7472
Cd-Lu Cd6Lu Cd6Y,cI184,204 Im-3 1.533,1.533,1.533,90,90,90 - - 9.40 X 47785
Cd-Mg MgCd rt AuCd,oP4,51 Pmma 0.50051,0.32217,0.527,90,90,90 close-packed structure - 5.34 X 414
Cd-Mg MgCd3 rt Mg3Cd,hP8,194 P63 /mmc 0.62335,0.62335,0.5045,90,90,120 close-packed structure - 7.07 A 442
Cd-Mg Mg0.33 Cd0.67 ht Mg,hP2,194 P63 /mmc 0.314,0.314,0.562,90,90,120 close-packed structure - 5.77 X 11854
Cd-Mg Mg3Cd rt Mg3Cd,hP8,194 P63 /mmc 0.6313,0.6313,0.5074,90,90,120 close-packed structure - 3.51 X 442
Cd-Mn Cd0.995 Mn0.005 Mg,hP2,194 P63 /mmc 0.29803,0.29803,0.56204,90,90,120 close-packed structure - 8.61 X 5459
Cd-N Cd[N3]2 Cd[N3]2,oP56,61 Pbca 0.644,1.6073,0.782,90,90,90 - colorless 3.22 X 45697
Cd-N Cd3N2 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.0829,1.0829,1.0829,90,90,90 - black 7.64 X 49601
Cd-N Cd4N3 *,oP21,54 Pcca 0.646,1.604,0.782,90,90,90 - white - N 127
Cd-Na Na2Cd11 Mg2Zn11,cP39,200 Pm-3 0.95875,0.95875,0.95875,90,90,90 - - 7.25 X 55459
Cd-Na Na26Cd141 Na26Cd141 ,hP167,191 P6/mmm 2.1306,2.1306,0.9625,90,90,120 - - 7.22 X 34377
Cd-Na Na54.6 Cd92.4 Na22(Na0.57 Cd0.43)57Cd68,cF1192,227 Fd-3m 3.056,3.056,3.056,90,90,90 - - 5.42 X 19958
Cd-Nb Cd3Nb Cu3Au,cP4,221 Pm-3m 0.4215,0.4215,0.4215,90,90,90 close-packed structure - 9.54 X 2928
Cd-Nd CdNd rt CsCl,cP2,221 Pm-3m 0.3818,0.3818,0.3818,90,90,90 b.c.c. family - 7.66 X 18569
Cd-Nd Cd11Nd BaHg11,cP36,221 Pm-3m 0.9294,0.9294,0.9294,90,90,90 - - 8.57 A 5495
Cd-Nd Cd2Nd Cd2Ce,hP3,164 P-3m1 0.5023,0.5023,0.3451,90,90,120 AlB2 family - 8.13 A 4094
Cd-Nd Cd45Nd11 Cd45Sm11,cF448,216 F-43m 2.1783,2.1783,2.1783,90,90,90 Nasicon family - 8.54 A 7472
Cd-Nd Cd58Nd13 Zn58Gd13,hP142,194 P63 /mmc 1.561,1.561,1.544,90,90,120 - - 8.56 X 7472
Cd-Nd Cd6Nd Cd6Y,cI184,204 Im-3 1.5641,1.5641,1.5641,90,90,90 - - 8.53 A 59028
Cd-Ni CdNi0.917 CdNi,cF96,227 Fd-3m 1.139,1.139,1.139,90,90,90 - - 8.97 X 2500
Cd-Ni Cd20Ni4 Cd19(Cd0.2 Ni0.8)5,cP48,215 P-43m 0.97878,0.97878,0.97878,90,90,90 - - 8.79 X 5064
Cd-Np Cd11Np BaHg11,cP36,221 Pm-3m 0.9288,0.9288,0.9288,90,90,90 - - 9.16 A 4706
Cd-Np Cd6Np Cd6Y,cI184,204 Im-3 1.5614,1.5614,1.5614,90,90,90 - - 9.54 A 4706
Cd-O CdO NaCl,cF8,225 Fm-3m 0.46806,0.46806,0.46806,90,90,90 monteponite red brown 8.32 X 56998
Cd-O Cd[O2] FeS2,cP12,205 Pa-3 0.5313,0.5313,0.5313,90,90,90 pyrite-marcasite family - 6.40 X 1103
Cd-P CdP 2 ht ZnP 2,tP24,92 P41212 0.52852,0.52852,1.9787,90,90,90 - red 4.19 X 20710
Cd-P CdP 2 rt CdP 2,oP12,33 Pna21 0.99,0.5408,0.5171,90,90,90 - red dark 4.18 X 4409
Cd-P CdP 4 CdP 4,mP10,14 P121/c1 0.527,0.519,0.766,90,99.47,90 - black 3.80 X 815
Cd-P Cd3P 2 tet1 Cd3As2,tI160,110 I41cd 1.238,1.238,2.474,90,90,90 - - 5.59 A 6220
Cd-P Cd3P 2 tet2 Zn3P 2,tP40,137 P42 /nmc 0.8739,0.8739,1.2252,90,90,90 fluorite family gray steel 5.67 X 47140
Cd-P Cd6P 7 ht *,cF52,* - 1.058,1.058,1.058,90,90,90 - gray steel - N 4241
Cd-P Cd7P 10 Cd7P 10,oF136,43 Fdd2 2.30,2.75,0.462,90,90,90 - gray steel 4.99 X 12554
Cd-Pb Cd0.0125Pb0.9875 Cu,cF4,225 Fm-3m 0.49467,0.49467,0.49467,90,90,90 close-packed structure - 11.31 X 567
Cd-Pd CdPd CuTi,tP2,123 P4/mmm 0.30276,0.30276,0.3631,90,90,90 b.c.c. family - 10.92 X 15456
Cd-Pd Cd0.28Pd0.72 Cu,cF4,225 Fm-3m 0.398,0.398,0.398,90,90,90 close-packed structure - 11.39 X 4086
Cd-Pd Cd1.15Pd0.85 ht CsCl,cP2,221 Pm-3m 0.32446,0.32446,0.32446,90,90,90 b.c.c. family - 10.68 X 15456
Cd-Pd Cd10.75 Pd2 Cd10.75 Pd2 ,cP52,215 P-43m 0.99415,0.99415,0.99415,90,90,90 γ-brass - 9.61 X 13068
Cd-Pd Cd54.25 Pd14.75 Zn45(Zn0.46Pd0.54 )16Pd8,oS276,64 Cmce 1.40033,0.99013,3.7063,90,90,90 - gray silver 9.91 X 48134
Cd-Pd Cd85.75 Pd26.25 Cd85.75Pd26.25 ,oF448,42 Fmm2 1.40212,6.0181,0.99251,90,90,90 - gray silver 9.86 X 48134
Cd-Po CdPo ZnS,cF8,216 F-43m 0.6665,0.6665,0.6665,90,90,90 adamantane structure gray 7.21 X 1261
Cd-Pr CdPr lt1 CuTi,tP2,123 P4/mmm 0.38,0.38,0.3835,90,90,90 b.c.c. family - 7.60 X 21588
Cd-Pr CdPr rt CsCl,cP2,221 Pm-3m 0.383,0.383,0.383,90,90,90 b.c.c. family - 7.49 X 21588
Cd-Pr Cd11Pr BaHg11,cP36,221 Pm-3m 0.93141,0.93141,0.93141,90,90,90 - - 8.49 X 55070
Cd-Pr Cd2Pr Cd2Ce,hP3,164 P-3m1 0.5043,0.5043,0.3445,90,90,120 AlB2 family - 8.00 X 4094
Cd-Pr Cd3Pr BiF3,cF16,225 Fm-3m 0.7201,0.7201,0.7201,90,90,90 b.c.c. family - 8.51 X 612
Cd-Pr Cd45Pr11 Cd45Sm11,cF448,216 F-43m 2.1842,2.1842,2.1842,90,90,90 Nasicon family - 8.43 A 7472
Cd-Pr Cd58Pr13 Zn58Gd13,hP142,194 P63 /mmc 1.571,1.571,1.552,90,90,120 - - 8.36 X 7472
Cd-Pr Cd6Pr Cd6Y,cI184,204 Im-3 1.5703,1.5703,1.5703,90,90,90 - - 8.39 A 59028
Cd-Pt CdPt CuAu,tP2,123 P4/mmm 0.29586,0.29586,0.38163,90,90,90 close-packed structure - 15.29 X 11778
Cd-Pt CdPt3 rt Cu3Au,cP4,221 Pm-3m 0.3977,0.3977,0.3977,90,90,90 close-packed structure - 18.42 X 449
Cd-Pt Cd0.26Pt0.74 Cu,cF4,225 Fm-3m 0.3986,0.3986,0.3986,90,90,90 close-packed structure - 18.21 X 449
Cd-Pt Cd40.4Pt8 Cd40Pt8,cI392,217 I-43m 1.98042,1.98042,1.98042,90,90,90 - - 10.44 X 13068
Cd-Pt Cd5Pt Cd5Pt,cP54,215 P-43m 0.992,0.992,0.992,90,90,90 - - 10.30 X 13068
Cd-Pu Cd11Pu BaHg11,cP36,221 Pm-3m 0.9282,0.9282,0.9282,90,90,90 - - 9.22 A 2817
Cd-Pu Cd6Pu Cd6Y,cI184,204 Im-3 1.559,1.559,1.559,90,90,90 - - 9.66 A 2817
Cd-Rb RbCd13 NaZn13,cF112,226 Fm-3c 1.3844,1.3844,1.3844,90,90,90 - - 7.74 X 46673
Cd-S CdS 24H *,hP48,* - 0.412,0.412,8.08,90,90,120 - - - N 1755
Cd-S CdS hp1 NaCl,cF8,225 Fm-3m 0.543,0.543,0.543,90,90,90 rocksalt family black 5.99 X 13460
Cd-S CdS hp2 CrN,oP4,59 Pmmn 0.3471,0.4873,0.3399,90,90,90 - - 8.35 A 16117
Cd-S CdS ht cub ZnS,cF8,216 F-43m 0.58304,0.58304,0.58304,90,90,90 hawleyite orange 4.84 X 31894
Cd-S CdS ht hex ZnO,hP4,186 P63 mc 0.41365,0.41365,0.6716,90,90,120 greenockite yellow 4.82 X 45600
Cd-S CdS m *,oP*,48 Pnnn 1.4074,1.4315,1.4568,90,90,90 - yellow - N 22585
Cd-S CdS2 FeS2,cP12,205 Pa-3 0.63032,0.63032,0.63032,90,90,90 pyrite-marcasite family - 4.68 A 4031
Cd-Sb CdSb CdSb,oP16,61 Pbca 0.6469,0.8251,0.8522,90,90,90 - gray 6.84 X 20988
Cd-Sb Cd0.2 Sb0.8 hp W,cI2,229 Im-3m 0.3279,0.3279,0.3279,90,90,90 b.c.c. family - 11.29 X 47334
Cd-Sb Cd0.44 Sb0.56 m hp-ht (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.30198,0.30198,0.28275,90,90,120 - - 8.75 X 47334
Cd-Sb Cd12.7 Sb10 m rhom Cd12.7 Sb10 ,hR246,167 R-3c 1.30395,1.30395,1.30346,90,90,120 - - 6.87 X 48181
Handbook of Inorganic Substances – Edition 2015 : Data 57

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cd-Sb Cd3Sb2 cub *,cP15,207 P432 1.136,1.136,1.136,90,90,90 - - 1.97 N 10677


Cd-Sb Cd3Sb2 m *,oP30,59 Pmmn 0.789,0.84,1.2,90,90,90 - - - N 6675
Cd-Sb Cd4Sb3 m orth *,oP28,26 Pmc21 0.85126,0.75378,1.22169,90,90,90 - - - N 32307
Cd-Sb Cd4Sb3 mon Cd4Sb3,mP276,7 P1c1 1.14478,2.60793,2.6421,90,104.311,90 - - 7.08 X 50520
Cd-Sb Cd5Sb4 ht *,o**,* - 0.506,0.5427,0.7309,90,90,90 - - - N 16452
Cd-Sc CdSc CsCl,cP2,221 Pm-3m 0.351,0.351,0.351,90,90,90 b.c.c. family - 6.04 X 31745
Cd-Sc Cd3Sc Mg3 Cd,hP8,194 P63/mmc 0.6324,0.6324,0.4853,90,90,120 close-packed structure - 7.55 X 2386
Cd-Sc Cd7Sc Cd7Sc,oS32,63 Cmcm 0.7304,0.9993,0.9306,90,90,90 - - 8.13 X 31206
Cd-Se CdSe 24H *,hP48,* - 0.4291,0.4291,8.43,90,90,120 - - - N 1755
Cd-Se CdSe hp NaCl,cF8,225 Fm-3m 0.549,0.549,0.549,90,90,90 rocksalt family - 7.68 X 2001
Cd-Se CdSe rt cub ZnS,cF8,216 F-43m 0.5873,0.5873,0.5873,90,90,90 adamantane structure orange red 6.28 X 45541
Cd-Se CdSe rt hex ZnO,hP4,186 P63mc 0.42982,0.42982,0.70084,90,90,120 cadmoselite red dark 5.67 X 45574
Cd-Se CdSe 2 hp FeS2 ,cP12,205 Pa-3 0.6615,0.6615,0.6615,90,90,90 pyrite-marcasite family - 6.20 A 4031
Cd-Sm CdSm CsCl,cP2,221 Pm-3m 0.3779,0.3779,0.3779,90,90,90 b.c.c. family - 8.09 X 8311
Cd-Sm Cd11 Sm BaHg11,cP36,221 Pm-3m 0.9288,0.9288,0.9288,90,90,90 - - 8.62 A 8295
Cd-Sm Cd2Sm Cd2Ce,hP3,164 P-3m1 0.4979,0.4979,0.3458,90,90,120 AlB2 family - 8.39 X 4094
Cd-Sm Cd45 Sm11 Cd45 Sm11,cF448,216 F-43m 2.1699,2.1699,2.1699,90,90,90 Nasicon family - 8.73 X 11219
Cd-Sm Cd58 Sm13 Zn58 Gd13,hP142,194 P63/mmc 1.551,1.551,1.536,90,90,120 - - 8.80 X 7472
Cd-Sm Cd6Sm Cd6Y,cI184,204 Im-3 1.5602,1.5602,1.5602,90,90,90 - - 8.66 A 59028
Cd-Sn Cd0.01 Sn0.99 rt Sn,tI4,141 I41/amd 0.5829,0.5829,0.318,90,90,90 - - 7.29 X 636
Cd-Sn Cd0.05 Sn0.95 ht (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.324,0.324,0.3009,90,90,120 - - 7.19 X 24977
Cd-Sr SrCd CsCl,cP2,221 Pm-3m 0.4025,0.4025,0.4025,90,90,90 b.c.c. family - 5.09 X 2861
Cd-Sr SrCd11 BaCd11,tI48,141 I41/amd 1.198,1.198,0.767,90,90,90 - - 7.99 A 2861
Cd-Sr SrCd2 KHg2,oI12,74 Imma 0.5052,0.8054,0.8526,90,90,90 AlB2 family gray silver 5.98 X 53597
Cd-Sr SrCd6 Cd6Y,cI184,204 Im-3 1.604,1.604,1.604,90,90,90 - - 7.36 A 6645
Cd-Sr Sr13 Cd58 Zn58 Gd13,hP142,194 P63/mmc 1.6068,1.6068,1.591,90,90,120 - - 7.15 A 6645
Cd-Sr Sr5Cd3 Cr5B3,tI32,140 I4/mcm 0.8717,0.8717,1.6601,90,90,90 - gray silver 4.08 X 29534
Cd-Tb CdTb CsCl,cP2,221 Pm-3m 0.3723,0.3723,0.3723,90,90,90 b.c.c. family gray silver 8.73 X 8311
Cd-Tb Cd2Tb Cd2Ce,hP3,164 P-3m1 0.4905,0.4905,0.345,90,90,120 AlB2 family - 8.87 A 3053
Cd-Tb Cd3Tb hex Mg3 Cd,hP8,194 P63/mmc 0.6585,0.6585,0.4925,90,90,120 close-packed structure - 8.91 X 7472
Cd-Tb Cd3Tb orth Cd3Er,oS16,63 Cmcm 0.6963,1.097,0.4851,90,90,90 close-packed structure - 8.89 X 7472
Cd-Tb Cd45 Tb11 Cd45 Sm11,cF448,216 F-43m 2.155,2.155,2.155,90,90,90 Nasicon family - 9.04 A 7472
Cd-Tb Cd6Tb Cd6Y,cI184,204 Im-3 1.5453,1.5453,1.5453,90,90,90 - - 9.00 X 47785
Cd-Te CdTe 12H ZnS,hP24,186 P63mc 0.46,0.46,4.51,90,90,120 adamantane structure black 5.79 A 1271
Cd-Te CdTe hp1 CdTe,hP6,152 P3121 0.4292,0.4292,1.0235,90,90,120 rocksalt family - 7.32 X 27980
Cd-Te CdTe hp2 NaCl,cF8,225 Fm-3m 0.5932,0.5932,0.5932,90,90,90 rocksalt family - 7.64 X 27983
Cd-Te CdTe hp3 ZnTe,oS8,63 Cmcm 0.5761,0.5834,0.5715,90,90,90 - - 8.30 X 30878
Cd-Te CdTe m ZnO,hP4,186 P63mc 0.4572,0.4572,0.7485,90,90,120 adamantane structure - 5.88 A 3220
Cd-Te CdTe rt ZnS,cF8,216 F-43m 0.64827,0.64827,0.64827,90,90,90 adamantane structure black 5.85 X 39254
Cd-Th Cd11 Th BaHg11,cP36,221 Pm-3m 0.9275,0.9275,0.9275,90,90,90 - - 9.17 A 14251
Cd-Th Cd2Th Hg2U,hP3,191 P6/mmm 0.5002,0.5002,0.3517,90,90,120 AlB2 family - 9.96 X 14251
Cd-Th Cd23 Th6 Th6Mn23,cF116,225 Fm-3m 1.4142,1.4142,1.4142,90,90,90 - - 9.34 A 14251
Cd-Th Cd3Th Mg3 Cd,hP8,194 P63/mmc 0.6775,0.6775,0.4928,90,90,120 close-packed structure - 9.65 A 14250
Cd-Th Cd5Th Mg5.2 Eu,hP42,194 P63/mmc 0.9801,0.9801,1.0113,90,90,120 - - 9.40 A 14251
Cd-Th Cd7Th6 Cd7Th6,oP26,55 Pbam 0.9929,1.1703,0.6041,90,90,90 Frank-Kasper phase - 10.31 X 17190
Cd-Ti CdTi CdTi,tP4,129 P4/nmm 0.2904,0.2904,0.8954,90,90,90 close-packed structure - 7.05 X 1767
Cd-Ti CdTi2 CuZr2,tI6,139 I4/mmm 0.2865,0.2865,1.342,90,90,90 close-packed structure - 6.28 X 1767
Cd-Tl Tl0.964 Cd0.036 rt Mg,hP2,194 P63/mmc 0.34672,0.34672,0.55343,90,90,120 close-packed structure - 11.59 X 1266
Cd-Tm CdTm rt CsCl,cP2,221 Pm-3m 0.369,0.369,0.369,90,90,90 b.c.c. family gray silver 9.30 X 18569
Cd-Tm Cd2Tm Cd2Ce,hP3,164 P-3m1 0.488,0.488,0.3413,90,90,120 AlB2 family - 9.29 X 4094
Cd-Tm Cd3Tm Cd3Er,oS16,63 Cmcm 0.7103,1.0617,0.4795,90,90,90 close-packed structure - 9.30 X 7472
Cd-Tm Cd45 Tm11 Cd45 Sm11,cF448,216 F-43m 2.1427,2.1427,2.1427,90,90,90 Nasicon family - 9.34 A 7472
Cd-Tm Cd6Tm Cd6Y,cI184,204 Im-3 1.5423,1.5423,1.5423,90,90,90 - - 9.16 X 47785
Cd-U Cd9.5 U BaHg11,cP36,221 Pm-3m 0.9248,0.9248,0.9248,90,90,90 - - 8.23 X 21416
Cd-V CdV3 Cr3Si,cP8,223 Pm-3n 0.4943,0.4943,0.4943,90,90,90 Frank-Kasper phase - 7.29 X 1964
Cd-Y CdY rt CsCl,cP2,221 Pm-3m 0.3719,0.3719,0.3719,90,90,90 b.c.c. family - 6.50 X 18569
Cd-Y Cd2Y Cd2Ce,hP3,164 P-3m1 0.4882,0.4882,0.3501,90,90,120 AlB2 family - 7.21 X 3844
Cd-Y Cd3Y Cd3Er,oS16,63 Cmcm 0.7044,1.0864,0.4837,90,90,90 close-packed structure - 7.65 X 6455
Cd-Y Cd45 Y11 Cd45 Sm11,cF448,216 F-43m 2.1492,2.1492,2.1492,90,90,90 Nasicon family - 8.08 A 4707
Cd-Y Cd58 Y13 Zn58 Gd13,hP142,194 P63/mmc 1.535,1.535,1.524,90,90,120 - - 8.20 X 7472
Cd-Y Cd6Y lt *,o*672,* - 1.5436,3.0897,3.0897,90,90,90 - - 8.26 N 42203
Cd-Y Cd6Y rt Cd6Y,cI184,204 Im-3 1.5482,1.5482,1.5482,90,90,90 - - 8.20 X 5669
Cd-Yb CdYb CsCl,cP2,221 Pm-3m 0.3808,0.3808,0.3808,90,90,90 b.c.c. family - 8.58 X 2673
Cd-Yb Cd2Yb rt MgZn2,hP12,194 P63/mmc 0.5989,0.5989,0.9597,90,90,120 Friauf-Laves phase - 8.87 A 6032
Cd-Yb Cd51 Yb14 Ag51 Gd14,hP68,175 P6/m 1.3441,1.3441,0.9655,90,90,120 - - 8.97 A 6032
Cd-Yb Cd6Yb lt Cd6Y,cI184,204 Im-3 1.5539,1.5539,1.5539,90,90,90 - black 9.00 X 48372
Cd-Yb Cd6Yb rt Cd6Yb,cI208,204 Im-3 1.559,1.559,1.559,90,90,90 - black 8.91 X 48372
Cd-Zn Zn0.04 Cd0.96 Mg,hP2,194 P63/mmc 0.29704,0.29704,0.56007,90,90,120 close-packed structure - 8.58 X 2539
Cd-Zn Zn0.986 Cd0.014 Mg,hP2,194 P63/mmc 0.26688,0.26688,0.49615,90,90,120 close-packed structure - 7.17 X 2146
Cd-Zr CdZr CdTi,tP4,129 P4/nmm 0.314,0.314,0.875,90,90,90 close-packed structure - 7.84 A 2862
Cd-Zr CdZr2 CuZr2,tI6,139 I4/mmm 0.315,0.315,1.33,90,90,90 close-packed structure - 7.42 A 50832
Cd-Zr Cd2Zr3 Cd2Zr3,oP5,47 Pmmm 0.530,0.652,0.786,90,90,90 - - 3.05 X 4357
Cd-Zr Cd3Zr SrPb3,tP4,123 P4/mmm 0.4375,0.4375,0.4362,90,90,90 close-packed structure - 8.52 X 50832
Ce-Cl CeCl3 UCl3,hP8,176 P63/m 0.74636,0.74636,0.43295,90,90,120 - - 3.92 X 57917
Ce-Co CeCo 2 MgCu2,cF24,227 Fd-3m 0.7161,0.7161,0.7161,90,90,90 Friauf-Laves phase - 9.33 X 30427
Ce-Co CeCo 3 PuNi3,hR36,166 R-3m 0.499,0.499,2.494,90,90,120 Laves-CaCu5 - 8.81 X 44948
Ce-Co CeCo 5 ht CaCu5,hP6,191 P6/mmm 0.492,0.492,0.401,90,90,120 - - 8.59 X 14227
Ce-Co Ce0.9 Co5.2 ht Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4848,0.4848,0.4071,90,90,120 CaCu5-Zr4Al3 - 8.67 A 8483
58 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ce-Co Ce2Co17 ht Th2Ni17,hP38,194 P63 /mmc 0.838,0.838,0.812,90,90,120 CaCu5-Zr4Al3 - 8.62 X 2177


Ce-Co Ce2Co17 rt Zn17Th2,hR57,166 R-3m 0.83781,0.83781,1.22041,90,90,120 CaCu5-Zr4Al3 - 8.61 A 15785
Ce-Co Ce2Co7 hex Ce2Ni7,hP36,194 P63 /mmc 0.498,0.498,2.452,90,90,120 Laves-CaCu5 - 8.74 A 52561
Ce-Co Ce2Co7 rhom Gd2Co7,hR54,166 R-3m 0.4938,0.4938,3.6501,90,90,120 Laves-CaCu5 - 8.96 A 8279
Ce-Co Ce24Co11 Ce24Co11,hP70,186 P63 mc 0.9587,0.9587,2.1825,90,90,120 - - 7.67 X 1579
Ce-Co Ce5Co19 Ce5Co19,hR72,166 R-3m 0.49475,0.49475,4.87434,90,90,120 Laves-CaCu5 - 8.78 X 7918
Ce-Cu CuCe FeB-b,oP8,62 Pnma 0.73,0.43,0.636,90,90,90 CrB(TlI)-FeB - 6.78 X 1382
Ce-Cu Cu2Ce KHg2,oI12,74 Imma 0.443,0.705,0.745,90,90,90 AlB2 family - 7.63 X 1390
Ce-Cu Cu25.47 Ce7 rt Cu25.47 Ce7 ,hP78,175 P6/m 1.1858,1.1858,0.9107,90,90,120 - - 7.78 X 16848
Ce-Cu Cu4Ce *,oP20,* - 0.4512,0.6789,0.9271,90,90,90 - - - N 33115
Ce-Cu Cu5Ce CaCu5,hP6,191 P6/mmm 0.5147,0.5147,0.41072,90,90,120 - - 8.07 X 25723
Ce-Cu Cu6Ce lt Cu6La,mP28,14 P121/c1 0.50841,1.01279,0.80731,90,91.442,90 - - 8.33 X 23710
Ce-Cu Cu6Ce rt Cu6Ce,oP28,62 Pnma 0.81088,0.51004,1.01621,90,90,90 - - 8.24 X 23710
Ce-D CeD2 CaF2,cF12,225 Fm-3m 0.5557,0.5557,0.5557,90,90,90 fluorite family - 5.58 X 6807
Ce-D CeD2.18 lt CeH2.1 ,tI30,107 I4mm 0.5547,0.5547,1.113,90,90,90 - - 5.61 X 17186
Ce-D CeD2.51 rt CeH3,cF44,225 Fm-3m 0.5529,0.5529,0.5529,90,90,90 fluorite family - 5.71 X 8347
Ce-Dy Ce0.97 Dy0.03 rt Cu,cF4,225 Fm-3m 0.51605,0.51605,0.51605,90,90,90 close-packed structure - 6.80 X 1566
Ce-Er Ce0.4Er0.6 Mg,hP2,194 P63 /mmc 0.36197,0.36197,0.5726,90,90,120 close-packed structure - 7.99 X 3590
Ce-Er Ce0.5 Er0.5 rt Sm,hR9,166 R-3m 0.36168,0.36168,2.6072,90,90,120 close-packed structure - 7.78 A 3590
Ce-Er Ce0.98 Er0.02 rt Cu,cF4,225 Fm-3m 0.5157,0.5157,0.5157,90,90,90 close-packed structure - 6.81 X 1566
Ce-Eu Ce0.96 Eu0.04 rt Cu,cF4,225 Fm-3m 0.51669,0.51669,0.51669,90,90,90 close-packed structure - 6.77 X 1913
Ce-F CeF3 HoH3,hP24,165 P-3c1 0.7131,0.7131,0.7286,90,90,120 fluocerite-(Ce) - 6.12 X 9677
Ce-F CeF4 ZrF4,mS60,15 C12/c1 1.25883,1.06263,0.82241,90,126.24,90 - colorless 4.85 X 36660
Ce-Fe CeFe2 hp TbFe2,hR18,166 R-3m 0.512,0.512,1.24331,90,90,120 Friauf-Laves phase - 8.89 A 59254
Ce-Fe CeFe2 MgCu2,cF24,227 Fd-3m 0.7305,0.7305,0.7305,90,90,90 Friauf-Laves phase - 8.58 X 23661
Ce-Fe CeFe5 CaCu5,hP6,191 P6/mmm 0.486,0.486,0.4,90,90,120 - - 8.51 X 1291
Ce-Fe Ce0.004 Fe0.996 rt W,cI2,229 Im-3m 0.28653,0.28653,0.28653,90,90,90 b.c.c. family - 7.93 X 13531
Ce-Fe Ce2Fe17 ht Th2Ni17,hP38,194 P63 /mmc 0.849,0.849,0.8281,90,90,120 CaCu5-Zr4Al3 - 7.90 A 5505
Ce-Fe Ce2Fe17 rt Zn17Th2,hR57,166 R-3m 0.8489,0.8489,1.241,90,90,120 CaCu5-Zr4Al3 - 7.91 X 49358
Ce-Fe Ce2.33 Fe16.33 Pr2.33 Fe16.33 ,hR60,166 R-3m 0.8488,0.8488,1.2402,90,90,120 CaCu5-Zr4Al3 - 7.97 A 2925
Ce-Ga CeGa ht *,tP*,* - 0.957,0.957,0.6992,90,90,90 - - - N 29445
Ce-Ga CeGa rt TlI,oS8,63 Cmcm 0.4473,1.1339,0.4201,90,90,90 CrB(TlI)-FeB - 6.54 X 5083
Ce-Ga CeGa2 AlB2,hP3,191 P6/mmm 0.4308,0.4308,0.435,90,90,120 AlB2 family - 6.64 X 28955
Ce-Ga CeGa6 rt PuGa6,tP14,125 P4/nbm 0.60422,0.60422,0.76704,90,90,90 - - 6.62 X 44822
Ce-Ga Ce3Ga Cu3Au,cP4,221 Pm-3m 0.54,0.54,0.54,90,90,90 close-packed structure - 5.17 X 10955
Ce-Ga Ce4.8 Ga3.2 Ba5Si3,tP32,130 P4/ncc 0.8066,0.8066,1.4495,90,90,90 - - 6.31 X 23536
Ce-Ga Ce5Ga3 W5Si3,tI32,140 I4/mcm 1.244,1.244,0.5571,90,90,90 - - 7.01 X 4014
Ce-Gd Ce0.2 Gd0.8 ht Mg,hP2,194 P63 /mmc 0.36473,0.36473,0.58116,90,90,120 close-packed structure - 7.63 X 3146
Ce-Gd Ce0.3 Gd0.7 rt Sm,hR9,166 R-3m 0.3638,0.3638,2.6281,90,90,120 close-packed structure - 7.55 A 3146
Ce-Gd Ce0.6 Gd0.4 rt Nd,hP4,194 P63 /mmc 0.36536,0.36536,1.1773,90,90,120 close-packed structure - 7.17 X 3146
Ce-Gd Ce0.9 Gd0.1 rt Cu,cF4,225 Fm-3m 0.51588,0.51588,0.51588,90,90,90 close-packed structure - 6.86 X 3146
Ce-Ge CeGe FeB-b,oP8,62 Pnma 0.8355,0.4078,0.6023,90,90,90 CrB(TlI)-FeB - 6.89 X 58618
Ce-Ge CeGe1.654 *,o**,* - 0.5961,0.5962,1.4206,90,90,90 - - - N 35901
Ce-Ge CeGe1.75 ht GdSi1.4 ,oI12,74 Imma 0.426,0.436,1.407,90,90,90 - - 6.79 X 2286
Ce-Ge CeGe1.768 *,o**,* - 0.6051,0.6053,1.4063,90,90,90 - - - N 35901
Ce-Ge CeGe1.86 rt *,m**,* - 0.4346,0.4254,1.4091,90,90.11,90 - - - N 35901
Ce-Ge CeGe2 ht ThSi2,tI12,141 I41/amd 0.421,0.421,1.4182,90,90,90 - - 7.54 X 1100
Ce-Ge CeGe5 hp LaGe5,oI12,71 Immm 0.4,0.6192,0.986,90,90,90 - - 6.84 X 52886
Ce-Ge Ce3Ge Ti3P,tP32,86 P42 /n 1.2482,1.2482,0.6137,90,90,90 - - 6.85 A 20721
Ce-Ge Ce3Ge5 rt Y3Ge5,oF64,43 Fdd2 0.5974,1.7931,1.4184,90,90,90 - - 6.85 A 35901
Ce-Ge Ce4Ge3 rt Th3P 4,cI28,220 I-43d 0.924,0.924,0.924,90,90,90 - - 6.55 X 52548
Ce-Ge Ce4Ge7 rt Nd4Ge7,oS44,20 C222 1 0.6031,1.4082,1.207,90,90,90 - - 6.92 A 35901
Ce-Ge Ce5Ge3 Mn5Si3,hP16,193 P63 /mcm 0.884,0.884,0.672,90,90,120 - - 6.71 X 4619
Ce-Ge Ce5Ge4 rt Sm5Ge4,oP36,62 Pnma 0.79611,1.5239,0.80599,90,90,90 - - 6.73 X 54626
Ce-Ge Ce9Ge14 Ce9Ge14,tI104,80 I41 1.2669,1.2669,1.4208,90,90,90 - - 6.63 X 23605
Ce-H CeH2.49 rt *,tI*,* - 0.5537,0.5537,0.5566,90,90,90 - bronze - N 20183
Ce-H CeH3.0 CeH3,cF44,225 Fm-3m 0.55354,0.55354,0.55354,90,90,90 fluorite family - 5.61 A 20183
Ce-Hf Ce0.0142 Hf0.9858 rt Mg,hP2,194 P63 /mmc 0.32,0.32,0.5056,90,90,120 close-packed structure - 13.18 X 7860
Ce-Hg HgCe CsCl,cP2,221 Pm-3m 0.3808,0.3808,0.3808,90,90,90 b.c.c. family - 10.25 X 1800
Ce-Hg Hg2Ce Hg2U,hP3,191 P6/mmm 0.4942,0.4942,0.354,90,90,120 AlB2 family - 12.01 X 1800
Ce-Hg Hg3Ce Mg3Cd,hP8,194 P63 /mmc 0.676,0.676,0.4941,90,90,120 close-packed structure - 12.60 A 1800
Ce-Hg Hg45Ce11 Cd45Sm11,cF448,216 F-43m 2.1857,2.1857,2.1857,90,90,90 Nasicon family - 13.45 A 12439
Ce-Ho Ce0.3 Ho0.7 Mg,hP2,194 P63 /mmc 0.362,0.362,0.573,90,90,120 close-packed structure - 8.04 X 18139
Ce-Ho Ce0.45 Ho0.55 rt Sm,hR9,166 R-3m 0.363,0.363,2.602,90,90,120 close-packed structure - 7.74 A 3218
Ce-Ho Ce0.55 Ho0.45 rt Nd,hP4,194 P63 /mmc 0.362,0.362,1.166,90,90,120 close-packed structure - 7.59 X 18139
Ce-Ho Ce0.98 Ho0.02 rt Cu,cF4,225 Fm-3m 0.51578,0.51578,0.51578,90,90,90 close-packed structure - 6.81 X 1566
Ce-I CeI3 PuBr3,oS16,63 Cmcm 0.437,1.3967,1.0013,90,90,90 - - 5.66 A 12808
Ce-In CeIn2 KHg2,oI12,74 Imma 0.474,0.761,0.9018,90,90,90 AlB2 family - 7.55 A 13849
Ce-In CeIn3 Cu3Au,cP4,221 Pm-3m 0.4678,0.4678,0.4678,90,90,90 close-packed structure - 7.86 X 25451
Ce-In Ce0.75 In0.25 ht Cu,cF4,225 Fm-3m 0.501,0.501,0.501,90,90,90 close-packed structure - 7.07 X 13849
Ce-In Ce2In Co1.75 Ge,hP6,194 P63 /mmc 0.547,0.547,0.682,90,90,120 AlB2 family - 7.42 X 21318
Ce-In Ce3In rt Cu3Au,cP4,221 Pm-3m 0.496,0.496,0.496,90,90,90 close-packed structure - 7.28 X 13849
Ce-In Ce3In5 Pu3Pd5,oS32,63 Cmcm 1.025,0.831,1.054,90,90,90 - - 7.36 A 13849
Ce-Ir CeIr2 MgCu2,cF24,227 Fd-3m 0.7578,0.7578,0.7578,90,90,90 Friauf-Laves phase - 16.01 X 23067
Ce-Ir CeIr3 hex CeNi3,hP24,194 P63 /mmc 0.5288,0.5288,1.747,90,90,120 Laves-CaCu5 - 16.88 A 7651
Ce-Ir CeIr3 rhom PuNi3,hR36,166 R-3m 0.529,0.529,2.622,90,90,120 Laves-CaCu5 - 16.86 X 43150
Ce-Ir CeIr5 cub Be5Au,cF24,216 F-43m 0.751,0.751,0.751,90,90,90 Friauf-Laves phase - 17.27 A 7651
Ce-Ir CeIr5 hex CaCu5,hP6,191 P6/mmm 0.5282,0.5282,0.4328,90,90,120 - - 17.49 X 23067
Handbook of Inorganic Substances – Edition 2015 : Data 59

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ce-Ir Ce2Ir7 Gd2Co 7,hR54,166 R-3m 0.5294,0.5294,3.8938,90,90,120 Laves-CaCu5 - 17.14 A 23067


Ce-Ir Ce3Ir Fe3C-b,oP16,62 Pnma 0.7232,1.0057,0.6524,90,90,90 - - 8.58 A 23067
Ce-Ir Ce5Ir3 Pu5Rh3,tP32,130 P4/ncc 1.1251,1.1251,0.6371,90,90,90 - - 10.52 A 23067
Ce-Ir Ce5Ir4 Sm5 Ge4,oP36,62 Pnma 0.7436,1.4776,0.7626,90,90,90 - - 11.65 X 13090
Ce-Ir Ce7Ir3 Th7Fe3,hP20,186 P63mc 1.0068,1.0068,0.6323,90,90,120 - - 9.32 A 23067
Ce-La La0.1 Ce0.9 ht1 Cu,cF4,225 Fm-3m 0.5182,0.5182,0.5182,90,90,90 close-packed structure - 6.68 X 13522
Ce-Lu Ce0.2 Lu0.8 Mg,hP2,194 P63/mmc 0.357,0.357,0.565,90,90,120 close-packed structure - 8.95 X 29483
Ce-Lu Ce0.96 Lu0.04 rt Cu,cF4,225 Fm-3m 0.51549,0.51549,0.51549,90,90,90 close-packed structure - 6.86 X 1566
Ce-Mg MgCe rt CsCl,cP2,221 Pm-3m 0.3908,0.3908,0.3908,90,90,90 b.c.c. family - 4.58 X 11662
Ce-Mg Mg0.06 Ce0.94 lt Cu,cF4,225 Fm-3m 0.51321,0.51321,0.51321,90,90,90 close-packed structure - 6.54 X 2055
Ce-Mg Mg12 Ce ThMn12,tI26,139 I4/mmm 1.03291,1.03291,0.59633,90,90,90 CaCu5-Zr4Al3 - 2.25 A 58167
Ce-Mg Mg17.58 Ce1.71 ht Mg17.58 Ce1.71 ,hP44,194 P63/mmc 1.033,1.033,1.025,90,90,120 CaCu5-Zr4Al3 - 2.34 X 3368
Ce-Mg Mg2 Ce ht MgCu2,cF24,227 Fd-3m 0.8731,0.8731,0.8731,90,90,90 Friauf-Laves phase - 3.77 X 25319
Ce-Mg Mg3 Ce BiF3 ,cF16,225 Fm-3m 0.7448,0.7448,0.7448,90,90,90 b.c.c. family - 3.43 X 32521
Ce-Mg Mg41 Ce5 ht Mg41 Ce5,tI92,87 I4/m 1.478,1.478,1.043,90,90,90 - - 2.47 X 3327
Ce-N CeN NaCl,cF8,225 Fm-3m 0.5022,0.5022,0.5022,90,90,90 rocksalt family golden 8.08 X 12495
Ce-N CeN2 *,hP*,* - 0.3894,0.3894,0.6038,90,90,120 - - - N 6879
Ce-Nd Ce0.6 Nd0.4 rt Nd,hP4,194 P63/mmc 0.36729,0.36729,1.18358,90,90,120 close-packed structure - 6.81 X 4096
Ce-Nd Ce0.7 Nd0.3 rt Cu,cF4,225 Fm-3m 0.51611,0.51611,0.51611,90,90,90 close-packed structure - 6.83 X 4096
Ce-Ni CeNi TlI,oS8,63 Cmcm 0.379,1.055,0.437,90,90,90 CrB(TlI)-FeB - 7.56 X 18170
Ce-Ni CeNi2 MgCu2,cF24,227 Fd-3m 0.722,0.722,0.722,90,90,90 Friauf-Laves phase - 9.09 X 20259
Ce-Ni CeNi3 CeNi3,hP24,194 P63/mmc 0.49613,0.49613,1.65216,90,90,120 Laves-CaCu5 - 8.95 X 48413
Ce-Ni CeNi5 CaCu5,hP6,191 P6/mmm 0.4885,0.4885,0.4006,90,90,120 - - 8.70 X 29359
Ce-Ni Ce0.006 Ni0.994 Cu,cF4,225 Fm-3m 0.35301,0.35301,0.35301,90,90,90 close-packed structure - 8.94 X 48608
Ce-Ni Ce0.95 Ni2 TmNi2,cF192,216 F-43m 1.4417,1.4417,1.4417,90,90,90 Friauf-Laves phase - 8.88 X 24622
Ce-Ni Ce2Ni7 Ce2Ni7,hP36,194 P63/mmc 0.49413,0.49413,2.45136,90,90,120 Laves-CaCu5 - 8.86 X 49025
Ce-Ni Ce7Ni3 Th7Fe3,hP20,186 P63mc 0.992,0.992,0.633,90,90,120 - - 7.12 X 1352
Ce-O CeO hp-ht NaCl,cF8,225 Fm-3m 0.5089,0.5089,0.5089,90,90,90 rocksalt family golden 7.87 X 27909
Ce-O CeO1.695 ht UN1.6 ,cI96,206 Ia-3 1.1111,1.1111,1.1111,90,90,90 - pink pale 6.48 X 36289
Ce-O CeO1.785 rt *,hR*,* - 0.9775,0.9775,0.9502,90,90,120 - blue - N 694
Ce-O CeO2 hex *,hP48,* - 0.836,0.836,1.042,90,90,120 - - - N 15194
Ce-O CeO2 hp PbCl2,oP12,62 Pnma 0.5776,0.35125,0.66699,90,90,90 - - 8.45 A 48770
Ce-O CeO2 rt CaF2 ,cF12,225 Fm-3m 0.54052,0.54052,0.54052,90,90,90 cerianite-(Ce) yellow pale 7.24 X 57914
Ce-O Ce11 O20 rt Tb11 O20-b,aP31,2 P-1 0.6732,0.6757,1.026,96.22,90.04,99.8 - pink pale 6.76 X 36289
Ce-O Ce19 O34 rt *,aP*,* - 0.6627,1.0123,1.1478,100.9,95.5,90. - - - N 18249
Ce-O Ce2O3 rt La2O3,hP5,164 P-3m1 0.3891,0.3891,0.6059,90,90,120 - yellow 6.86 X 18109
Ce-O Ce6O11 rt *,mP144,14 P121/c1 0.6781,1.1893,1.31583,90,100.083,90 - - - N 9995
Ce-O Ce7O11.89 rt Pr7O12,hR57,148 R-3 1.0351,1.0351,0.9638,90,90,120 fluorite family pink pale 6.52 X 36289
Ce-Os CeOs2 hp MgZn2,hP12,194 P63/mmc 0.53502,0.53502,0.88165,90,90,120 Friauf-Laves phase - 15.82 A 18381
Ce-Os CeOs2 ht MgCu2,cF24,227 Fd-3m 0.75934,0.75934,0.75934,90,90,90 Friauf-Laves phase - 15.79 X 18381
Ce-Os Ce3Os Fe3C-b,oP16,62 Pnma 0.7348,0.967,0.6378,90,90,90 - - 8.95 A 13335
Ce-P CeP hp CsCl,cP2,221 Pm-3m 0.328,0.328,0.328,90,90,90 b.c.c. family - 8.05 X 20319
Ce-P CeP rt NaCl,cF8,225 Fm-3m 0.592,0.592,0.592,90,90,90 rocksalt family - 5.48 X 27909
Ce-P CeP2 ht LaP 2 ,mS48,9 C1c1 1.26719,1.3967,0.8962,90,134.97,90 - - 4.78 A 33115
Ce-P CeP2 rt NdAs2,mP12,14 P121/c1 0.4066,0.6577,1.0157,90,105.67,90 - - 5.13 A 37962
Ce-P CeP5 hp NdP 5,mP12,11 P121/m1 0.49143,0.96226,0.55152,90,104.303,90 - black 3.88 X 43126
Ce-P CeP5 LaP 5 ,mP24,11 P121/m1 0.5501,0.9618,0.9831,90,104.21,90 - black 3.89 X 35312
Ce-Pb CePb2 CuZr2,tI6,139 I4/mmm 0.3315,0.3315,1.6187,90,90,90 close-packed structure - 10.35 A 28918
Ce-Pb CePb3 Cu3Au,cP4,221 Pm-3m 0.4876,0.4876,0.4876,90,90,90 close-packed structure - 10.91 X 16606
Ce-Pb Ce3Pb Cu3Au,cP4,221 Pm-3m 0.4964,0.4964,0.4964,90,90,90 close-packed structure - 8.52 X 2296
Ce-Pb Ce5Pb3 Mn5 Si3,hP16,193 P63/mcm 0.9473,0.9473,0.6825,90,90,120 - - 8.28 A 2485
Ce-Pb Ce5Pb4 Sm5 Ge4,oP36,62 Pnma 0.8435,1.615,0.8571,90,90,90 - - 8.70 A 4345
Ce-Pd CePd rt TlI,oS8,63 Cmcm 0.38893,1.0932,0.46229,90,90,90 CrB(TlI)-FeB - 8.33 A 52913
Ce-Pd CePd3 Cu3Au,cP4,221 Pm-3m 0.4135,0.4135,0.4135,90,90,90 close-packed structure - 10.79 X 22042
Ce-Pd CePd5 hex CaCu5,hP6,191 P6/mmm 0.5373,0.5373,0.4177,90,90,120 - - 10.69 X 22253
Ce-Pd CePd5 ht *,c**,* - 0.4056,0.4056,0.4056,90,90,90 - - - N 24294
Ce-Pd CePd5 lt CePd5,oP12,51 Pmma 0.57004,0.40622,0.84617,90,90,90 - - 11.39 X 26064
Ce-Pd CePd7 ht *,h**,* - 0.2594,0.2594,0.4133,90,90,120 - - - N 24294
Ce-Pd Ce0.12Pd0.88 rt Cu,cF4,225 Fm-3m 0.3997,0.3997,0.3997,90,90,90 close-packed structure - 11.49 X 22253
Ce-Pd Ce0.77Pd7.23 rt CuPt7,cF32,225 Fm-3m 0.7946,0.7946,0.7946,90,90,90 close-packed structure - 11.61 X 52913
Ce-Pd Ce3Pd4 Pu3Pd4,hR42,148 R-3 1.3699,1.3699,0.5813,90,90,120 b.c.c. family - 8.92 A 52913
Ce-Pd Ce3Pd5 Th3Pd5,hP8,189 P-62m 0.725,0.725,0.385,90,90,120 AlB2 family - 9.02 A 18120
Ce-Pd Ce7Pd3 Th7Fe3,hP20,186 P63mc 1.021,1.021,0.644,90,90,120 - - 7.43 A 18120
Ce-Pr Ce0.95Pr0.05 rt Cu,cF4,225 Fm-3m 0.51609,0.51609,0.51609,90,90,90 close-packed structure - 6.77 X 1566
Ce-Pt CePt TlI,oS8,63 Cmcm 0.3884,1.0845,0.4517,90,90,90 CrB(TlI)-FeB - 11.70 X 28090
Ce-Pt CePt2 MgCu2,cF24,227 Fd-3m 0.7741,0.7741,0.7741,90,90,90 Friauf-Laves phase - 15.19 X 54239
Ce-Pt CePt5 CaCu5,hP6,191 P6/mmm 0.5365,0.5365,0.4379,90,90,120 - - 16.97 X 22933
Ce-Pt Ce3Pt2 rt Er3Ni2,hR45,148 R-3 0.8962,0.8962,1.7119,90,90,120 - - 10.17 A 54239
Ce-Pt Ce3Pt4 Pu3Pd4,hR42,148 R-3 1.3683,1.3683,0.5796,90,90,120 b.c.c. family - 12.73 A 54239
Ce-Pt Ce5Pt3 Pu5Rh3,tP32,130 P4/ncc 1.1405,1.1405,0.6648,90,90,90 - - 9.88 A 54239
Ce-Pt Ce5Pt4 ht Sm5 Ge4,oP36,62 Pnma 0.7665,1.5066,0.7616,90,90,90 - - 11.18 A 54239
Ce-Pt Ce7Pt3 Th7Fe3,hP20,186 P63mc 1.021,1.021,0.6403,90,90,120 - - 9.00 A 54239
Ce-Pu Ce0.01Pu0.99 ht1 Pu,mS34,12 C12/m1 1.19433,1.0451,0.7852,90,129.013,90 - - 18.01 A 1817
Ce-Pu Ce0.08Pu0.92 ht3 Cu,cF4,225 Fm-3m 0.4659,0.4659,0.4659,90,90,90 close-packed structure - 15.48 X 1345
Ce-Pu Ce0.5 Pu0.5 m Cu,cF4,225 Fm-3m 0.476,0.476,0.476,90,90,90 close-packed structure - 11.83 X 9246
Ce-Pu Ce0.7 Pu0.3 lt Cu,cF4,225 Fm-3m 0.5009,0.5009,0.5009,90,90,90 close-packed structure - 9.05 X 1172
Ce-Rh CeRh TlI,oS8,63 Cmcm 0.3844,1.0946,0.4174,90,90,90 CrB(TlI)-FeB - 9.19 A 55045
Ce-Rh CeRh2 MgCu2,cF24,227 Fd-3m 0.7545,0.7545,0.7545,90,90,90 Friauf-Laves phase - 10.70 X 27404
60 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ce-Rh CeRh3 Cu3Au,cP4,221 Pm-3m 0.40284,0.40284,0.40284,90,90,90 close-packed structure - 11.40 X 53420


Ce-Rh Ce3Rh2 Er3Ni2,hR45,148 R-3 0.8858,0.8858,1.6794,90,90,120 - - 8.20 A 27404
Ce-Rh Ce5Rh3 rt Pu5Rh3,tP32,130 P4/ncc 1.126,1.126,0.645,90,90,90 - - 8.20 A 27404
Ce-Rh Ce5Rh4 Sm5Ge4,oP36,62 Pnma 0.7434,1.486,0.7604,90,90,90 - - 8.79 X 9915
Ce-Rh Ce7Rh3 Th7Fe3,hP20,186 P63 mc 1.0051,1.0051,0.6378,90,90,120 - - 7.68 A 27404
Ce-Ru CeRu2 rt MgCu2,cF24,227 Fd-3m 0.7545,0.7545,0.7545,90,90,90 Friauf-Laves phase - 10.59 X 24757
Ce-Ru Ce0.05 Ru0.95 Mg,hP2,194 P63 /mmc 0.2718,0.2718,0.4298,90,90,120 close-packed structure - 12.44 X 17698
Ce-Ru Ce16Ru9 Ce16Ru9,hR150,166 R-3m 1.3645,1.3645,2.2742,90,90,120 - - 8.56 X 25612
Ce-Ru Ce3Ru Fe3C-b,oP16,62 Pnma 0.7242,0.9863,0.6419,90,90,90 - - 7.55 X 24757
Ce-Ru Ce4Ru3 Ce4Ru3,mS28,12 C12/m1 0.8400,1.3837,0.5985,90,117.90,90 - - 9.33 X 26910
Ce-Ru Ce7Ru3 Th7Fe3,hP20,186 P63 mc 0.9802,0.9802,0.6261,90,90,120 - - 8.19 X 24757
Ce-S CeS NaCl,cF8,225 Fm-3m 0.5785,0.5785,0.5785,90,90,90 rocksalt family golden 5.91 X 13631
Ce-S CeS2 cub *,cF*,* - 0.808,0.808,0.808,90,90,90 - - - N 27345
Ce-S CeS2 hp LaS2,oP24,62 Pnma 0.8068,1.6216,0.4095,90,90,90 - red dark 5.06 X 53589
Ce-S CeS2 mon CeSe2,mP12,14 P121/c1 0.8097,0.4075,0.8105,90,89.97,90 - red dark 5.07 X 53589
Ce-S Ce10S15 Pr10S14O,tI200,142 I41/acd 1.52326,1.52326,2.0096,90,90,90 - - 5.36 A 59395
Ce-S Ce10S19 tet Ce10Se19,tP58,86 P42 /n 0.9015,0.9015,1.6168,90,90,90 - black 5.08 X 49625
Ce-S Ce2S3 cub *,cF*,227 Fd-3m 2.031,2.031,2.031,90,90,90 - - - N 5510
Ce-S Ce2S3 orth *,o**,* - 0.7554,1.064,1.3187,90,90,90 - - - N 27345
Ce-S Ce2S3 rt Cr3C2-b,oP20,62 Pnma 0.75323,0.40967,1.57276,90,90,90 - red dark 5.15 X 36545
Ce-S Ce2.67 S4 ht Th3P 4,cI28,220 I-43d 0.8651,0.8651,0.8651,90,90,90 - red dark 5.15 X 30219
Ce-S Ce3S4 rt Th3P 4,cI28,220 I-43d 0.863,0.863,0.863,90,90,90 - black 5.67 A 4496
Ce-S Ce4.67 S7 rt *,tI192,142 I41/acd 1.534,1.534,2.033,90,90,90 - - - N 5180
Ce-Sb CeSb hp CuTi,tP2,123 P4/mmm 0.3933,0.3933,0.3209,90,90,90 b.c.c. family - 8.76 X 17187
Ce-Sb CeSb lt *,t*8,* - 0.6407,0.6407,0.6392,90,90,90 - - - N 4826
Ce-Sb CeSb rt NaCl,cF8,225 Fm-3m 0.64208,0.64208,0.64208,90,90,90 rocksalt family - 6.57 X 33308
Ce-Sb CeSb2 rt SmSb2,oS24,64 Cmce 0.62807,0.61561,1.8267,90,90,90 - - 7.22 A 42303
Ce-Sb Ce2Sb La2Sb,tI12,139 I4/mmm 0.4538,0.4538,1.7861,90,90,90 - - 7.26 X 41027
Ce-Sb Ce4Sb3 Th3P 4,cI28,220 I-43d 0.9519,0.9519,0.9519,90,90,90 - gray 7.13 X 52717
Ce-Sb Ce5Sb3 Mn5Si3,hP16,193 P63 /mcm 0.9302,0.9302,0.6514,90,90,120 - - 7.25 X 3842
Ce-Sc Sc0.17 Ce0.83 ht1 Cu,cF4,225 Fm-3m 0.51236,0.51236,0.51236,90,90,90 close-packed structure - 6.12 X 1566
Ce-Se CeSe rt NaCl,cF8,225 Fm-3m 0.599,0.599,0.599,90,90,90 rocksalt family red wine 6.77 X 27909
Ce-Se CeSe1.75 *,mP24,14 P121/c1 0.8487,0.8375,0.8375,90,90.,90 - - - N 3542
Ce-Se CeSe1.83 UAs2,tP6,129 P4/nmm 0.4178,0.4178,0.8471,90,90,90 - black 6.39 X 53531
Ce-Se CeSe2 CeSe2,mP12,14 P121/c1 0.8482,0.4210,0.8420,90,90,90 - - 6.58 X 3969
Ce-Se Ce10Se19 Ce10Se19,tP58,86 P42 /n 0.93598,0.93598,1.6938,90,90,90 - - 6.49 X 22528
Ce-Se Ce2.67 Se4 ht Th3P 4,cI28,220 I-43d 0.89774,0.89774,0.89774,90,90,90 - red dark 6.33 X 43934
Ce-Si CeSi FeB-b,oP8,62 Pnma 0.83002,0.39522,0.59519,90,90,90 CrB(TlI)-FeB gray 5.72 X 28960
Ce-Si CeSi1.82 GdSi1.4 ,oI12,74 Imma 0.41802,0.41859,1.38501,90,90,90 - gray 5.24 X 45759
Ce-Si CeSi2 ThSi2,tI12,141 I41/amd 0.41874,0.41874,1.3904,90,90,90 - - 5.35 X 46628
Ce-Si CeSi5 hp LaGe5,oI12,71 Immm 0.37774,0.60189,0.92979,90,90,90 - - 4.41 X 53640
Ce-Si Ce0.0021 Si0.9979 C,cF8,227 Fd-3m 0.5428,0.5428,0.5428,90,90,90 - - 2.35 X 56799
Ce-Si Ce2Si2.7 V2B3,oS20,63 Cmcm 0.44043,2.48498,0.39527,90,90,90 - - 5.47 X 27435
Ce-Si Ce2Si7 hp Ce2Si7,oS18,65 Cmmm 0.70893,0.99644,0.44868,90,90,90 - - 5.00 X 53640
Ce-Si Ce3Si2 U3Si2,tP10,127 P4/mbm 0.7717,0.7717,0.437,90,90,90 - - 6.08 A 56799
Ce-Si Ce5Si3 (C) *,t**,* - 1.101,1.101,0.403,90,90,90 - - - N 17145
Ce-Si Ce5Si3 rt Cr5B3,tI32,140 I4/mcm 0.789,0.789,1.377,90,90,90 - - 6.08 X 2647
Ce-Si Ce5Si4 Zr5Si4,tP36,92 P41212 0.79539,0.79539,1.50723,90,90,90 - - 5.66 X 52559
Ce-Sm Ce0.4 Sm0.6 rt Nd,hP4,194 P63 /mmc 0.36477,0.36477,1.176,90,90,120 close-packed structure - 7.17 X 4096
Ce-Sm Ce0.8 Sm0.2 rt Cu,cF4,225 Fm-3m 0.51564,0.51564,0.51564,90,90,90 close-packed structure - 6.89 X 4096
Ce-Sn CeSn3 Cu3Au,cP4,221 Pm-3m 0.4722,0.4722,0.4722,90,90,90 close-packed structure - 7.83 X 13609
Ce-Sn Ce0.725 Sn0.275 ht Cu,cF4,225 Fm-3m 0.505,0.505,0.505,90,90,90 close-packed structure gray 6.92 X 15258
Ce-Sn Ce11Sn10 orth *,o**,* - 0.43868,0.94176,1.17954,90,90,90 - gray - N 24908
Ce-Sn Ce11Sn10 tet Ho11Ge10,tI84,139 I4/mmm 1.212,1.212,1.795,90,90,90 - - 6.87 A 31605
Ce-Sn Ce2Sn3 Nd2Sn3,aP20,2 P-1 0.6444,0.851,1.1195,107.36,96.78,99.42 - - 7.43 A 42507
Ce-Sn Ce2Sn5 Ce2Sn5,oS28,65 Cmmm 0.4559,3.5014,0.4619,90,90,90 close-packed structure - 7.87 X 21073
Ce-Sn Ce3Sn rt Cu3Au,cP4,221 Pm-3m 0.49479,0.49479,0.49479,90,90,90 close-packed structure gray 7.39 X 24908
Ce-Sn Ce3Sn5 Pu3Pd5,oS32,63 Cmcm 1.02485,0.82003,1.0569,90,90,90 - - 7.58 A 24908
Ce-Sn Ce3Sn7 Ce3Sn7,oS20,65 Cmmm 0.4524,2.5742,0.4610,90,90,90 close-packed structure - 7.74 X 21073
Ce-Sn Ce5Sn3 ht Mn5Si3,hP16,193 P63 /mcm 0.9316,0.9316,0.6833,90,90,120 - - 6.83 A 24908
Ce-Sn Ce5Sn3 rt W5Si3,tI32,140 I4/mcm 1.2582,1.2582,0.6202,90,90,90 - gray 7.15 X 26292
Ce-Sn Ce5Sn4 Sm5Ge4,oP36,62 Pnma 0.8333,1.6001,0.8473,90,90,90 - gray 6.91 X 26292
Ce-Tb Ce0.25 Tb0.75 rt Mg,hP2,194 P63 /mmc 0.36285,0.36285,0.57577,90,90,120 close-packed structure - 7.80 X 4096
Ce-Tb Ce0.4 Tb0.6 rt Sm,hR9,166 R-3m 0.36247,0.36247,2.6159,90,90,120 close-packed structure - 7.60 A 4096
Ce-Tb Ce0.6 Tb0.4 rt Nd,hP4,194 P63 /mmc 0.36399,0.36399,1.172,90,90,120 close-packed structure - 7.29 X 4096
Ce-Tb Ce0.9 Tb0.1 rt Cu,cF4,225 Fm-3m 0.5154,0.5154,0.5154,90,90,90 close-packed structure - 6.89 X 4096
Ce-Te CeTe rt NaCl,cF8,225 Fm-3m 0.636,0.636,0.636,90,90,90 rocksalt family blue 6.91 X 27909
Ce-Te CeTe2 CeTe2,tP72,75 P4 0.89975,0.89975,1.8212,90,90,90 - black 7.12 X 37375
Ce-Te CeTe3 CeTe3,oS16,40 Ama2 0.43849,2.59733,0.43732,90,90,90 - brown 6.97 X 44787
Ce-Te Ce10Te19 Ce10Se19,tP58,86 P42 /n 1.00261,1.00261,1.81336,90,90,90 - black 6.97 X 47064
Ce-Te Ce2Te5 ht Nd2Te5,oS28,63 Cmcm 0.442,4.435,0.442,90,90,90 - lilac 7.04 A 3545
Ce-Te Ce3Te4 Th3P 4,cI28,220 I-43d 0.95297,0.95297,0.95297,90,90,90 - gray 7.14 X 56218
Ce-Te Ce4Te7 *,tP22,127 P4/mbm 0.8988,0.8988,0.9167,90,90,90 - black - N 3545
Ce-Th Th0.1 Ce0.9 rt Cu,cF4,225 Fm-3m 0.5137,0.5137,0.5137,90,90,90 close-packed structure - 7.32 X 51201
Ce-Tl TlCe lt CuTi,tP2,123 P4/mmm 0.367,0.367,0.434,90,90,90 b.c.c. family - 9.79 X 14458
Ce-Tl TlCe rt CsCl,cP2,221 Pm-3m 0.3888,0.3888,0.3888,90,90,90 b.c.c. family - 9.73 X 14458
Ce-Tl TlCe3 rt Cu3Au,cP4,221 Pm-3m 0.495,0.495,0.495,90,90,90 close-packed structure - 8.55 X 13849
Ce-Tl Tl0.25 Ce0.75 ht Cu,cF4,225 Fm-3m 0.501,0.501,0.501,90,90,90 close-packed structure - 8.25 X 13849
Handbook of Inorganic Substances – Edition 2015 : Data 61

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ce-Tl Tl3Ce Cu3Au,cP4,221 Pm-3m 0.47674,0.47674,0.47674,90,90,90 close-packed structure - 11.54 X 13385


Ce-Tl Tl3Ce 5 W5Si3,tI32,140 I4/mcm 1.265,1.265,0.6197,90,90,90 - - 8.80 A 13849
Ce-Tl Tl5Ce 3 Pu3Pd5,oS32,63 Cmcm 1.0325,0.832,1.0555,90,90,90 - - 10.57 A 13849
Ce-Tm Ce0.98 Tm0.02 rt Cu,cF4,225 Fm-3m 0.51575,0.51575,0.51575,90,90,90 close-packed structure - 6.81 X 1566
Ce-Y Y0.1 Ce0.9 ht1 Cu,cF4,225 Fm-3m 0.51596,0.51596,0.51596,90,90,90 close-packed structure - 6.53 X 3146
Ce-Y Y0.25 Ce0.75 rt Nd,hP4,194 P63/mmc 0.3668,0.3668,1.175,90,90,120 close-packed structure - 6.18 X 20316
Ce-Y Y0.45 Ce0.55 rt Sm,hR9,166 R-3m 0.36677,0.36677,2.6448,90,90,120 close-packed structure - 5.68 A 3146
Ce-Y Y0.7 Ce0.3 rt Mg,hP2,194 P63/mmc 0.3675,0.3675,0.57981,90,90,120 close-packed structure - 5.11 X 3146
Ce-Yb Ce0.75 Yb0.25 m Cu,cF4,225 Fm-3m 0.497,0.497,0.497,90,90,90 close-packed structure - 8.03 X 27427
Ce-Zn ZnCe hp AuCd,oP4,51 Pmma 0.445,0.2704,0.5229,90,90,90 close-packed structure - 10.85 A 33099
Ce-Zn ZnCe lt CuTi,tP2,123 P4/mmm 0.3677,0.3677,0.3745,90,90,90 b.c.c. family - 6.74 X 23968
Ce-Zn ZnCe rt CsCl,cP2,221 Pm-3m 0.3694,0.3694,0.3694,90,90,90 b.c.c. family - 6.77 X 23968
Ce-Zn Zn11 Ce BaCd11,tI48,141 I41/amd 1.06588,1.06588,0.68626,90,90,90 - - 7.32 X 44079
Ce-Zn Zn11 Ce3 La3Al11,oI28,71 Immm 0.45242,0.88942,1.34754,90,90,90 - - 6.98 X 56903
Ce-Zn Zn17 Ce2 hex Th2Ni17,hP38,194 P63/mmc 0.9088,0.9088,0.8856,90,90,120 CaCu5-Zr4Al3 - 7.30 A 3579
Ce-Zn Zn17 Ce2 rhom Zn17 Th2,hR57,166 R-3m 0.90907,0.90907,1.32847,90,90,120 CaCu5-Zr4Al3 gray 7.29 X 20156
Ce-Zn Zn2Ce KHg2,oI12,74 Imma 0.4639,0.7552,0.751,90,90,90 AlB2 family - 6.84 X 6756
Ce-Zn Zn22 Ce3 Zn22 Ce3,tI100,141 I41/amd 0.89363,0.89363,2.13804,90,90,90 - - 7.23 X 56903
Ce-Zn Zn3Ce Zn3Ce,oS16,63 Cmcm 0.4627,1.0437,0.6644,90,90,90 - - 6.96 X 5331
Ce-Zn Zn5Ce CaCu5,hP6,191 P6/mmm 0.543,0.543,0.428,90,90,120 - - 7.10 X 20269
Ce-Zn Zn5.66 Ce0.67 rt Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.52424,0.52424,0.44274,90,90,120 CaCu5-Zr4Al3 - 7.31 X 56903
Ce-Zn Zn58 Ce13 Zn58 Gd13,hP142,194 P63/mmc 1.4638,1.4638,1.4158,90,90,120 - - 7.10 X 47696
Ce-Zr Ce0.07 Zr0.93 rt Mg,hP2,194 P63/mmc 0.3234,0.3234,0.51531,90,90,120 close-packed structure - 6.73 X 2235
Cf-Cl CfCl3 ht PuBr3,oS16,63 Cmcm 0.3869,1.1748,0.8561,90,90,90 - - 6.10 X 7512
Cf-Cl CfCl3 rt UCl3,hP8,176 P63/m 0.7379,0.7379,0.409,90,90,120 - - 6.15 X 7512
Cf-F CfF3 ht HoH3,hP24,165 P-3c1 0.6945,0.6945,0.7101,90,90,120 - - 10.35 A 7521
Cf-F CfF3 rt Fe3C-b,oP16,62 Pnma 0.6653,0.7039,0.4393,90,90,90 - - 9.94 A 7521
Cf-I CfI2 ht CdCl2,hR9,166 R-3m 0.45735,0.45735,2.08477,90,90,120 - - 6.66 A 11658
Cf-I CfI2 rt CdI2 ,hP3,164 P-3m1 0.4557,0.4557,0.6992,90,90,120 CdI2-PbI2 polytype - 6.67 A 11658
Cf-I CfI3 BiI3,hR24,148 R-3 0.75874,0.75874,2.08132,90,90,120 - - 6.07 A 11658
Cf-O CfO2 hp *,hR*,* - 0.75918,0.75918,0.93176,90,90,120 - - - N 6786
Cf-O CfO2 CaF2 ,cF12,225 Fm-3m 0.531,0.531,0.531,90,90,90 fluorite family black 12.56 X 6786
Cf-O Cf2O3 ht1 Sm2 O3,mS30,12 C12/m1 1.4101,0.3592,0.8796,90,100.16,90 - green lime 12.50 A 6786
Cf-O Cf2O3 ht2 La2O3,hP5,164 P-3m1 0.372,0.372,0.596,90,90,120 - - 12.79 A 7523
Cf-O Cf2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.085,1.085,1.085,90,90,90 - - 11.44 A 23688
Cf-Pt CfPt5 CaCu5,hP6,191 P6/mmm 0.5264,0.5264,0.4417,90,90,120 - - 19.21 X 23689
Cf-S CfS NaCl,cF8,225 Fm-3m 0.5744,0.5744,0.5744,90,90,90 rocksalt family - 9.92 X 9115
Cf-Sb CfSb NaCl,cF8,225 Fm-3m 0.6165,0.6165,0.6165,90,90,90 rocksalt family - 10.57 X 13272
Cl-Cm CmCl3 UCl3,hP8,176 P63/m 0.73743,0.73743,0.4185,90,90,120 - - 5.95 X 7513
Cl-Co CoCl2 rt CdCl2,hR9,166 R-3m 0.35434,0.35434,1.74311,90,90,120 - blue 3.41 X 77
Cl-Cr CrCl2 ht CrCl2,oP12,62 Pnma 1.1794,0.3429,0.6514,90,90,90 - - 3.10 X 33377
Cl-Cr CrCl2 rt CaCl2,oP6,58 Pnnm 0.59848,0.66439,0.34885,90,90,90 - - 2.94 X 45498
Cl-Cr CrCl3 lt BiI3,hR24,148 R-3 0.5942,0.5942,1.7333,90,90,120 - - 2.98 X 2245
Cl-Cr CrCl3 rt AlCl3,mS16,12 C12/m1 0.59588,1.03206,0.61138,90,108.495,90 - purple 2.95 X 2245
Cl-Cs CsCl ht NaCl,cF8,225 Fm-3m 0.693,0.693,0.693,90,90,90 rocksalt family - 3.36 X 18486
Cl-Cs CsCl rt CsCl,cP2,221 Pm-3m 0.4088,0.4088,0.4088,90,90,90 b.c.c. family - 4.09 X 5637
Cl-Cu CuCl hp1 CuCl,cP16,205 Pa-3 0.63104,0.63104,0.63104,90,90,90 - colorless 5.23 X 29368
Cl-Cu CuCl hp2 NaCl,cF8,225 Fm-3m 0.4929,0.4929,0.4929,90,90,90 rocksalt family colorless 5.49 X 29368
Cl-Cu CuCl hp3 ZnS,cF8,216 F-43m 0.5406,0.5406,0.5406,90,90,90 adamantane structure - 4.16 X 681
Cl-Cu CuCl ht ZnO,hP4,186 P63mc 0.3893,0.3893,0.6375,90,90,120 adamantane structure - 3.93 X 21887
Cl-Cu CuCl rt CuI,cF20,216 F-43m 0.54203,0.54203,0.54203,90,90,90 nantokite white 4.13 X 28259
Cl-Cu CuCl2 hp CuBr2,mS6,12 C12/m1 0.67986,0.32942,0.65324,90,118.981,90 tolbachite brown 3.49 X 53225
Cl-Cu Cu3Cl4 tf Fe3O4,cF56,227 Fd-3m 0.8265,0.8265,0.8265,90,90,90 spinel family - 7.82 X 1709
Cl-D DCl lt1 HCl,cF52,225 Fm-3m 0.547,0.547,0.547,90,90,90 - - 1.52 X 3685
Cl-D DCl lt3 HCl,oS8,36 Cmc21 0.5825,0.5053,0.5373,90,90,90 - - 1.57 X 3684
Cl-Dy DyCl2 mon *,mP24,14 P121/c1 0.681,1.329,0.71,90,91.56,90 - black - N 25355
Cl-Dy DyCl2 rt *,o*12,* - 0.669,0.676,0.706,90,90,90 - - 4.86 N 3089
Cl-Dy DyCl2 tet SrBr2,tP30,85 P4/n 1.07713,1.07713,0.66394,90,90,90 - - 5.03 A 19071
Cl-Dy DyCl3 ht AlCl3,mS16,12 C12/m1 0.69048,1.19607,0.6398,90,111.18,90 - - 3.62 A 19071
Cl-Dy DyCl3 rt PuBr3,oS16,63 Cmcm 0.3816,1.1815,0.8507,90,90,90 - - 4.66 X 24189
Cl-Dy Dy5 Cl11 Dy5Cl11,mP64,11 P121/m1 0.6634,3.468,0.7110,90,90.23,90 - - 4.88 X 9497
Cl-Dy Dy6 Cl13 Sm6 Br13,mS76,15 C12/c1 4.1835,0.6667,0.7096,90,98.383,90 - - 4.87 A 9497
Cl-Er ErCl3 hp2 FeF3 ,hR24,167 R-3c 0.6457,0.6457,1.81,90,90,120 - - 4.17 A 16653
Cl-Er ErCl3 hp3 PuBr3,oS16,63 Cmcm 0.376,1.1868,0.8487,90,90,90 - - 4.80 A 16678
Cl-Er ErCl3 AlCl3,mS16,12 C12/m1 0.68116,1.17986,0.63932,90,110.778,90 - - 3.78 A 22436
Cl-Eu EuCl2 ht CaF2 ,cF12,225 Fm-3m 0.715,0.715,0.715,90,90,90 fluorite family - 4.05 X 10125
Cl-Eu EuCl2 rt PbCl2,oP12,62 Pnma 0.7538,0.4511,0.8965,90,90,90 - - 4.86 X 7753
Cl-Eu EuCl3 UCl3,hP8,176 P63/m 0.73746,0.73746,0.41323,90,90,120 - - 4.41 X 4117
Cl-Eu Eu14 Cl33 ht1 *,hR*,148 R-3 1.2815,1.2815,2.4768,90,90,120 - - - N 21984
Cl-Eu Eu3Cl7 *,hP10,* - 0.4841,0.4841,1.241,90,90,120 - - 4.64 N 10950
Cl-Eu Eu4Cl9 rt *,o*52,* - 0.6693,0.6956,0.7108,90,90,90 - - - N 14564
Cl-Eu Eu5Cl11 ht1 *,oP*,62 Pnma 0.7253,3.535,0.681,90,90,90 - blue - N 25901
Cl-Eu Eu5Cl11 rt Dy5Cl11,mP64,11 P121/m1 0.6758,3.509,0.7201,90,90.3,90 - blue 4.47 X 25901
Cl-F ClF ClF,mP8,14 P121/c1 0.6378,0.4247,0.6425,90,104.55,90 - - 2.15 X 32738
Cl-F ClF3 lt1 ClF3 ,oP16,62 Pnma 0.8825,0.609,0.452,90,90,90 - - 2.53 X 517
Cl-F ClF3 lt2 ClF3 ,mP32,14 P121/c1 0.8051,0.4402,1.4612,90,96.05,90 - - 2.38 X 22818
Cl-F ClF5 lt2 *,cI12,* - 0.57,0.57,0.57,90,90,90 - - 2.34 N 11437
Cl-F ClF5 lt3 BrF5 ,oS24,36 Cmc21 0.617,0.722,0.766,90,90,90 - - 2.54 A 11437
62 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cl-Fe FeCl2 hp CdI2,hP3,164 P-3m1 0.35429,0.35429,0.5502,90,90,120 CdI2 -PbI2 polytype - 3.52 X 53211
Cl-Fe FeCl2 CdCl2,hR9,166 R-3m 0.3598,0.3598,1.7481,90,90,120 lawrencite - 3.22 X 9141
Cl-Fe FeCl3 12-lay FeCl3,hP96,147 P-3 0.6063,0.6063,6.97,90,90,120 - greenish 2.91 X 28041
Cl-Fe FeCl3 3-lay1 BiI3,hR24,148 R-3 0.6056,0.6056,1.7407,90,90,120 molysite green 2.92 X 28041
Cl-Fe FeCl3 3-lay2 Ti3O,hP24,149 P312 0.6056,0.6056,1.7401,90,90,120 - green 2.92 X 28041
Cl-Ga GaCl2 ht GaCl2,oP24,52 Pnna 0.72,0.9625,0.9498,90,90,90 - white 2.84 X 20923
Cl-Ga GaCl3 GaCl3,mS16,12 C12/m1 1.1948,0.6855,0.705,90,125.69,90 - colorless 2.49 X 44054
Cl-Ga Ga3Cl7 Ga3Cl7,oP40,33 Pna21 1.1818,0.8897,1.0575,90,90,90 - - 2.73 X 24304
Cl-Gd GdCl ht (H) ZrBr,hR12,166 R-3m 0.3819,0.3819,2.7482,90,90,120 - - 5.53 A 13789
Cl-Gd GdCl rt ZrCl,hR12,166 R-3m 0.3819,0.3819,2.7482,90,90,120 - gray 5.53 X 9701
Cl-Gd GdCl3 ht UCl3,hP8,176 P63 /m 0.73663,0.73663,0.41059,90,90,120 - - 4.54 X 4117
Cl-Gd GdCl3 rt PuBr3,oS16,63 Cmcm 0.388,1.173,0.852,90,90,90 - - 4.52 A 2691
Cl-Gd Gd2Cl3 Gd2Cl3,mS20,12 C12/m1 1.5231,0.3895,1.0175,90,117.64,90 - bronze 5.23 X 12819
Cl-Ge GeCl4 lt SnBr4,mP20,14 P121/c1 0.969,0.6451,0.9774,90,103.075,90 - colorless 2.39 X 39723
Cl-Ge Ge3Cl8 Si3Cl8,cF176,219 F-43c 1.7437,1.7437,1.7437,90,90,90 - - 2.51 X 34371
Cl-H HCl lt1 HCl,cF52,225 Fm-3m 0.5482,0.5482,0.5482,90,90,90 - - 1.47 X 6858
Cl-H HCl lt3 HCl,oS8,36 Cmc21 0.571,0.503,0.535,90,90,90 - - 1.58 A 59
Cl-Hf HfCl ZrBr,hR12,166 R-3m 0.33697,0.33697,2.6582,90,90,120 - gray 8.15 A 10634
Cl-Hf HfCl4 ZrCl4,mP10,13 P12/c1 0.6327,0.7377,0.62,90,109.05,90 - colorless 3.89 X 31174
Cl-Hg HgCl rt HgCl,tI8,139 I4/mmm 0.44795,0.44795,1.09054,90,90,90 calomel - 7.16 X 23045
Cl-Hg HgCl2 HgCl2-b,oP12,62 Pnma 1.2776,0.5986,0.4333,90,90,90 - brown 5.44 X 12998
Cl-Ho HoCl2 *,oP12,* - 0.656,0.687,0.703,90,90,90 - - - N 22787
Cl-Ho HoCl3 hp PuBr3,oS16,63 Cmcm 0.3792,1.1844,0.8497,90,90,90 - - 4.72 A 16678
Cl-Ho HoCl3 AlCl3,mS16,12 C12/m1 0.685,1.185,0.639,90,110.8,90 - - 3.72 A 631
Cl-Ho Ho5Cl11 Dy5Cl11,mP64,11 P121/m1 0.6603,3.457,0.7078,90,90.19,90 - - 4.99 A 10636
Cl-I ICl mon1 ICl-a,mP16,14 P121/c1 1.2162,0.4286,1.1889,90,117.5,90 - red dark 3.92 X 36783
Cl-I ICl mon2 ICl-b,mP16,14 P121/c1 0.8883,0.8400,0.7568,90,91.35,90 - - 3.82 X 1594
Cl-I ICl3 ICl3,aP8,2 P-1 0.548,0.571,0.839,72.10,78.78,80.83 - yellow 3.18 X 562
Cl-In InCl ht InCl,oS8,40 Ama2 0.4689,1.232,0.4242,90,90,90 - red 4.07 X 11283
Cl-In InCl rt InCl,cP64,198 P213 1.2373,1.2373,1.2373,90,90,90 rocksalt family yellow 4.22 X 11283
Cl-In InCl2 ht GaCl2,oP24,52 Pnna 0.71,1.069,1.021,90,90,90 - - 3.18 A 3157
Cl-In InCl3 AlCl3,mS16,12 C12/m1 0.641,1.11,0.631,90,109.8,90 - - 3.48 A 631
Cl-In In2Cl3 rt Tl2Cl3,oP160,62 Pnma 1.2614,2.5238,1.4562,90,90,90 - colorless 3.85 X 14705
Cl-In In5Cl9 rt In5Cl9,hR84,167 R-3c 1.2343,1.2343,1.7831,90,90,120 - colorless 3.78 X 16683
Cl-In In7Cl9 rt In7Cl9,cP64,205 Pa-3 1.2218,1.2218,1.2218,90,90,90 - yellow 4.09 X 24497
Cl-Ir IrCl3 mon AlCl3,mS16,12 C12/m1 0.599,1.037,0.599,90,109.4,90 - brown 5.65 X 2756
Cl-Ir IrCl3 orth IrCl3,oF64,70 Fddd 0.695,0.981,2.082,90,90,90 - red dark 5.59 X 2848
Cl-K KCl hp CsCl,cP2,221 Pm-3m 0.3634,0.3634,0.3634,90,90,90 b.c.c. family - 2.58 X 14145
Cl-K KCl NaCl,cF8,225 Fm-3m 0.62849,0.62849,0.62849,90,90,90 sylvite colorless 1.99 X 46487
Cl-La LaCl ZrCl,hR12,166 R-3m 0.41026,0.41026,2.7597,90,90,120 - blue 4.32 X 14160
Cl-La LaCl3 UCl3,hP8,176 P63 /m 0.74779,0.74779,0.43745,90,90,120 - - 3.85 X 4117
Cl-Li LiCl hp NaCl,cF8,225 Fm-3m 0.51741,0.51741,0.51741,90,90,90 rocksalt family - 2.03 X 57917
Cl-Li LiCl tf ZnO,hP4,186 P63 mc 0.3852,0.3852,0.6118,90,90,120 adamantane structure - 1.79 X 53463
Cl-Lu LuCl3 hp FeF3,hR24,167 R-3c 0.6403,0.6403,1.7868,90,90,120 - - 4.42 A 16653
Cl-Lu LuCl3 AlCl3,mS16,12 C12/m1 0.672,1.16,0.639,90,110.4,90 - - 4.00 A 631
Cl-Mg MgCl2 rhom CdCl2,hR9,166 R-3m 0.36363,0.36363,1.76663,90,90,120 chloromagnesite - 2.35 X 25117
Cl-Mg MgCl2 trig CdI2,hP3,164 P-3m1 0.3641,0.3641,0.5927,90,90,120 CdI2 -PbI2 polytype - 2.32 X 15713
Cl-Mn MnCl2 CdCl2,hR9,166 R-3m 0.3711,0.3711,1.759,90,90,120 scacchite - 2.99 X 24264
Cl-Mo MoCl2 MoCl2,oS72,64 Cmce 1.4054,1.1244,1.1267,90,90,90 Chevrel phase yellow 3.73 X 28309
Cl-Mo MoCl3 ht AlCl3,mS16,12 C12/m1 0.6092,0.9745,0.63012,90,108.132,90 - black 3.78 X 3762
Cl-Mo MoCl3 rt mon1 MoCl3,mS16,12 C12/m1 0.6098,0.9757,0.6301,90,108.06,90 - brown 3.77 X 33101
Cl-Mo MoCl3 rt mon2 MoCl3,mS36,12 C12/m1 0.6094,0.9801,1.2026,90,92.79,90 - brown 3.75 X 33101
Cl-Mo MoCl4 ht MoCl4,hP30,162 P-31m 1.209,1.209,0.586,90,90,120 - black 3.19 X 14082
Cl-Mo MoCl4 rt NbCl4,mS20,12 C12/m1 1.19029,0.6778,0.8236,90,131.772,90 - - 3.19 A 15502
Cl-Mo MoCl5 mon1 MoCl5,mS72,12 C12/m1 1.731,1.781,0.6079,90,95.7,90 - black 2.92 X 1068
Cl-Mo MoCl5 mon2 ReCl5,mP48,14 P121/c1 0.94682,1.17496,1.21619,90,108.879,90 - - 2.84 X 32868
Cl-Mo MoCl5 orth MoCl5,oP48,62 Pnma 1.1700,1.7874,0.6085,90,90,90 - black 2.85 X 32868
Cl-Mo MoCl5 tricl UCl5,aP12,2 P-1 0.6074,0.65941,0.9048,108.424,90.81,116.124 - - 2.99 X 32868
Cl-N Cl[N3] Cl[N3],oS16,36 Cmc21 0.56456,1.17515,0.43077,90,90,90 - yellow 1.80 X 57537
Cl-N NCl3 NCl3,oP48,62 Pnma 0.748,0.935,1.648,90,90,90 - yellow 2.08 X 9415
Cl-Na NaCl hp CsCl,cP2,221 Pm-3m 0.27376,0.27376,0.27376,90,90,90 b.c.c. family - 4.73 X 58415
Cl-Na NaCl NaCl,cF8,225 Fm-3m 0.50639,0.50639,0.50639,90,90,90 halite colorless 2.99 X 58415
Cl-Nb NbCl4 rt NbCl4,mS20,12 C12/m1 1.1823,0.6823,0.8140,90,131.56,90 - brown dark 3.17 X 10653
Cl-Nb NbCl5 mon1 NbCl5,mS72,12 C12/m1 1.8338,1.7861,0.5890,90,90.69,90 - yellow 2.79 X 24254
Cl-Nb NbCl5 mon2 UCl5,mP24,14 P121/c1 0.7785,1.0201,1.1159,90,133.655,90 - yellow 2.80 X 24413
Cl-Nb Nb3Cl7 Nb3Cl7,oS80,64 Cmce 1.3494,1.2252,1.1019,90,90,90 Chevrel phase black 3.84 X 2846
Cl-Nb Nb3Cl8 Nb3Cl8,hP22,164 P-3m1 0.67295,0.67295,1.2232,90,90,120 - - 3.89 X 39474
Cl-Nd NdCl2 PbCl2,oP12,62 Pnma 0.76147,0.45562,0.90849,90,90,90 - green 4.53 X 18633
Cl-Nd NdCl2.31 *,tI100,87 I4/m 1.1041,1.1041,2.1209,90,90,90 - - 4.36 N 21976
Cl-Nd NdCl3 UCl3,hP8,176 P63 /m 0.73988,0.73988,0.42423,90,90,120 - - 4.14 X 4117
Cl-Nd Nd14Cl33 *,aP*,2 P-1 1.1167,1.1168,2.1488,99.69,100.55,108.89 - - - N 21984
Cl-Ni NiCl2 rt CdCl2,hR9,166 R-3m 0.3483,0.3483,1.74,90,90,120 - - 3.53 X 1837
Cl-Np NpCl3 UCl3,hP8,176 P63 /m 0.7405,0.7405,0.4273,90,90,120 - - 5.62 X 322
Cl-Np NpCl4 ThCl4,tI20,141 I41/amd 0.8229,0.8229,0.7437,90,90,90 - red dark 5.00 X 28836
Cl-O ClO2 lt ClO2,oP24,61 Pbca 0.5518,1.0767,0.6654,90,90,90 - - 2.27 X 25980
Cl-O ClO3 lt ClO3,mS32,9 C1c1 0.5563,0.8613,0.9785,90,100.56,90 - red 2.41 X 20814
Cl-O Cl2O lt [H2O],tI24,141 I41/amd 0.77246,0.77246,0.92606,90,90,90 - - 2.09 X 35233
Cl-O Cl2O7 lt Cl2O7,mS36,15 C12/c1 1.3696,0.4617,0.8722,90,111.94,90 - colorless 2.37 X 21055
Handbook of Inorganic Substances – Edition 2015 : Data 63

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cl-Os OsCl4 ht OsCl4,oS10,65 Cmmm 0.7929,0.8326,0.3560,90,90,90 - black 4.69 X 10632


Cl-Os OsCl5 *,mP8,14 P121/c1 0.917,1.15,1.197,90,109.,90 - - 4.09 P 12338
Cl-P PCl3 lt PCl3 ,oP16,62 Pnma 0.8129,0.94,0.609,90,90,90 - - 1.96 X 12852
Cl-P PCl5 m *,mS36,12 C12/m1 1.48302,0.84765,0.87981,90,123.589,90 - - 2.25 N 27520
Cl-P PCl5 rt PCl5 ,tP24,85 P4/n 0.922,0.922,0.744,90,90,90 - - 2.19 X 6319
Cl-Pa PaCl4 ThCl4,tI20,141 I41/amd 0.8377,0.8377,0.7481,90,90,90 - - 4.72 X 7459
Cl-Pa PaCl5 PaCl5,mS24,15 C12/c1 0.797,1.135,0.836,90,106.4,90 - yellow 3.74 X 3350
Cl-Pb PbCl2 hp PbCl2,mP24,14 P121/c1 0.8589,0.4491,1.1995,90,90.8,90 - - 7.99 X 30885
Cl-Pb PbCl2 PbCl2,oP12,62 Pnma 0.7619,0.45336,0.9043,90,90,90 cotunnite - 5.91 X 19634
Cl-Pb PbCl4 lt OsO4,mS20,15 C12/c1 1.20115,0.5359,1.0542,90,116.353,90 - colorless 3.81 X 39818
Cl-Pd PdCl2 ht1 PdCl2,oP6,58 Pnnm 0.38115,1.10371,0.33429,90,90,90 - red 4.19 X 53631
Cl-Pd PdCl2 ht2 PdCl2,mP6,10 P12/m1 0.4012,0.3288,1.1782,90,97.03,90 - - 3.82 X 53631
Cl-Pd PdCl2 rhom PdCl2,hR54,148 R-3 1.30471,1.30471,0.86017,90,90,120 - black 4.18 X 31417
Cl-Pd PdCl2 rt PdCl2,mP8,14 P121/c1 0.55496,0.38608,0.64105,90,107.151,90 - - 4.49 X 53631
Cl-Po PoCl2 PoCl2,oP3,47 Pmmm 0.367,0.435,0.450,90,90,90 - - 6.47 X 688
Cl-Pr PrCl3 rt UCl3,hP8,176 P63/m 0.73958,0.73958,0.42675,90,90,120 - - 4.06 X 20912
Cl-Pr Pr1.29 Cl3 ht Pr1.29 Cl3,hP10,176 P63/m 0.7417,0.7417,0.4272,90,90,120 - black 4.70 X 22372
Cl-Pt PtCl2 ht PtCl2,mS16,12 C12/m1 1.3258,0.3194,0.6802,90,107.75,90 - black 6.44 X 21937
Cl-Pt PtCl2 orth PdCl2,oP6,58 Pnnm 0.386,1.105,0.335,90,90,90 - - 6.18 A 961
Cl-Pt PtCl2 rt PtCl2,hR54,166 R-3m 1.3126,1.3126,0.8666,90,90,120 - red dark 6.15 X 42389
Cl-Pt PtCl3 PtBr3,hR144,148 R-3 2.1213,2.1213,0.86,90,90,120 - - 5.38 X 43920
Cl-Pt PtCl4 SnI4 ,cP40,205 Pa-3 1.045,1.045,1.045,90,90,90 - - 3.92 X 962
Cl-Pu PuCl3 UCl3,hP8,176 P63/m 0.7394,0.7394,0.4243,90,90,120 - green 5.79 X 9124
Cl-Rb RbCl hp CsCl,cP2,221 Pm-3m 0.391,0.391,0.391,90,90,90 b.c.c. family - 3.36 X 2267
Cl-Rb RbCl ht NaCl,cF8,225 Fm-3m 0.6581,0.6581,0.6581,90,90,90 rocksalt family - 2.82 X 4951
Cl-Re ReCl3 ReCl3,hR72,166 R-3m 1.02062,1.02062,2.0353,90,90,120 - red dark 4.76 X 20833
Cl-Re ReCl4 ht ReCl4,mP20,13 P12/c1 0.6362,0.6273,1.2165,90,93.15,90 - - 4.49 X 7435
Cl-Re ReCl4 mon *,m*80,* - 1.817,0.627,1.843,90,104.,90 - brown 4.28 N 6706
Cl-Re ReCl4 rt NbCl4,mS20,12 C12/m1 1.17669,0.6501,0.8037,90,129.591,90 - - 4.60 A 15502
Cl-Re ReCl5 ReCl5,mP48,14 P121/c1 0.924,1.154,1.203,90,109.1,90 - brown dark 3.98 X 3858
Cl-Rh RhCl3 AlCl3,mS16,12 C12/m1 0.595,1.03,0.603,90,109.2,90 - golden red 3.98 X 2226
Cl-Ru RuCl3 ht Ti3O,hP24,149 P312 0.5979,0.5979,1.717,90,90,120 - black 3.89 A 3609
Cl-Ru RuCl3 lt RuBr3,oP16,59 Pmmn 0.5634,1.0576,0.6106,90,90,90 - gray silver 3.79 X 43965
Cl-Ru RuCl3 rt TiCl3,hP8,193 P63/mcm 0.6121,0.6121,0.5655,90,90,120 - brown 3.75 X 43965
Cl-S SCl lt SCl,oF64,43 Fdd2 1.7276,2.1370,0.47616,90,90,90 - yellow 2.04 X 16749
Cl-S SCl2 lt SCl2 ,oP24,19 P212121 0.40019,0.9188,1.7505,90,90,90 - - 2.13 X 17717
Cl-S SCl4 lt SeCl4,cP160,218 P-43n 1.58,1.58,1.58,90,90,90 - - 2.34 A 17717
Cl-Sb SbCl3 SbCl3,oP16,62 Pnma 0.8111,0.9419,0.6313,90,90,90 - - 3.14 X 12190
Cl-Sb SbCl5 lt ReCl5,mP48,14 P121/c1 0.9524,1.1869,1.2197,90,108.27,90 - orange 3.03 X 40969
Cl-Sb SbCl5 rt SbCl5,hP12,194 P63/mmc 0.7414,0.7414,0.794,90,90,120 - colorless 2.63 X 40969
Cl-Sc ScCl ZrCl,hR12,166 R-3m 0.3473,0.3473,2.671,90,90,120 - black gray 2.87 X 10645
Cl-Sc ScCl3 BiI3,hR24,148 R-3 0.63775,0.63775,1.779,90,90,120 - - 2.41 X 28385
Cl-Sc Sc5Cl8 Tb5Br8,mS26,12 C12/m1 1.778,0.3523,1.204,90,130.1,90 - black 2.93 X 11566
Cl-Sc Sc7Cl10 Sc7Cl10,mS34,12 C12/m1 1.8620,0.35366,1.2250,90,91.98,90 - - 2.76 X 10628
Cl-Sc Sc7Cl12 Sc7Cl12,hR57,148 R-3 1.2959,1.2959,0.8825,90,90,120 - black 2.87 X 15679
Cl-Se SeCl SeBr,mP16,14 P121/c1 0.7081,1.4058,0.4814,90,97.06,90 - red dark 3.20 X 16749
Cl-Se SeCl4 m TeCl4,mS80,15 C12/c1 1.6548,0.981,1.50291,90,116.95,90 - - 2.70 X 14792
Cl-Se SeCl4 SeCl4,cP160,218 P-43n 1.6433,1.6433,1.6433,90,90,90 - yellow pale 2.64 X 14797
Cl-Si SiCl2 mon SiCl2,mS72,15 C12/c1 1.7624,0.9765,1.3506,90,109.914,90 - colorless 1.81 X 56333
Cl-Si SiCl2 orth SiCl2,oP12,19 P212121 0.40569,0.6783,1.3346,90,90,90 adamantane structure yellow pale 1.79 X 34122
Cl-Si SiCl4 lt2 SnBr4,mP20,14 P121/c1 0.9608,0.6356,0.9672,90,102.909,90 - - 1.96 X 19608
Cl-Si Si3Cl8 Si3Cl8,cF176,219 F-43c 1.71884,1.71884,1.71884,90,90,90 - colorless 1.92 X 55882
Cl-Si Si5Cl12 Si5Cl12,hP55,147 P-3 1.34123,1.34123,0.90631,90,90,120 - colorless 2.00 X 55882
Cl-Sm SmCl2 ht CaF2 ,cF12,225 Fm-3m 0.71496,0.71496,0.71496,90,90,90 fluorite family - 4.02 X 14571
Cl-Sm SmCl2 rt PbCl2,oP12,62 Pnma 0.75628,0.45077,0.90109,90,90,90 - red blood 4.79 X 19071
Cl-Sm SmCl3 UCl3,hP8,176 P63/m 0.73733,0.73733,0.41684,90,90,120 - - 4.35 A 19071
Cl-Sm Sm3 Cl7 *,hP10,* - 0.4857,0.4857,1.237,90,90,120 - brown 4.60 N 12662
Cl-Sn SnCl2 hp PbCl2,mP24,14 P121/c1 0.842,0.439,1.194,90,91.,90 - - 5.71 X 31963
Cl-Sn SnCl2 rt PbCl2,oP12,62 Pnma 0.74,0.437,0.881,90,90,90 - - 4.42 X 31963
Cl-Sn SnCl4 lt SnBr4,mP20,14 P121/c1 0.98642,0.668,0.99377,90,102.945,90 - - 2.71 X 38256
Cl-Sr SrCl2 ht UO2.12 ,cF92,225 Fm-3m 0.71806,0.71806,0.71806,90,90,90 fluorite family - 2.84 X 56908
Cl-Sr SrCl2 rt CaF2 ,cF12,225 Fm-3m 0.6978,0.6978,0.6978,90,90,90 fluorite family - 3.10 X 56908
Cl-Ta TaCl4 NbCl4,mS20,12 C12/m1 1.1898,0.6775,0.8145,90,131.53,90 - black 4.36 X 32594
Cl-Ta TaCl5 NbCl5,mS72,12 C12/m1 1.8278,1.7766,0.585,90,90.62,90 - colorless 3.76 X 38290
Cl-Ta Ta2Cl5 Ta2Cl5,cI336,230 Ia-3d 2.0326,2.0326,2.0326,90,90,90 - green olive 5.12 X 36723
Cl-Tb TbCl lt ZrCl,hR12,166 R-3m 0.3781,0.3781,2.7461,90,90,120 - gray 5.70 X 13789
Cl-Tb TbCl rt (H) ZrBr,hR12,166 R-3m 0.3786,0.3786,2.7461,90,90,120 - - 5.68 X 13789
Cl-Tb TbCl3 ht1 UCl3,hP8,176 P63/m 0.73763,0.73763,0.40571,90,90,120 - - 4.61 X 22012
Cl-Tb TbCl3 ht2 TbCl3,tP16,136 P42/mnm 0.64251,0.64251,1.17714,90,90,90 - - 3.63 X 22012
Cl-Tb TbCl3 rt PuBr3,oS16,63 Cmcm 0.38471,1.17737,0.85177,90,90,90 - - 4.57 X 22012
Cl-Tb Tb2Cl3 Gd2Cl3,mS20,12 C12/m1 1.5184,0.3869,1.0135,90,118.07,90 - - 5.36 A 12819
Cl-Tc TcCl2 TcCl2,tI16,87 I4/m 0.8557,0.8557,0.3417,90,90,90 - black 4.48 X 56459
Cl-Tc TcCl3 mon AlCl3,mS16,12 C12/m1 0.5986,0.9725,0.6194,90,108.687,90 - - 3.97 X 58322
Cl-Tc TcCl3 rhom ReCl3,hR72,166 R-3m 1.01035,1.01035,2.012,90,90,120 - black 3.43 X 54443
Cl-Tc TcCl4 TcCl4,oP40,61 Pbca 0.60111,1.15308,1.39334,90,90,90 - red 3.30 X 58383
Cl-Te TeCl4 TeCl4,mS80,15 C12/c1 1.6846,1.0347,1.5051,90,116.87,90 - green 3.06 X 36877
Cl-Te Te2Cl Te2Br,oP24,62 Pnma 1.482,0.4,1.281,90,90,90 - - 5.08 A 7248
Cl-Te Te3Cl2 Te3Cl2,mP20,14 P121/c1 0.7039,0.8635,1.1211,90,117.35,90 - - 4.98 X 10233
64 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cl-Th ThCl4 ht ThCl4,tI20,141 I41/amd 0.8486,0.8486,0.7465,90,90,90 - - 4.62 X 4407


Cl-Th ThCl4 rt tet ThCl4,tI20,88 I41/a 0.6408,0.6408,1.2924,90,90,90 - - 4.68 X 8277
Cl-Ti TiCl2 ht CdI2,hP3,164 P-3m1 0.343,0.343,0.61,90,90,120 CdI2 -PbI2 polytype violet 3.17 X 1750
Cl-Ti TiCl3 ht TiCl3,hP8,193 P63 /mcm 0.627,0.627,0.582,90,90,120 - brown 2.59 X 1466
Cl-Ti TiCl3 lt1 TiCl3,mS48,12 C12/m1 0.6051,1.0569,1.7559,90,91.21,90 - - 2.74 X 25357
Cl-Ti TiCl3 lt2 TiCl3,mS32,15 C12/c1 0.6064,1.057,1.171,90,90.28,90 - - 2.73 X 25357
Cl-Ti TiCl3 rt rhom BiI3,hR24,148 R-3 0.6153,0.6153,1.7599,90,90,120 - - 2.66 X 25357
Cl-Ti TiCl3 rt trig1 Ti3O,hP16,163 P-31c 0.6143,0.6143,1.1718,90,90,120 - violet 2.68 X 25357
Cl-Ti TiCl3 rt trig2 Ti3O,hP24,149 P312 0.6151,0.6151,1.76,90,90,120 - violet 2.67 X 25357
Cl-Ti TiCl3 tricl TiBr3,aP8,2 P-1 0.6087,0.6098,0.679,63.94,64.41,60.17 - - 2.71 X 38022
Cl-Ti TiCl4 SnBr4,mP20,14 P121/c1 0.967,0.64737,0.9682,90,102.168,90 - colorless 2.13 X 39825
Cl-Ti Ti7Cl16 Ti7Cl16,oP46,58 Pnnm 0.9987,1.4421,0.689,90,90,90 - black 3.02 X 14683
Cl-Tl TlCl m1 NaCl,cF8,225 Fm-3m 0.632,0.632,0.632,90,90,90 rocksalt family - 6.31 X 3225
Cl-Tl TlCl m2 TlI,oS8,63 Cmcm 0.474,1.24,0.427,90,90,90 CrB(TlI)-FeB - 6.35 A 3225
Cl-Tl TlCl CsCl,cP2,221 Pm-3m 0.38416,0.38416,0.38416,90,90,90 lafossaite yellow pale 7.02 X 8497
Cl-Tl TlCl2 TlCl2,tI24,88 I41/a 0.69645,0.69645,1.5528,90,90,90 - yellow 4.86 X 9423
Cl-Tl TlCl3 AlCl3,mS16,12 C12/m1 0.654,1.133,0.632,90,110.2,90 - - 4.70 A 631
Cl-Tl Tl2Cl3 rt Tl2Cl3,oP160,62 Pnma 1.2676,2.5087,1.4748,90,90,90 - yellow 5.84 X 13870
Cl-Tm TmCl2 SrI2,oP24,61 Pbca 0.6702,1.3161,0.6959,90,90,90 - red dark 5.19 X 9910
Cl-Tm TmCl3 hp1 PuBr3,oS16,63 Cmcm 0.3734,1.1877,0.8492,90,90,90 - - 4.86 A 12808
Cl-Tm TmCl3 hp2 FeF3,hR24,167 R-3c 0.6438,0.6438,1.8015,90,90,120 - - 4.24 X 16653
Cl-Tm TmCl3 AlCl3,mS16,12 C12/m1 0.67483,1.1726,0.63905,90,110.6,90 - - 3.86 A 19071
Cl-U UCl3 rt UCl3,hP8,176 P63 /m 0.74439,0.74439,0.43243,90,90,120 - red dark 5.51 X 20209
Cl-U UCl4 ThCl4,tI20,141 I41/amd 0.83018,0.83018,0.74813,90,90,90 - yellow 4.89 X 20209
Cl-U UCl5 mon UCl5,mP24,14 P121/c1 0.799,1.069,1.150,90,132.5,90 - brown dark 3.81 X 3321
Cl-U UCl5 tricl UCl5,aP12,2 P-1 0.635,0.7003,0.965,107.86,90.90,116.28 - - 3.83 X 8644
Cl-U UCl6 UCl6,hP21,164 P-3m1 1.097,1.097,0.6025,90,90,120 - black 3.58 X 7916
Cl-V VCl2 CdI2,hP3,164 P-3m1 0.3581,0.3581,0.5798,90,90,120 CdI2 -PbI2 polytype green apple 3.14 X 16336
Cl-V VCl3 BiI3,hR24,148 R-3 0.6012,0.6012,1.734,90,90,120 - - 2.89 X 278
Cl-V VCl4 SnBr4,mP20,14 P121/c1 0.9603,0.6417,0.9622,90,102.2,90 - - 2.21 X 45876
Cl-W WCl2 MoCl2,oS72,64 Cmce 1.404,1.127,1.128,90,90,90 Chevrel phase - 5.69 A 3762
Cl-W WCl3 WCl3,hR72,148 R-3 1.4989,1.4989,0.84547,90,90,120 - black 5.27 X 44038
Cl-W WCl4 NbCl4,mS20,12 C12/m1 1.1782,0.6475,0.8062,90,131.14,90 - black 4.67 X 34343
Cl-W WCl5 rt MoCl5,mS72,12 C12/m1 1.7438,1.7706,0.6063,90,95.51,90 - black green 3.86 X 11252
Cl-W WCl6 ht1 UCl6,hP21,164 P-3m1 1.049,1.049,0.5733,90,90,120 - - 3.62 X 7903
Cl-W WCl6 rt WCl6,hR21,148 R-3 0.6088,0.6088,1.668,90,90,120 - black 3.69 X 238
Cl-Y YCl ZrCl,hR12,166 R-3m 0.37523,0.37523,2.7525,90,90,120 - black 3.69 X 16989
Cl-Y YCl3 AlCl3,mS16,12 C12/m1 0.692,1.194,0.644,90,111.,90 - - 2.61 X 631
Cl-Y Y2Cl3 Gd2Cl3,mS20,12 C12/m1 1.5144,0.3825,1.0077,90,118.24,90 - black 3.67 X 13231
Cl-Yb YbCl2 SrI2,oP24,61 Pbca 0.6693,1.315,0.6942,90,90,90 - green faint 5.30 X 8609
Cl-Yb YbCl3 hp1 FeF3,hR24,167 R-3c 0.6415,0.6415,1.7941,90,90,120 - - 4.35 A 16653
Cl-Yb YbCl3 hp2 PuBr3,oS16,63 Cmcm 0.371,1.187,0.85,90,90,90 - - 4.96 A 16678
Cl-Yb YbCl3 AlCl3,mS16,12 C12/m1 0.6739,1.1651,0.6383,90,110.51,90 - white 3.95 A 23771
Cl-Yb Yb6Cl13 Sm6Br13,mS76,15 C12/c1 4.142,0.6539,0.6953,90,98.48,90 - colorless 5.35 A 15153
Cl-Zn ZnCl2 (aq) ZnCl2,tI12,122 I-42d 0.541,0.541,1.03,90,90,90 - - 3.00 X 1564
Cl-Zn ZnCl2 mon (aq) ZnCl2,mP36,14 P121/c1 0.654,1.131,1.396,90,117.94,90 - - 2.98 X 1564
Cl-Zn ZnCl2 orth ZnCl2,oP12,33 Pna21 0.6443,0.7693,0.6125,90,90,90 - - 2.98 X 11513
Cl-Zn ZnCl2 tet (aq) HgI2,tP6,137 P42 /nmc 0.37,0.37,1.06,90,90,90 - - 3.12 X 1127
Cl-Zr ZrCl ZrCl,hR12,166 R-3m 0.3424,0.3424,2.657,90,90,120 - black 4.68 X 9824
Cl-Zr ZrCl2 18T *,hP*,* - 0.3382,0.3382,11.6312,90,90,120 - - - N 12348
Cl-Zr ZrCl2 36R ZrCl2,hR54,148 R-3 1.2973,1.2973,0.8782,90,90,120 - brown red 3.79 X 14150
Cl-Zr ZrCl2 3R MoS2,hR9,160 R3m 0.33819,0.33819,1.9378,90,90,120 - gray 4.21 X 12348
Cl-Zr ZrCl2 6T *,hP*,* - 1.0146,1.0146,3.877,90,90,120 - - - N 12348
Cl-Zr ZrCl3 TiCl3,hP8,193 P63 /mcm 0.6383,0.6383,0.6139,90,90,120 - green 3.03 X 15141
Cl-Zr ZrCl4 ZrCl4,mP10,13 P12/c1 0.6361,0.7407,0.6256,90,109.30,90 - colorless 2.78 X 5595
Cl-Zr Zr2Cl5 Ta2Cl5,cI336,230 Ia-3d 2.1141,2.1141,2.1141,90,90,90 - - 3.03 X 15679
Cl-Zr Zr6.3 Cl12 Zr6.3 Cl12,hP19,164 P-3m1 0.33791,0.33791,3.8713,90,90,120 - gray 4.34 X 12348
Cm-F CmF3 HoH3,hP24,165 P-3c1 0.7012,0.7012,0.7198,90,90,120 - - 9.88 A 16438
Cm-F CmF4 ZrF4,mS60,15 C12/c1 1.25,1.051,0.816,90,126.25,90 - - 7.44 A 16438
Cm-H CmH2 CaF2,cF12,225 Fm-3m 0.5322,0.5322,0.5322,90,90,90 fluorite family - 10.97 X 18259
Cm-H CmH3 Na3As,hP8,194 P63 /mmc 0.3769,0.3769,0.6732,90,90,120 - - 10.03 A 18259
Cm-I CmI3 BiI3,hR24,148 R-3 0.744,0.744,2.04,90,90,120 - - 6.40 A 2624
Cm-Ir CmIr2 MgCu2,cF24,227 Fd-3m 0.75616,0.75616,0.75616,90,90,90 Friauf-Laves phase - 19.40 X 26761
Cm-Ir CmIr3 Cu3Au,cP4,221 Pm-3m 0.41729,0.41729,0.41729,90,90,90 close-packed structure - 18.82 X 29389
Cm-Ir CmxIr Cu,cF4,225 Fm-3m 0.3839,0.3839,0.3839,90,90,90 close-packed structure - 22.57 X 26761
Cm-N CmN NaCl,cF8,225 Fm-3m 0.5041,0.5041,0.5041,90,90,90 rocksalt family - 13.53 X 9305
Cm-Ni CmNi3 Cu3Au,cP4,221 Pm-3m 0.4145,0.4145,0.4145,90,90,90 close-packed structure - 9.87 X 30945
Cm-Ni CmNi5 CaCu5,hP6,191 P6/mmm 0.48713,0.48713,0.40142,90,90,120 - - 10.88 X 30945
Cm-Ni Cm0.001 Ni0.999 Cu,cF4,225 Fm-3m 0.35266,0.35266,0.35266,90,90,90 close-packed structure - 8.92 X 30945
Cm-Ni Cm0.977 Ni0.023 rt Nd,hP4,194 P63 /mmc 0.3473,0.3473,1.1293,90,90,120 close-packed structure - 13.66 X 30945
Cm-Ni Cm2.2 Ni16.6 Th2Ni17,hP38,194 P63 /mmc 0.8347,0.8347,0.80685,90,90,120 CaCu5-Zr4Al3 - 10.35 A 30945
Cm-O CmO NaCl,cF8,225 Fm-3m 0.5019,0.5019,0.5019,90,90,90 rocksalt family - 13.82 X 23688
Cm-O CmO2 CaF2,cF12,225 Fm-3m 0.53642,0.53642,0.53642,90,90,90 fluorite family - 12.01 X 22443
Cm-O Cm2O3 cub (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.0996,1.0996,1.0996,90,90,90 - - 10.83 A 6785
Cm-O Cm2O3 mon Sm2O3,mS30,12 C12/m1 1.429,0.3657,0.89,90,100.28,90 - - 11.80 A 47402
Cm-O Cm2O3 trig La2O3,hP5,164 P-3m1 0.3799,0.3799,0.599,90,90,120 - - 12.02 A 5292
Cm-O Cm7O12 rt Pr7O12,hR57,148 R-3 1.01937,1.01937,0.94608,90,90,120 fluorite family - 11.24 A 6785
Cm-P CmP NaCl,cF8,225 Fm-3m 0.5725,0.5725,0.5725,90,90,90 rocksalt family - 9.84 X 9305
Handbook of Inorganic Substances – Edition 2015 : Data 65

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cm-Pd Cm0.03Pd0.97 Cu,cF4,225 Fm-3m 0.3902,0.3902,0.3902,90,90,90 close-packed structure - 12.37 X 22944


Cm-Pd Cm0.82Pd3.18 Cu3Au,cP4,221 Pm-3m 0.41032,0.41032,0.41032,90,90,90 close-packed structure - 13.00 X 22944
Cm-Pt CmPt2 MgCu2,cF24,227 Fd-3m 0.7625,0.7625,0.7625,90,90,90 Friauf-Laves phase - 19.09 X 9952
Cm-Pt CmPt3 Cu3Au,cP4,221 Pm-3m 0.4176,0.4176,0.4176,90,90,90 close-packed structure - 18.98 X 29389
Cm-Pt CmPt5 hex CaCu5,hP6,191 P6/mmm 0.5308,0.5308,0.442,90,90,120 - - 18.82 X 22945
Cm-Pt CmPt5 orth *,oP72,* - 0.5329,0.9108,2.638,90,90,90 - - 19.03 N 9952
Cm-Rh CmRh2 MgCu2,cF24,227 Fd-3m 0.75187,0.75187,0.75187,90,90,90 Friauf-Laves phase - 14.15 X 29389
Cm-Rh CmRh3 Cu3Au,cP4,221 Pm-3m 0.4161,0.4161,0.4161,90,90,90 close-packed structure - 12.81 X 29389
Cm-Ru CmRu2 MgZn2,hP12,194 P63/mmc 0.532,0.532,0.878,90,90,120 Friauf-Laves phase - 13.86 A 47402
Cm-Ru CmRu3 Cu3Au,cP4,221 Pm-3m 0.4151,0.4151,0.4151,90,90,90 close-packed structure - 7.05 X 47402
Cm-S CmS NaCl,cF8,225 Fm-3m 0.5575,0.5575,0.5575,90,90,90 rocksalt family - 10.70 X 12461
Cm-S CmS2 UAs2,tP6,129 P4/nmm 0.3926,0.3926,0.801,90,90,90 - - 8.37 X 9057
Cm-S Cm2 S3 ht *,tI*,* - 1.478,1.478,1.976,90,90,90 - - - N 9877
Cm-S Cm2 S3 rt Cr3C2-b,oP20,62 Pnma 0.739,0.398,1.535,90,90,90 - - 8.68 A 9877
Cm-S Cm2.67 S4 rt cub Th3P 4,cI28,220 I-43d 0.8452,0.8452,0.8452,90,90,90 - - 8.67 A 9057
Cm-Sb CmSb NaCl,cF8,225 Fm-3m 0.6248,0.6248,0.6248,90,90,90 rocksalt family - 10.04 X 9305
Cm-Se CmSe NaCl,cF8,225 Fm-3m 0.5798,0.5798,0.5798,90,90,90 rocksalt family - 11.11 X 12461
Cm-Se CmSe 2 UAs2,tP6,129 P4/nmm 0.4096,0.4096,0.8396,90,90,90 - - 9.55 X 9057
Cm-Se Cm2.67 Se4 Th3P 4,cI28,220 I-43d 0.8788,0.8788,0.8788,90,90,90 - - 9.55 A 9057
Cm-Si CmSi FeB-b,oP8,62 Pnma 0.8278,0.3914,0.5954,90,90,90 CrB(TlI)-FeB black 9.47 X 16141
Cm-Si CmSi1.5 AlB2 ,hP3,191 P6/mmm 0.387,0.387,0.4145,90,90,120 AlB2 family gray silver 8.93 X 16141
Cm-Si CmSi2 ThSi2,tI12,141 I41/amd 0.3963,0.3963,1.372,90,90,90 - gray silver 9.35 X 16141
Cm-Te CmTe NaCl,cF8,225 Fm-3m 0.615,0.615,0.615,90,90,90 rocksalt family - 10.70 X 12461
Cm-Te CmTe 2 UAs2,tP6,129 P4/nmm 0.4328,0.4328,0.893,90,90,90 - - 9.97 X 9876
Cm-Te CmTe 3 NdTe 3,oS16,63 Cmcm 0.434,2.51,0.434,90,90,90 - - 8.85 A 9876
Cm-Te Cm2 Te3 Th2S3,oP20,62 Pnma 1.213,0.433,1.194,90,90,90 - - 9.29 A 9876
Co-Cr Cr0.38 Co0.62 rt Mg,hP2,194 P63/mmc 0.253,0.253,0.408,90,90,120 close-packed structure - 8.27 X 22335
Co-Cr Cr0.66 Co0.34 rt (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.8789,0.8789,0.45388,90,90,90 Frank-Kasper phase - 7.72 X 57770
Co-Cr Cr0.7 Co0.3 W,cI2,229 Im-3m 0.286,0.286,0.286,90,90,90 b.c.c. family - 7.68 X 22335
Co-Cr Cr2.28 Co1.72 ht Cr3Si,cP8,223 Pm-3n 0.4558,0.4558,0.4558,90,90,90 Frank-Kasper phase - 7.71 X 6918
Co-Cr Cr3Co Mg3 Cd,hP8,194 P63/mmc 0.5028,0.5028,0.4034,90,90,120 close-packed structure - 8.08 A 4876
Co-Cu Cu0.5 Co0.5 m Cu,cF4,225 Fm-3m 0.3591,0.3591,0.3591,90,90,90 close-packed structure - 8.78 X 43749
Co-D CoD0.18 m NiAs,hP4,194 P63/mmc 0.2529,0.2529,0.4091,90,90,120 AlB2 family - 8.69 X 35923
Co-D CoD0.38 Cr0.88 S,hP4,164 P-3m1 0.2565,0.2565,0.4142,90,90,120 - - 8.40 X 35923
Co-D CoD0.50 m Cr0.88 S,hP4,164 P-3m1 0.2579,0.2579,0.4162,90,90,120 - - 8.30 X 35923
Co-Dy DyCo 2 lt *,t*24,* - 0.7176,0.7176,0.7186,90,90,90 - - - N 14624
Co-Dy DyCo 2 rt MgCu2,cF24,227 Fd-3m 0.7194,0.7194,0.7194,90,90,90 Friauf-Laves phase - 10.00 X 52225
Co-Dy DyCo 3 PuNi3,hR36,166 R-3m 0.5004,0.5004,2.435,90,90,120 Laves-CaCu5 - 9.60 X 9265
Co-Dy DyCo 5 ht CaCu5,hP6,191 P6/mmm 0.49249,0.49249,0.3985,90,90,120 - - 9.07 X 16594
Co-Dy Dy12 Co7 Ho12 Co7,mP38,14 P121/c1 0.836,1.125,1.10945,90,124.265,90 - - 9.10 A 9613
Co-Dy Dy2 Co17 ht Th2Ni17,hP38,194 P63/mmc 0.83439,0.83439,0.81228,90,90,120 CaCu5-Zr4Al3 - 9.00 A 29672
Co-Dy Dy2 Co17 rt Zn17 Th2,hR57,166 R-3m 0.842,0.842,1.2216,90,90,120 CaCu5-Zr4Al3 - 8.81 A 35955
Co-Dy Dy2 Co7 Gd2Co 7,hR54,166 R-3m 0.4992,0.4992,3.6189,90,90,120 Laves-CaCu5 gray 9.41 A 29672
Co-Dy Dy3 Co Fe3C-b,oP16,62 Pnma 0.69674,0.93422,0.62439,90,90,90 - - 8.93 X 37883
Co-Dy Dy6 Co4.5 rt Ho6Co 4.5 ,hP22,176 P63/m 1.146,1.146,0.4005,90,90,120 - - 9.04 X 4009
Co-Er ErCo 2 lt TbFe 2,hR18,166 R-3m 0.5071,0.5071,1.2188,90,90,120 Friauf-Laves phase - 10.47 A 14624
Co-Er ErCo 2 rt MgCu2,cF24,227 Fd-3m 0.7156,0.7156,0.7156,90,90,90 Friauf-Laves phase - 10.34 X 14624
Co-Er ErCo3 PuNi3,hR36,166 R-3m 0.49781,0.49781,2.42459,90,90,120 Laves-CaCu5 - 9.88 X 46940
Co-Er ErCo 5 ht CaCu5,hP6,191 P6/mmm 0.487,0.487,0.4002,90,90,120 - - 9.33 X 3296
Co-Er Er0.9 Co5.2 ht Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4841,0.4841,0.4038,90,90,120 CaCu5-Zr4Al3 - 9.26 A 8483
Co-Er Er12 Co7 Ho12 Co7,mP38,14 P121/c1 0.83,1.116,1.10388,90,124.28,90 - - 9.51 A 9613
Co-Er Er2Co17 hex Th2Ni17,hP38,194 P63/mmc 0.83068,0.83068,0.81212,90,90,120 CaCu5-Zr4Al3 - 9.15 X 23457
Co-Er Er2Co17 rhom Zn17 Th2,hR57,166 R-3m 0.8315,0.8315,1.2203,90,90,120 CaCu5-Zr4Al3 - 9.11 A 34662
Co-Er Er2Co7 Gd2Co 7,hR54,166 R-3m 0.497,0.497,3.591,90,90,120 Laves-CaCu5 gray dark 9.69 X 47557
Co-Er Er3Co rt Fe3C-b,oP16,62 Pnma 0.6902,0.9191,0.6189,90,90,90 - - 9.49 A 6211
Co-Er Er6Co4.5 rt Ho6Co 4.5 ,hP22,176 P63/m 1.136,1.136,0.3975,90,90,120 - - 9.49 X 4009
Co-F CoF2 hp-ht FeS2 ,oP6,58 Pnnm 0.464,0.48,0.316,90,90,90 pyrite-marcasite family - 4.57 X 4767
Co-F CoF2 TiO2 ,tP6,136 P42/mnm 0.46956,0.46956,0.31793,90,90,90 - pink 4.59 X 38481
Co-F CoF3 FeF3 ,hR24,167 R-3c 0.50423,0.50423,1.3218,90,90,120 - - 3.97 X 35176
Co-Fe FeCo rt CsCl,cP2,221 Pm-3m 0.2856,0.2856,0.2856,90,90,90 wairauite - 8.18 X 46387
Co-Fe Fe0.01 Co0.99 rt Mg,hP2,194 P63/mmc 0.2509,0.2509,0.4072,90,90,120 close-packed structure - 8.81 X 8410
Co-Fe Fe0.05 Co0.95 Nd,hP4,194 P63/mmc 0.251,0.251,0.818,90,90,120 close-packed structure - 8.75 X 8410
Co-Fe Fe0.08 Co0.92 ht Cu,cF4,225 Fm-3m 0.3551,0.3551,0.3551,90,90,90 close-packed structure - 8.71 X 8410
Co-Fe Fe0.28 Co0.72 ht W,cI2,229 Im-3m 0.2842,0.2842,0.2842,90,90,90 b.c.c. family black 8.40 X 31806
Co-Fe Fe0.28 Co0.72 stab Mn,cI58,217 I-43m 0.8747,0.8747,0.8747,90,90,90 - - 8.36 X 31806
Co-Fe Fe0.6 Co0.4 hp Mg,hP2,194 P63/mmc 0.241,0.241,0.3879,90,90,120 close-packed structure - 9.72 X 10715
Co-Ga CoGa CsCl,cP2,221 Pm-3m 0.28832,0.28832,0.28832,90,90,90 b.c.c. family - 8.91 X 28006
Co-Ga CoGa3 IrIn3 ,tP16,136 P42/mnm 0.623,0.623,0.64312,90,90,90 - gray silver 7.13 X 40476
Co-Ga Co0.8 Ga0.2 ht Cu,cF4,225 Fm-3m 0.3596,0.3596,0.3596,90,90,90 close-packed structure - 8.73 X 1870
Co-Ga Co0.92 Ga0.08 rt Mg,hP2,194 P63/mmc 0.2522,0.2522,0.4096,90,90,120 close-packed structure - 8.80 X 16223
Co-Gd GdCo *,o*4,* - 0.39,0.422,0.487,90,90,90 - - - N 1536
Co-Gd GdCo 2 MgCu2,cF24,227 Fd-3m 0.7218,0.7218,0.7218,90,90,90 Friauf-Laves phase - 9.72 X 30431
Co-Gd GdCo 3 PuNi3,hR36,166 R-3m 0.5053,0.5053,2.459,90,90,120 Laves-CaCu5 - 9.18 A 52817
Co-Gd GdCo 5 ht CaCu5,hP6,191 P6/mmm 0.4979,0.4979,0.3972,90,90,120 - - 8.80 X 25232
Co-Gd Gd0.9 Co5.2 ht Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4837,0.4837,0.4062,90,90,120 CaCu5-Zr4Al3 - 9.04 A 8483
Co-Gd Gd12 Co7 Ho12 Co7,mP38,14 P121/c1 0.841,1.139,1.11628,90,124.179,90 - - 8.63 A 9613
Co-Gd Gd2 Co17 ht Th2Ni17,hP38,194 P63/mmc 0.8378,0.8378,0.8139,90,90,120 CaCu5-Zr4Al3 - 8.84 A 7158
Co-Gd Gd2 Co17 rt Zn17 Th2,hR57,166 R-3m 0.8377,0.8377,1.2198,90,90,120 CaCu5-Zr4Al3 - 8.85 X 3015
66 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Co-Gd Gd2Co3 *,c*30,* - 0.798,0.798,0.798,90,90,90 - - - N 1536


Co-Gd Gd2Co7 ht Gd2Co7,hR54,166 R-3m 0.502,0.502,3.63,90,90,120 Laves-CaCu5 - 9.14 X 2570
Co-Gd Gd2Co7 rt Ce2Ni7,hP36,194 P63 /mmc 0.5032,0.5032,2.428,90,90,120 Laves-CaCu5 - 9.07 A 14324
Co-Gd Gd3Co Fe3C-b,oP16,62 Pnma 0.705,0.954,0.632,90,90,90 - - 8.29 X 5336
Co-Gd Gd6Co4.5 Ho6Co4.5 ,hP22,176 P63 /m 1.1565,1.1565,0.404,90,90,120 - - 8.58 X 38788
Co-Gd Gd9Co *,o**,* - 0.909,0.983,1.267,90,90,90 - - - N 4480
Co-Ge CoGe hp FeSi,cP8,198 P213 0.4637,0.4637,0.4637,90,90,90 - - 8.76 X 15284
Co-Ge CoGe CoGe,mS16,12 C12/m1 1.1648,0.3807,0.4945,90,101.103,90 - - 8.12 X 1335
Co-Ge CoGe4 hp *,cI*,* - 1.099,1.099,1.099,90,90,90 - - - N 23775
Co-Ge Co0.1 Ge0.9 m C,cF8,227 Fd-3m 0.56576,0.56576,0.56576,90,90,90 - - 5.23 X 50165
Co-Ge Co0.83 Ge0.17 ht Cu,cF4,225 Fm-3m 0.3575,0.3575,0.3575,90,90,90 close-packed structure - 8.91 X 1870
Co-Ge Co0.875 Ge2 CoGe2,oS24,64 Cmce 1.0818,0.5681,0.5681,90,90,90 - - 7.49 X 360
Co-Ge Co1.7 Ge ht Co1.75 Ge,hP6,194 P63 /mmc 0.3914,0.3914,0.5004,90,90,120 AlB2 family - 8.64 X 9917
Co-Ge Co2Ge rt Co2Si-b,oP12,62 Pnma 0.502,0.382,0.726,90,90,90 - - 9.09 A 4699
Co-Ge Co5Ge2 ht *,hP*,* - 0.406,0.406,0.59,90,90,120 - - - N 13330
Co-Ge Co5Ge7 Co5Ge7,tI24,107 I4mm 0.764,0.764,0.581,90,90,90 - - 7.86 X 1285
Co-H CoH ht NaCl,cF8,225 Fm-3m 0.37124,0.37124,0.37124,90,90,90 rocksalt family - 7.78 X 44964
Co-H CoH0.19 NiAs,hP4,194 P63 /mmc 0.2538,0.2538,0.4102,90,90,120 AlB2 family - 8.58 X 35923
Co-H Co3H lt Co3H,hP8,186 P63 mc 0.2555,0.2555,1.2406,90,90,120 - - 8.42 X 35923
Co-Hf HfCo CsCl,cP2,221 Pm-3m 0.3171,0.3171,0.3171,90,90,90 b.c.c. family - 12.37 X 53132
Co-Hf HfCo 2 MgCu2,cF24,227 Fd-3m 0.6912,0.6912,0.6912,90,90,90 Friauf-Laves phase - 11.92 X 1528
Co-Hf HfCo 7 ht *,oP*,50 Pban 0.47,3.8,0.83,90,90,90 - - - N 24735
Co-Hf Hf2Co ht Ti2Ni,cF96,227 Fd-3m 1.2045,1.2045,1.2045,90,90,90 - - 12.65 A 53132
Co-Hf Hf2Co7 Zr2Ni7,mS36,12 C12/m1 0.4444,0.8191,1.214,90,90.,90 - - 11.57 A 11611
Co-Hf Hf6Co23 ht Th6Mn23,cF116,225 Fm-3m 1.1502,1.1502,1.1502,90,90,90 - - 10.59 A 19652
Co-Ho HoCo2 lt1 *,t*24,* - 0.7155,0.7155,0.7165,90,90,90 - - - N 14624
Co-Ho HoCo2 lt2 UMn2,oI12,74 Imma 0.5061,0.5064,0.717,90,90,90 Friauf-Laves phase - 10.22 A 23634
Co-Ho HoCo2 rt MgCu2,cF24,227 Fd-3m 0.71781,0.71781,0.71781,90,90,90 Friauf-Laves phase - 10.16 X 48866
Co-Ho HoCo3 PuNi3,hR36,166 R-3m 0.4992,0.4992,2.43,90,90,120 Laves-CaCu5 - 9.74 X 2562
Co-Ho HoCo5 ht CaCu5,hP6,191 P6/mmm 0.49138,0.49138,0.3975,90,90,120 - - 9.18 X 16594
Co-Ho Ho12Co7 Ho12Co7,mP38,14 P121/c1 0.8327,1.1191,1.1051,90,124.2,90 - - 9.33 X 9613
Co-Ho Ho2Co17 ht Zn17Th2,hR57,166 R-3m 0.8332,0.8332,1.2201,90,90,120 CaCu5-Zr4Al3 - 9.04 A 7158
Co-Ho Ho2Co17 lt Th2Ni17,hP38,194 P63 /mmc 0.8331,0.8331,0.8117,90,90,120 CaCu5-Zr4Al3 - 9.07 X 3015
Co-Ho Ho2Co7 Gd2Co7,hR54,166 R-3m 0.4985,0.4985,3.614,90,90,120 Laves-CaCu5 - 9.51 A 23630
Co-Ho Ho3Co Fe3C-b,oP16,62 Pnma 0.692,0.9293,0.6213,90,90,90 - - 9.21 X 4702
Co-Ho Ho6Co4.5 rt Ho6Co4.5 ,hP22,176 P63 /m 1.140,1.140,0.399,90,90,120 - - 9.28 X 4437
Co-I CoI2 CdI2,hP3,164 P-3m1 0.396,0.396,0.665,90,90,120 CdI2 -PbI2 polytype black 5.75 X 22
Co-In CoIn2 Mg2Cu,oF48,70 Fddd 0.5282,0.9402,1.7846,90,90,90 - - 8.65 X 8836
Co-In CoIn3 IrIn3,tP16,136 P42 /mnm 0.68343,0.68343,0.70922,90,90,90 - gray silver 8.09 X 40476
Co-Ir Co0.65 Ir0.35 rt Mg,hP2,194 P63 /mmc 0.2602,0.2602,0.4183,90,90,120 close-packed structure - 14.30 X 16223
Co-Ir Co0.7 Ir0.3 ht Cu,cF4,225 Fm-3m 0.3696,0.3696,0.3696,90,90,90 close-packed structure - 13.01 X 48907
Co-La LaCo0.85 LaCo0.85 ,mS8,12 C12/m1 0.8478,0.4895,0.4335,90,90,90 - black 6.98 X 36958
Co-La LaCo13 NaZn13,cF112,226 Fm-3c 1.133,1.133,1.133,90,90,90 - - 8.27 X 3741
Co-La LaCo2 hp MgCu2,cF24,227 Fd-3m 0.7449,0.7449,0.7449,90,90,90 Friauf-Laves phase - 8.25 X 6914
Co-La LaCo5 hex CaCu5,hP6,191 P6/mmm 0.51085,0.51085,0.39667,90,90,120 - - 8.03 X 32247
Co-La La2Co3 La2Ni3,oS20,64 Cmce 0.4853,1.035,0.7801,90,90,90 - - 7.71 X 18383
Co-La La2Co7 ht Gd2Co7,hR54,166 R-3m 0.513,0.513,3.666,90,90,120 Laves-CaCu5 - 8.23 A 58878
Co-La La2Co7 rt Ce2Ni7,hP36,194 P63 /mmc 0.508,0.508,2.48,90,90,120 Laves-CaCu5 - 8.27 A 13685
Co-La La3Co Fe3C-b,oP16,62 Pnma 0.7279,1.0088,0.6578,90,90,90 - - 6.54 X 1358
Co-Lu LuCo2 MgCu2,cF24,227 Fd-3m 0.71,0.71,0.71,90,90,90 Friauf-Laves phase - 10.87 X 10780
Co-Lu LuCo3 PuNi3,hR36,166 R-3m 0.4942,0.4942,2.408,90,90,120 Laves-CaCu5 - 10.32 A 3751
Co-Lu Lu2Co17 Th2Ni17,hP38,194 P63 /mmc 0.8266,0.8266,0.8099,90,90,120 CaCu5-Zr4Al3 - 9.37 A 48343
Co-Lu Lu2Co7 Gd2Co7,hR54,166 R-3m 0.4946,0.4946,3.598,90,90,120 Laves-CaCu5 - 9.97 A 3592
Co-Lu Lu3Co Fe3C-b,oP16,62 Pnma 0.687,0.903,0.614,90,90,90 - - 10.18 A 6297
Co-Lu Lu6Co4.5 Ho6Co4.5 ,hP22,176 P63 /m 1.121,1.121,0.392,90,90,120 - - 10.24 A 6297
Co-Mg MgCo CdNi,cF96,227 Fd-3m 1.1434,1.1434,1.1434,90,90,90 - - 4.44 X 27381
Co-Mg MgCo2 MgZn2,hP12,194 P63 /mmc 0.4859,0.4859,0.7954,90,90,120 Friauf-Laves phase - 5.81 A 16223
Co-Mg Mg0.5 Co0.5 m W,cI2,229 Im-3m 0.3,0.3,0.3,90,90,90 b.c.c. family - 5.12 X 53300
Co-Mn Mn0.5 Co0.5 ht Cu,cF4,225 Fm-3m 0.361,0.361,0.361,90,90,90 close-packed structure - 8.04 X 30435
Co-Mn Mn0.75 Co0.25 ht1 Mn,cP20,213 P4132 0.6306,0.6306,0.6306,90,90,90 - - 7.41 X 52479
Co-Mo MoCo3 rt Mg3Cd,hP8,194 P63 /mmc 0.51245,0.51245,0.41125,90,90,120 close-packed structure - 9.69 X 2470
Co-Mo Mo0.1Co0.9 rt Mg,hP2,194 P63 /mmc 0.254,0.254,0.4105,90,90,120 close-packed structure - 9.07 X 16223
Co-Mo Mo0.2Co0.8 ht Mg,hP2,194 P63 /mmc 0.25973,0.25973,0.42123,90,90,120 close-packed structure - 8.95 X 1919
Co-Mo Mo0.35 Co0.65 m *,hP*,* - 0.327,0.327,0.522,90,90,120 - - - N 16444
Co-Mo Mo0.6Co0.4 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.92287,0.92287,0.48269,90,90,90 Frank-Kasper phase - 9.83 X 1824
Co-Mo Mo0.92 Co0.08 W,cI2,229 Im-3m 0.31363,0.31363,0.31363,90,90,90 b.c.c. family - 10.01 X 1919
Co-Mo Mo5.89 Co7.11 rt W6Fe7,hR39,166 R-3m 0.4761,0.4761,2.559,90,90,120 Frank-Kasper phase - 9.76 X 42927
Co-N CoN rt ZnS,cF8,216 F-43m 0.4297,0.4297,0.4297,90,90,90 adamantane structure - 6.11 X 30240
Co-N Co2N CaCl2,oP6,58 Pnnm 0.4332,0.4662,0.2749,90,90,90 - - 7.89 X 44937
Co-N Co3N ht Fe3N,hP8,182 P6322 0.4606,0.4606,0.4346,90,90,120 - - 7.94 A 1278
Co-N Co4N rt Fe4N,cP5,221 Pm-3m 0.3738,0.3738,0.3738,90,90,90 - - 7.94 X 1278
Co-Nb Nb0.065 Co0.935 ht Cu,cF4,225 Fm-3m 0.35706,0.35706,0.35706,90,90,90 close-packed structure - 8.92 X 14817
Co-Nb Nb0.14 Co0.86 m W,cI2,229 Im-3m 0.28609,0.28609,0.28609,90,90,90 b.c.c. family - 9.03 X 14817
Co-Nb Nb0.735 Co2.265 ht Nb0.74 Co2.26 ,hP40,194 P63 /mmc 0.47414,0.47414,1.5458,90,90,120 Friauf-Laves phase - 8.91 X 47693
Co-Nb Nb0.77 Co0.23 m Cu,cF4,225 Fm-3m 0.411,0.411,0.411,90,90,90 close-packed structure - 8.14 X 28846
Co-Nb Nb1.05 Co1.95 ht MgZn2,hP12,194 P63 /mmc 0.4834,0.4834,0.7853,90,90,120 Friauf-Laves phase - 8.88 X 2179
Co-Nb Nb1.06 Co1.94 MgCu2,cF24,227 Fd-3m 0.6802,0.6802,0.6802,90,90,90 Friauf-Laves phase - 8.98 X 50365
Co-Nb Nb2Co7 rt Zr2Ni7,mS18,12 C12/m1 0.45874,0.81509,0.62223,90,107.181,90 - - 8.94 X 58180
Handbook of Inorganic Substances – Edition 2015 : Data 67

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Co-Nb Nb6.7 Co6.3 W6Fe7,hR39,166 R-3m 0.4904,0.4904,2.6186,90,90,120 Frank-Kasper phase gray silver 9.08 X 29765
Co-Nd NdCo 2 lt1 YMn2,tI12,141 I41/amd 0.51564,0.51564,0.72705,90,90,90 - - 9.01 X 46667
Co-Nd NdCo 2 lt2 UMn2,oI12,74 Imma 0.51512,0.51431,0.72973,90,90,90 Friauf-Laves phase - 9.01 X 46667
Co-Nd NdCo 2 rt MgCu2,cF24,227 Fd-3m 0.73049,0.73049,0.73049,90,90,90 Friauf-Laves phase - 8.93 X 46667
Co-Nd NdCo 3 PuNi3,hR36,166 R-3m 0.506,0.506,2.4781,90,90,120 Laves-CaCu5 - 8.73 A 27479
Co-Nd NdCo 5 CaCu5,hP6,191 P6/mmm 0.5034,0.5034,0.3977,90,90,120 - - 8.35 X 15488
Co-Nd Nd2 Co1.7 *,hP*,* - 0.4795,0.4795,0.408,90,90,120 - - - N 7642
Co-Nd Nd2 Co17 rt Zn17 Th2,hR57,166 R-3m 0.8398,0.8398,1.2218,90,90,120 CaCu5-Zr4Al3 - 8.61 X 15202
Co-Nd Nd2 Co3 rt La2Ni3,oS20,64 Cmce 0.4986,1.,0.7546,90,90,90 - - 8.21 A 54551
Co-Nd Nd2 Co7 hex Ce2Ni7,hP36,194 P63/mmc 0.50628,0.50628,2.44469,90,90,120 Laves-CaCu5 - 8.58 X 56002
Co-Nd Nd2 Co7 rhom Gd2Co 7,hR54,166 R-3m 0.5059,0.5059,3.643,90,90,120 Laves-CaCu5 - 8.65 A 6211
Co-Nd Nd24 Co11 Ce24 Co11,hP70,186 P63mc 0.9596,0.9596,2.17,90,90,120 - - 7.89 A 4207
Co-Nd Nd3 Co Fe3C-b,oP16,62 Pnma 0.7107,0.975,0.6386,90,90,90 - - 7.38 A 6211
Co-Nd Nd5 Co19 Ce5Co19,hR72,166 R-3m 0.5054,0.5054,4.866,90,90,120 Laves-CaCu5 - 8.52 A 7642
Co-Nd Nd5 Co2 Mn5 C2,mS28,15 C12/c1 1.637,0.643,0.708,90,96.7,90 - - 7.53 A 9556
Co-Nd Nd7 Co3 Th7Fe3,hP20,186 P63mc 0.9888,0.9888,0.5937,90,90,120 - - 7.84 A 4207
Co-Ni Co0.35 Ni0.65 ht Cu,cF4,225 Fm-3m 0.3543,0.3543,0.3543,90,90,90 close-packed structure - 8.78 X 24779
Co-Ni Co0.75 Ni0.25 rt Mg,hP2,194 P63/mmc 0.2504,0.2504,0.4065,90,90,120 close-packed structure - 8.86 X 348
Co-Np NpCo 2 MgCu2,cF24,227 Fd-3m 0.7043,0.7043,0.7043,90,90,90 Friauf-Laves phase - 13.50 X 9263
Co-Np Np2 Co17 Th2Ni17,hP38,194 P63/mmc 0.83107,0.83107,0.81058,90,90,120 CaCu5-Zr4Al3 - 10.11 X 59211
Co-O CoO lt1 CoO,mS4,12 C12/m1 0.51738,0.30119,0.30258,90,125.587,90 - - 6.49 X 21452
Co-O CoO lt2 CoO,tI4,139 I4/mmm 0.3015,0.3015,0.42143,90,90,90 rocksalt family - 6.50 X 349
Co-O CoO m1 ZnO,hP4,186 P63mc 0.321,0.321,0.524,90,90,120 adamantane structure green 5.32 A 24748
Co-O CoO m2 ZnS,cF8,216 F-43m 0.455,0.455,0.455,90,90,90 adamantane structure green 5.28 X 24748
Co-O CoO rt NaCl,cF8,225 Fm-3m 0.4267,0.4267,0.4267,90,90,90 rocksalt family green olive 6.41 X 24748
Co-O CoO2 rhom Ni(O0.5 [OH]0.5 )2,hR9,166 R-3m 0.28388,0.28388,1.3439,90,90,120 - - 4.83 X 50721
Co-O CoO2 trig CdI2 ,hP3,164 P-3m1 0.28208,0.28208,0.42403,90,90,120 CdI2-PbI2 polytype - 5.17 X 36283
Co-O Co2 O3 hp Al2O3,hR30,167 R-3c 0.4782,0.4782,1.296,90,90,120 - - 6.44 X 6293
Co-O Co2 O3 *,h*10,* - 0.464,0.464,0.575,90,90,120 - - - N 19
Co-O Co3 O4 tf Mn3 O4,tI28,141 I41/amd 0.57205,0.57205,0.8262,90,90,90 - - 5.92 A 16483
Co-O Co3 O4 Fe3O4,cF56,227 Fd-3m 0.8072,0.8072,0.8072,90,90,90 spinel family black 6.08 X 13349
Co-Os Os0.2 Co0.8 ht Cu,cF4,225 Fm-3m 0.357,0.357,0.357,90,90,90 close-packed structure - 12.44 X 473
Co-Os Os0.5 Co0.5 Mg,hP2,194 P63/mmc 0.266,0.266,0.424,90,90,120 close-packed structure - 15.92 X 473
Co-P CoP FeAs,oP8,62 Pnma 0.5077,0.3281,0.5587,90,90,90 AlB2 family - 6.42 X 1630
Co-P CoP2 CoSb2,mP12,14 P121/c1 0.5551,0.5549,0.5614,90,114.71,90 pyrite-marcasite family - 5.11 X 17225
Co-P CoP3 CoAs3,cI32,204 Im-3 0.7705,0.7705,0.7705,90,90,90 - black 4.41 X 38122
Co-P Co2P rt Co2P,oP12,62 Pnma 0.5646,0.3513,0.6608,90,90,90 - - 7.54 X 1213
Co-P Co3P Ni3P,tI32,82 I-4 0.878,0.878,0.4336,90,90,90 - - 8.26 A 1626
Co-Pd Co0.33Pd0.67 Cu,cF4,225 Fm-3m 0.3888,0.3888,0.3888,90,90,90 close-packed structure - 10.25 X 48904
Co-Pr PrCo 2 rt MgCu2,cF24,227 Fd-3m 0.7312,0.7312,0.7312,90,90,90 Friauf-Laves phase - 8.79 X 3708
Co-Pr PrCo 3 PuNi3,hR36,166 R-3m 0.50778,0.50778,2.47668,90,90,120 Laves-CaCu5 - 8.59 X 59650
Co-Pr PrCo 5 CaCu5,hP6,191 P6/mmm 0.5011,0.5011,0.3982,90,90,120 - - 8.35 X 28971
Co-Pr Pr2Co1.7 *,hP*,* - 0.481,0.481,0.409,90,90,120 - - - N 7642
Co-Pr Pr2Co7 hex Ce2Ni7,hP36,194 P63/mmc 0.5068,0.5068,2.4463,90,90,120 Laves-CaCu5 - 8.48 X 58515
Co-Pr Pr2Co7 rhom Gd2Co 7,hR54,166 R-3m 0.5068,0.5068,3.6549,90,90,120 Laves-CaCu5 - 8.51 X 58515
Co-Pr Pr2.05 Co16.90 rt Pr2.05 Co16.90 ,hR78,160 R3m 0.845,0.845,1.2255,90,90,120 CaCu5-Zr4Al3 - 8.45 X 42191
Co-Pr Pr3Co Fe3C-b,oP16,62 Pnma 0.7143,0.978,0.641,90,90,90 - - 7.14 A 6211
Co-Pr Pr5Co19 Ce5Co19,hR72,166 R-3m 0.5053,0.5053,4.871,90,90,120 Laves-CaCu5 - 8.44 A 7642
Co-Pr Pr5Co2 rt Mn5 C2,mS28,15 C12/c1 1.654,0.648,0.71,90,96.8,90 - - 7.23 A 9556
Co-Pt CoPt rt CuAu,tP2,123 P4/mmm 0.2682,0.2682,0.3675,90,90,90 close-packed structure - 15.96 X 56060
Co-Pt CoPt3 rt Cu3Au,cP4,221 Pm-3m 0.38535,0.38535,0.38535,90,90,90 close-packed structure - 18.69 X 32257
Co-Pt Co0.46Pt0.54 ht Cu,cF4,225 Fm-3m 0.3749,0.3749,0.3749,90,90,90 close-packed structure - 16.70 X 56809
Co-Pt Co0.8 Pt0.2 rt Mg,hP2,194 P63/mmc 0.257,0.257,0.4189,90,90,120 close-packed structure - 11.94 X 16223
Co-Pu PuCo 2 MgCu2,cF24,227 Fd-3m 0.7043,0.7043,0.7043,90,90,90 Friauf-Laves phase - 13.76 X 1153
Co-Pu PuCo 3 PuNi3,hR36,166 R-3m 0.5003,0.5003,2.442,90,90,120 Laves-CaCu5 - 11.88 A 1346
Co-Pu Pu2Co *,hP*,* - 0.7803,0.7803,0.3606,90,90,120 - - - N 1346
Co-Pu Pu2Co17 Th2Ni17,hP38,194 P63/mmc 0.8327,0.8327,0.8107,90,90,120 CaCu5-Zr4Al3 - 10.16 A 1346
Co-Pu Pu3Co Re3B,oS16,63 Cmcm 0.3475,1.0976,0.922,90,90,90 - - 14.94 X 1836
Co-Pu Pu6Co rt U6Mn,tI28,140 I4/mcm 1.0475,1.0475,0.534,90,90,90 - - 17.26 A 1346
Co-Re Re0.2 Co0.8 ht Cu,cF4,225 Fm-3m 0.367,0.367,0.367,90,90,90 close-packed structure - 11.34 X 473
Co-Re Re0.67 Co0.33 Mg,hP2,194 P63/mmc 0.268,0.268,0.431,90,90,120 close-packed structure - 17.86 X 47131
Co-Rh Co0.35 Rh0.65 ht Cu,cF4,225 Fm-3m 0.3698,0.3698,0.3698,90,90,90 close-packed structure - 11.49 X 57248
Co-Rh Co0.65 Rh0.35 rt Mg,hP2,194 P63/mmc 0.2602,0.2602,0.419,90,90,120 close-packed structure - 10.05 X 16223
Co-Ru Ru0.15 Co0.85 ht Cu,cF4,225 Fm-3m 0.3548,0.3548,0.3548,90,90,90 close-packed structure - 9.70 X 48066
Co-Ru Ru0.5 Co0.5 Mg,hP2,194 P63/mmc 0.26239,0.26239,0.41884,90,90,120 close-packed structure - 10.64 X 52589
Co-S CoS2 FeS2 ,cP12,205 Pa-3 0.55385,0.55385,0.55385,90,90,90 cattierite gray 4.81 X 24522
Co-S Co0.88 S ht NiAs,hP4,194 P63/mmc 0.337,0.337,0.516,90,90,120 jaipurite - 5.49 X 26261
Co-S Co0.90 S ht *,hP54,194 P63/mmc 1.01,1.01,1.548,90,90,120 - - - N 2646
Co-S Co3 S4 rt Fe3O4,cF56,227 Fd-3m 0.9406,0.9406,0.9406,90,90,90 linnaeite - 4.87 X 24731
Co-S Co9 S8 rt Co9S8,cF68,225 Fm-3m 0.9923,0.9923,0.9923,90,90,90 - white 5.35 X 8925
Co-Sb CoSb NiAs,hP4,194 P63/mmc 0.38906,0.38906,0.51875,90,90,120 AlB2 family - 8.82 X 54586
Co-Sb CoSb2 ht FeAs2,oP6,58 Pnnm 0.5517,0.6406,0.3411,90,90,90 pyrite-marcasite family - 8.33 X 56581
Co-Sb CoSb2 rt CoSb2,mP12,14 P121/c1 0.65051,0.63833,0.65410,90,117.65,90 pyrite-marcasite family - 8.35 X 19279
Co-Sb CoSb3 CoAs3,cI32,204 Im-3 0.9036,0.9036,0.9036,90,90,90 kieftite - 7.64 X 43392
Co-Sc ScCo CsCl,cP2,221 Pm-3m 0.316,0.316,0.316,90,90,90 b.c.c. family - 5.47 X 2178
Co-Sc ScCo 2 MgCu2,cF24,227 Fd-3m 0.6875,0.6875,0.6875,90,90,90 Friauf-Laves phase - 6.66 X 25319
Co-Sc Sc2Co cub Ti2Ni,cF96,227 Fd-3m 1.223,1.223,1.223,90,90,90 - - 4.32 A 2052
Co-Sc Sc2Co tet CuAl2,tI12,140 I4/mcm 0.6377,0.6377,0.5618,90,90,90 - - 4.33 X 6743
68 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Co-Sc Sc3Co Sc3Co,oP32,62 Pnma 1.3102,0.8624,0.5829,90,90,90 - - 3.91 X 11264


Co-Se CoSe NiAs,hP4,194 P63 /mmc 0.3585,0.3585,0.54747,90,90,120 AlB2 family black 7.52 X 54807
Co-Se CoSe2 has FeS2,oP6,58 Pnnm 0.484,0.572,0.36,90,90,90 hastite ? - 7.23 A 701
Co-Se CoSe2 rt FeS2,cP12,205 Pa-3 0.58593,0.58593,0.58593,90,90,90 trogtalite rose violet 7.16 X 4461
Co-Se Co2Se3 rt *,m**,* - 0.5188,0.3553,0.6114,90,91.25,90 - - - N 6885
Co-Se Co3Se4 bor Fe3O4,cF56,227 Fd-3m 1.02,1.02,1.02,90,90,90 bornhardtite rose 6.17 A 701
Co-Se Co3Se4 rt Cr3S4,mS14,12 C12/m1 1.21,0.357,0.6183,90,120.73,90 - gray 7.13 X 43888
Co-Se Co6.8 Se8 Cr7Se8,mS30,12 C12/m1 1.04002,0.71402,0.80798,90,130.066,90 - gray 7.47 X 43888
Co-Se Co9Se8 rt Co9S8,cF68,225 Fm-3m 1.1435,1.1435,1.1435,90,90,90 - - 5.16 A 4827
Co-Si CoSi FeSi,cP8,198 P213 0.445,0.445,0.445,90,90,90 - gray dark 6.56 X 50112
Co-Si CoSi2 hp *,oP12,* Pnma 0.44615,0.36098,0.8807,90,90,90 - - 5.39 N 50742
Co-Si CoSi2 CaF2,cF12,225 Fm-3m 0.5364,0.5364,0.5364,90,90,90 fluorite family gray dark 4.95 X 20575
Co-Si Co0.85 Si0.15 ht Cu,cF4,225 Fm-3m 0.3534,0.3534,0.3534,90,90,90 close-packed structure - 8.17 X 1870
Co-Si Co0.9 Si0.1 rt Mg,hP2,194 P63 /mmc 0.2507,0.2507,0.4065,90,90,120 close-packed structure - 8.38 X 16223
Co-Si Co2Si Co2Si-b,oP12,62 Pnma 0.4906,0.3729,0.709,90,90,90 - - 7.47 X 34364
Co-Si Co2Si3 hp-ht Ru2Sn3,tP20,116 P-4c2 0.5234,0.5234,0.8543,90,90,90 chimney-ladder structure - 5.74 A 15256
Co-Si Co3Si m Mg3Cd,hP8,194 P63 /mmc 0.4976,0.4976,0.4069,90,90,120 close-packed structure - 7.80 A 7830
Co-Sm SmCo2 lt TbFe2,hR18,166 R-3m 0.51364,0.51364,1.2582,90,90,120 Friauf-Laves phase - 9.30 A 8648
Co-Sm SmCo2 rt MgCu2,cF24,227 Fd-3m 0.727,0.727,0.727,90,90,90 Friauf-Laves phase - 9.28 X 22365
Co-Sm SmCo3 PuNi3,hR36,166 R-3m 0.5084,0.5084,2.5016,90,90,120 Laves-CaCu5 - 8.73 X 55173
Co-Sm SmCo5 m *,hP48,* - 0.99952,0.99952,0.79559,90,90,120 - - - N 7479
Co-Sm SmCo5 CaCu5,hP6,191 P6/mmm 0.5,0.5,0.398,90,90,120 - - 8.58 X 21403
Co-Sm Sm0.67 Co5.67 ht Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.48562,0.48562,0.40813,90,90,120 CaCu5-Zr4Al3 - 8.66 X 7158
Co-Sm Sm0.97 Co5.06 ht Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4979,0.4979,0.3991,90,90,120 CaCu5-Zr4Al3 - 8.61 A 8495
Co-Sm Sm2Co17 ht Th2Ni17,hP38,194 P63 /mmc 0.8341,0.8341,0.8153,90,90,120 CaCu5-Zr4Al3 - 8.81 X 33200
Co-Sm Sm2Co17 rt Zn17Th2,hR57,166 R-3m 0.83657,0.83657,1.22336,90,90,120 CaCu5-Zr4Al3 - 8.75 X 52363
Co-Sm Sm2Co7 ht Gd2Co7,hR54,166 R-3m 0.507,0.507,3.64,90,90,120 Laves-CaCu5 - 8.77 A 21403
Co-Sm Sm2Co7 rt Ce2Ni7,hP36,194 P63 /mmc 0.50433,0.50433,2.43117,90,90,120 Laves-CaCu5 - 8.85 X 8018
Co-Sm Sm3Co Fe3C-b,oP16,62 Pnma 0.706,0.96,0.634,90,90,90 - - 7.89 A 11388
Co-Sm Sm5Co19 ht1 Ce5Co19,hR72,166 R-3m 0.50314,0.50314,4.8402,90,90,120 Laves-CaCu5 - 8.79 A 8648
Co-Sm Sm5Co19 ht2 Sm5Co19,hP48,194 P63 /mmc 0.50312,0.50312,3.2265,90,90,120 Laves-CaCu5 - 8.79 X 8499
Co-Sm Sm5Co2 Mn5C2,mS28,15 C12/c1 1.6282,0.6392,0.7061,90,96.6,90 - - 7.92 X 9556
Co-Sn CoSn rt CoSn,hP6,191 P6/mmm 0.5279,0.5279,0.42597,90,90,120 AlB2 family - 8.61 X 31772
Co-Sn CoSn2 m CoSn2,tP3,99 P4mm 0.3089,0.3089,0.5846,90,90,90 - - 8.82 X 52804
Co-Sn CoSn2 CuAl2,tI12,140 I4/mcm 0.6373,0.6373,0.5463,90,90,90 - gray silver 8.87 X 53903
Co-Sn CoSn3 hp1 PdSn3,oS32,64 Cmce 1.6864,0.6268,0.627,90,90,90 - gray tin 8.32 X 32617
Co-Sn CoSn3 ht CoSn3,tI64,142 I41/acd 0.6275,0.6275,3.374,90,90,90 - gray tin 8.30 X 32617
Co-Sn CoSn4 *,o**,* - 0.571,0.629,0.641,90,90,90 - - - N 22776
Co-Sn Co0.75 Sn0.25 m W,cI2,229 Im-3m 0.29228,0.29228,0.29228,90,90,90 b.c.c. family - 9.83 X 13853
Co-Sn Co0.83 Sn5 Co0.83 Sn5,tP12,124 P4/mcc 0.69328,0.69328,0.57924,90,90,90 - - 7.66 X 58812
Co-Sn Co0.9 Sn0.1 rt Mg,hP2,194 P63 /mmc 0.2522,0.2522,0.4159,90,90,120 close-packed structure - 9.41 X 16223
Co-Sn Co0.985 Sn0.015 ht Cu,cF4,225 Fm-3m 0.35523,0.35523,0.35523,90,90,90 close-packed structure - 8.87 X 33133
Co-Sn Co1.5 Sn ht Co1.75 Ge,hP6,194 P63 /mmc 0.4113,0.4113,0.5185,90,90,120 AlB2 family - 9.05 X 9917
Co-Sn Co1.5 Sn0.5 hp2 CsCl,cP2,221 Pm-3m 0.2939,0.2939,0.2939,90,90,90 b.c.c. family - 9.66 X 20600
Co-Sn Co2.9 Sn2 rt Ni3Sn2,oP20,62 Pnma 0.7085,0.5216,0.8194,90,90,90 AlB2 family - 8.96 X 18755
Co-Ta TaCo2 ht MgZn2,hP12,194 P63 /mmc 0.4787,0.4787,0.7827,90,90,120 Friauf-Laves phase - 12.78 X 1601
Co-Ta TaCo2 rt MgNi2,hP24,194 P63 /mmc 0.4732,0.4732,1.542,90,90,120 Friauf-Laves phase - 13.28 X 1601
Co-Ta TaCo3 ht Cu3Au,cP4,221 Pm-3m 0.367,0.367,0.367,90,90,90 close-packed structure - 12.02 X 5906
Co-Ta TaCo3 rt BaPb3,hR36,166 R-3m 0.51864,0.51864,1.887,90,90,120 close-packed structure - 12.16 X 3705
Co-Ta Ta0.75 Co2.25 MgCu2,cF24,227 Fd-3m 0.6788,0.6788,0.6788,90,90,90 Friauf-Laves phase - 11.40 X 16223
Co-Ta Ta2Co CuAl2,tI12,140 I4/mcm 0.6116,0.6116,0.4969,90,90,90 - - 15.04 X 6743
Co-Ta Ta6.5 Co6.5 W6Fe7,hR39,166 R-3m 0.4905,0.4905,2.633,90,90,120 Frank-Kasper phase - 14.16 X 4250
Co-Tb TbCo2 lt TbFe2,hR18,166 R-3m 0.5093,0.5093,1.2514,90,90,120 Friauf-Laves phase - 9.81 X 16201
Co-Tb TbCo2 rt MgCu2,cF24,227 Fd-3m 0.721,0.721,0.721,90,90,90 Friauf-Laves phase - 9.81 X 16201
Co-Tb TbCo3 ht PuNi3,hR36,166 R-3m 0.502,0.502,2.445,90,90,120 Laves-CaCu5 - 9.40 A 23902
Co-Tb TbCo5 CaCu5,hP6,191 P6/mmm 0.4952,0.4952,0.3974,90,90,120 - - 8.93 X 44607
Co-Tb Tb0.86 Co5.28 Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.48637,0.48637,0.40216,90,90,120 CaCu5-Zr4Al3 - 9.03 A 44607
Co-Tb Tb12Co7 Ho12Co7,mP38,14 P121/c1 0.839,1.132,1.11343,90,124.265,90 - - 8.82 A 9613
Co-Tb Tb2Co17 ht Th2Ni17,hP38,194 P63 /mmc 0.8347,0.8347,0.81435,90,90,120 CaCu5-Zr4Al3 - 8.92 A 44607
Co-Tb Tb2Co17 rt Zn17Th2,hR57,166 R-3m 0.8376,0.8376,1.2198,90,90,120 CaCu5-Zr4Al3 - 8.87 A 9277
Co-Tb Tb2Co7 Gd2Co7,hR54,166 R-3m 0.5002,0.5002,3.6221,90,90,120 Laves-CaCu5 - 9.27 A 50359
Co-Tb Tb3Co Fe3C-b,oP16,62 Pnma 0.6997,0.9417,0.6274,90,90,90 - - 8.61 A 19447
Co-Tb Tb6Co4.5 rt Ho6Co4.5 ,hP22,176 P63 /m 1.152,1.152,0.4008,90,90,120 - - 8.79 X 4009
Co-Tc Tc0.5 Co0.5 rt Mg,hP2,194 P63 /mmc 0.2628,0.2628,0.4193,90,90,120 close-packed structure - 10.39 X 1920
Co-Te CoTe2 hp FeS2,cP12,205 Pa-3 0.632,0.632,0.632,90,90,90 pyrite-marcasite family - 8.27 A 9834
Co-Te CoTe2 FeS2,oP6,58 Pnnm 0.53267,0.63219,0.39059,90,90,90 mattagamite gray 7.93 X 34656
Co-Te Co0.90 Te NiAs,hP4,194 P63 /mmc 0.3887,0.3887,0.5379,90,90,120 AlB2 family gray silver 8.52 X 19103
Co-Th ThCo TlI,oS8,63 Cmcm 0.374,1.088,0.416,90,90,90 CrB(TlI)-FeB gray 11.42 X 738
Co-Th ThCo3 PuNi3,hR36,166 R-3m 0.5038,0.5038,2.464,90,90,120 Laves-CaCu5 - 11.28 A 3137
Co-Th ThCo5 CaCu5,hP6,191 P6/mmm 0.4999,0.4999,0.40015,90,90,120 - - 10.10 X 9271
Co-Th Th2Co17 rhom Zn17Th2,hR57,166 R-3m 0.8438,0.8438,1.2254,90,90,120 CaCu5-Zr4Al3 - 9.67 X 4424
Co-Th Th2Co7 ht Gd2Co7,hR54,166 R-3m 0.5035,0.5035,3.6986,90,90,120 Laves-CaCu5 - 10.76 A 22422
Co-Th Th2Co7 rt Ce2Ni7,hP36,194 P63 /mmc 0.503,0.503,2.462,90,90,120 Laves-CaCu5 - 10.79 X 4975
Co-Th Th7Co3 Th7Fe3,hP20,186 P63 mc 0.983,0.983,0.617,90,90,120 - - 11.59 X 738
Co-Ti TiCo rt CsCl,cP2,221 Pm-3m 0.2995,0.2995,0.2995,90,90,90 b.c.c. family - 6.60 X 20604
Co-Ti TiCo 2 MgCu2,cF24,227 Fd-3m 0.669,0.669,0.669,90,90,90 Friauf-Laves phase - 7.35 X 20217
Co-Ti TiCo 3 rt Cu3Au,cP4,221 Pm-3m 0.3597,0.3597,0.3597,90,90,90 close-packed structure - 8.02 X 42114
Co-Ti Ti0.13 Co0.87 ht Cu,cF4,225 Fm-3m 0.3588,0.3588,0.3588,90,90,90 close-packed structure - 8.27 X 6149
Handbook of Inorganic Substances – Edition 2015 : Data 69

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Co-Ti Ti0.77 Co0.23 ht W,cI2,229 Im-3m 0.314,0.314,0.314,90,90,90 b.c.c. family - 5.41 X 18514
Co-Ti Ti0.9 Co2.1 MgNi2,hP24,194 P63/mmc 0.4732,0.4732,1.5427,90,90,120 Friauf-Laves phase - 7.41 A 6149
Co-Ti Ti2Co cub1 Ti2Ni,cF96,227 Fd-3m 1.12881,1.12881,1.12881,90,90,90 - - 5.72 X 49263
Co-Ti Ti2Co cub2 MgCu2,cF24,227 Fd-3m 0.673,0.673,0.673,90,90,90 Friauf-Laves phase - 6.74 X 456
Co-Tm TmCo 2 lt TbFe 2,hR18,166 R-3m 0.50399,0.50399,1.22806,90,90,120 Friauf-Laves phase - 10.58 A 30461
Co-Tm TmCo 2 rt MgCu2,cF24,227 Fd-3m 0.71181,0.71181,0.71181,90,90,90 Friauf-Laves phase - 10.56 X 30461
Co-Tm TmCo 3 lt PuNi3,hR36,166 R-3m 0.4966,0.4966,2.423,90,90,120 Laves-CaCu5 - 9.99 A 23902
Co-Tm Tm2 Co17 Th2Ni17,hP38,194 P63/mmc 0.8298,0.8298,0.8136,90,90,120 CaCu5-Zr4Al3 - 9.17 A 40011
Co-Tm Tm2 Co7 lt *,o**,* - 0.285,0.4954,3.604,90,90,90 - - - N 26165
Co-Tm Tm2 Co7 rt Gd2Co 7,hR54,166 R-3m 0.4962,0.4962,3.608,90,90,120 Laves-CaCu5 - 9.72 A 26165
Co-Tm Tm6 Co4.5 Ho6Co 4.5 ,hP22,176 P63/m 1.129,1.129,0.3953,90,90,120 - - 9.73 X 4009
Co-U UCo UCo,cI16,199 I213 0.63557,0.63557,0.63557,90,90,90 b.c.c. family - 15.37 X 332
Co-U UCo 2 MgCu2,cF24,227 Fd-3m 0.6992,0.6992,0.6992,90,90,90 Friauf-Laves phase - 13.83 X 19436
Co-U UCo 3 rt PuNi3,hR36,166 R-3m 0.498,0.498,2.418,90,90,120 Laves-CaCu5 - 11.94 A 28753
Co-U UCo 5 UCo 5,hR54,166 R-3m 0.478,0.478,3.634,90,90,120 - gray 11.07 X 23509
Co-U U6Co U6Mn,tI28,140 I4/mcm 1.036,1.036,0.521,90,90,90 - - 17.66 X 440
Co-V VCo 3 rt PuAl3,hP24,194 P63/mmc 0.5032,0.5032,1.227,90,90,120 close-packed structure - 8.43 X 1054
Co-V V0.124 Co0.876 ht Cu,cF4,225 Fm-3m 0.3555,0.3555,0.3555,90,90,90 close-packed structure - 8.57 X 10102
Co-V V0.62 Co0.38 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.8834,0.8834,0.45865,90,90,90 Frank-Kasper phase - 7.51 X 15474
Co-V V0.7 Co3.3 ht1 Cu3Au,cP4,221 Pm-3m 0.3555,0.3555,0.3555,90,90,90 close-packed structure - 8.51 X 12847
Co-V V0.7 Co3.3 rt Cu3Au,cP4,221 Pm-3m 0.3552,0.3552,0.3552,90,90,90 close-packed structure - 8.53 X 12847
Co-V V0.93 Co0.07 W,cI2,229 Im-3m 0.3006,0.3006,0.3006,90,90,90 b.c.c. family - 6.30 X 51255
Co-V V3Co rt Cr3Si,cP8,223 Pm-3n 0.4676,0.4676,0.4676,90,90,90 Frank-Kasper phase - 6.88 X 8265
Co-W WCo 3 rt Mg3 Cd,hP8,194 P63/mmc 0.512,0.512,0.412,90,90,120 close-packed structure - 12.81 X 152
Co-W W0.15 Co0.85 rt Mg,hP2,194 P63/mmc 0.2544,0.2544,0.4146,90,90,120 close-packed structure - 11.10 X 16223
Co-W W0.2 Co0.8 ht Cu,cF4,225 Fm-3m 0.3628,0.3628,0.3628,90,90,90 close-packed structure - 11.67 X 16223
Co-W W6Co7 rt W6Fe7,hR39,166 R-3m 0.4755,0.4755,2.56817,90,90,120 Frank-Kasper phase - 15.01 X 152
Co-Y YCo TlI,oS8,63 Cmcm 0.4106,1.0358,0.3906,90,90,90 CrB(TlI)-FeB - 5.91 X 17517
Co-Y YCo 2 MgCu2,cF24,227 Fd-3m 0.7221,0.7221,0.7221,90,90,90 Friauf-Laves phase - 7.30 X 24956
Co-Y YCo 3 hex CeNi3,hP24,194 P63/mmc 0.501,0.501,1.623,90,90,120 Laves-CaCu5 - 7.50 A 19099
Co-Y YCo 3 rhom PuNi3,hR36,166 R-3m 0.50152,0.50152,2.43805,90,90,120 Laves-CaCu5 - 7.48 X 49378
Co-Y YCo 5 CaCu5,hP6,191 P6/mmm 0.495,0.495,0.3973,90,90,120 - - 7.56 X 21255
Co-Y Y2Co 17 ht Th2Ni17,hP38,194 P63/mmc 0.8347,0.8347,0.8142,90,90,120 CaCu5-Zr4Al3 - 7.98 A 44841
Co-Y Y2Co 17 rt Zn17 Th2,hR57,166 R-3m 0.8356,0.8356,1.22,90,90,120 CaCu5-Zr4Al3 - 7.97 A 25689
Co-Y Y2Co 3 *,cP*,* - 0.7996,0.7996,0.7996,90,90,90 - - - N 2677
Co-Y Y2Co 7 rt Gd2Co 7,hR54,166 R-3m 0.5,0.5,3.622,90,90,120 Laves-CaCu5 - 7.50 A 25689
Co-Y Y3Co Fe3C-b,oP16,62 Pnma 0.7053,0.9448,0.634,90,90,90 - - 5.12 A 19447
Co-Y Y3Co 2 rt Y3Co 2,oP20,58 Pnnm 0.9389,1.2248,0.3975,90,90,90 - - 5.59 X 8855
Co-Y Y6Co 4.5 rt Ho6Co 4.5 ,hP22,176 P63/m 1.1528,1.1528,0.4051,90,90,120 - - 5.69 X 19977
Co-Y Y8Co 5 Y8Co 5,mP52,14 P121/c1 0.7058,0.7286,2.4277,90,102.11,90 - - 5.47 X 9656
Co-Yb YbCo 2 MgCu2,cF24,227 Fd-3m 0.706,0.706,0.706,90,90,90 Friauf-Laves phase - 10.98 X 2797
Co-Yb YbCo 3 PuNi3,hR36,166 R-3m 0.4946,0.4946,2.4184,90,90,120 Laves-CaCu5 - 10.20 A 10149
Co-Yb YbCo 5 CaCu5,hP6,191 P6/mmm 0.4869,0.4869,0.3988,90,90,120 - - 9.49 X 22178
Co-Yb Yb2Co 17 Th2Ni17,hP38,194 P63/mmc 0.8308,0.8308,0.8098,90,90,120 CaCu5-Zr4Al3 - 9.25 A 40672
Co-Yb Yb3Co hp Fe3C-b,oP16,62 Pnma 0.714,0.912,0.613,90,90,90 - - 9.62 A 19088
Co-Zn Zn0.1 Co0.9 ht Cu,cF4,225 Fm-3m 0.3595,0.3595,0.3595,90,90,90 close-packed structure - 8.52 X 30489
Co-Zn Zn0.5 Co0.5 rt Mn,cP20,213 P4132 0.6319,0.6319,0.6319,90,90,90 - - 8.18 A 16223
Co-Zn Zn10.27 Co2.73 Zn9(Zn0.5 Fe0.5)2Fe2,cI52,217 I-43m 0.89277,0.89277,0.89277,90,90,90 γ-brass - 7.77 A 55202
Co-Zn Zn13 Co Zn13 Co,mS28,12 C12/m1 1.0846,0.7535,0.4992,90,100.72,90 - - 7.53 X 1606
Co-Zn Zn17.5 Co2.5 Zn17 (Zn0.5 Co0.5)Co2,hP60,171 P62 1.1292,1.1292,0.775,90,90,120 - gray 7.52 X 40515
Co-Zn Zn7.8 Co inc Zn7.8 Co,mS28,12 C12/m1 0.903,0.4338,0.77083,90,125.755,90 - gray silver 7.71 X 41288
Co-Zr ZrCo CsCl,cP2,221 Pm-3m 0.3195,0.3195,0.3195,90,90,90 b.c.c. family - 7.65 X 50115
Co-Zr ZrCo 2 MgCu2,cF24,227 Fd-3m 0.6933,0.6933,0.6933,90,90,90 Friauf-Laves phase - 8.34 X 41690
Co-Zr Zr2Co ht Ti2Ni,cF96,227 Fd-3m 1.2182,1.2182,1.2182,90,90,90 - - 7.09 A 15259
Co-Zr Zr2Co rt CuAl2,tI12,140 I4/mcm 0.63642,0.63642,0.55204,90,90,90 - - 7.17 X 27440
Co-Zr Zr2Co11 *,oP*,50 Pban 0.48,3.6,0.82,90,90,90 - - - N 24735
Co-Zr Zr3Co hex Mg3 Cd,hP8,194 P63/mmc 0.5966,0.5966,0.466,90,90,120 close-packed structure - 7.69 A 2633
Co-Zr Zr3Co orth Re3B,oS16,63 Cmcm 0.327,1.084,0.895,90,90,90 - - 6.96 X 5211
Co-Zr Zr3Co2 *,o**,* - 0.344,0.861,1.203,90,90,90 - - - N 15259
Co-Zr Zr4Co m1 *,hP*,* - 0.5038,0.5038,0.3126,90,90,120 - - - N 15259
Co-Zr Zr4Co m2 *,o**,* - 0.3281,0.3553,0.6864,90,90,90 - - - N 15259
Co-Zr Zr6Co23 Th6Mn23,cF116,225 Fm-3m 1.1516,1.1516,1.1516,90,90,90 - - 8.28 X 3112
Cr-Cu Cu0.063 Cr0.937 W,cI2,229 Im-3m 0.2933,0.2933,0.2933,90,90,90 b.c.c. family - 6.94 X 46713
Cr-Cu Cu0.77 Cr0.23 m Cu,cF4,225 Fm-3m 0.3623,0.3623,0.3623,90,90,90 close-packed structure - 8.50 X 21267
Cr-F CrF2 CuF2,mP6,14 P121/c1 0.3505,0.4718,0.55597,90,122.262,90 - - 3.84 X 894
Cr-F CrF3 rt FeF3 ,hR24,167 R-3c 0.49863,0.49863,1.32142,90,90,120 - - 3.82 X 42719
Cr-F CrF4 mon CrF4 ,mS80,15 C12/c1 1.457,0.972,0.719,90,102.68,90 - red dark 3.42 X 39710
Cr-F CrF4 tet CrF4 ,tP20,136 P42/mnm 0.8296,0.8296,0.3737,90,90,90 - violet 3.31 X 31068
Cr-F CrF5 CrF5 ,oP24,57 Pbcm 0.78299,0.7534,0.55181,90,90,90 - red 3.00 X 53412
Cr-F Cr2F5 Cr2F5,mS28,15 C12/c1 0.77526,0.75228,0.71317,90,120.124,90 - - 3.67 X 26364
Cr-Fe Cr0.03 Fe0.97 ht2 W,cI2,229 Im-3m 0.28692,0.28692,0.28692,90,90,90 b.c.c. family - 7.84 X 3264
Cr-Fe Cr0.35 Fe0.65 tf In,oF4,69 Fmmm 0.3453,0.4089,0.4206,90,90,90 - - 6.10 X 52508
Cr-Fe Cr0.49 Fe0.51 ht1 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.87966,0.87966,0.45582,90,90,90 Frank-Kasper phase - 7.62 X 15937
Cr-Fe Cr0.52 Fe0.48 tf cub Cr,cP8,223 Pm-3n 0.4638,0.4638,0.4638,90,90,90 - - 7.17 X 52508
Cr-Fe Cr0.52 Fe0.48 tf orth *,oP8,* - 0.4601,0.4638,0.4848,90,90,90 - - 6.91 N 52508
Cr-Ga CrGa ht MnGa,hR78,166 R-3m 1.2625,1.2625,0.7785,90,90,120 - - 7.34 X 42973
Cr-Ga CrGa4 Hg4Pt,cI10,229 Im-3m 0.56497,0.56497,0.56497,90,90,90 - - 6.09 X 44615
Cr-Ga Cr3Ga rt Cr3Si,cP8,223 Pm-3n 0.4646,0.4646,0.4646,90,90,90 Frank-Kasper phase - 7.47 X 57058
70 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cr-Ga Cr3Ga4 Fe3Ga4,mS42,12 C12/m1 1.0135,0.7845,0.7986,90,105.99,90 - - 7.10 X 8839


Cr-Ge CrGe FeSi,cP8,198 P213 0.48,0.48,0.48,90,90,90 - - 7.48 X 7734
Cr-Ge Cr0.04 Ge0.96 C,cF8,227 Fd-3m 0.56491,0.56491,0.56491,90,90,90 - - 5.29 X 13331
Cr-Ge Cr0.93 Ge0.07 W,cI2,229 Im-3m 0.2897,0.2897,0.2897,90,90,90 b.c.c. family - 7.30 X 13331
Cr-Ge Cr11Ge19 Mn11Si19,tP120,118 P-4n2 0.58,0.58,5.234,90,90,90 chimney-ladder structure - 7.36 X 3785
Cr-Ge Cr11Ge8 Cr11Ge8,oP76,62 Pnma 1.3171,0.4939,1.5775,90,90,90 - - 7.46 X 8423
Cr-Ge Cr3Ge Cr3Si,cP8,223 Pm-3n 0.463,0.463,0.463,90,90,90 Frank-Kasper phase - 7.65 X 7420
Cr-Ge Cr5Ge3 ht W5Si3,tI32,140 I4/mcm 0.9413,0.9413,0.478,90,90,90 - - 7.49 X 929
Cr-H CrH cub NaCl,cF8,225 Fm-3m 0.3854,0.3854,0.3854,90,90,90 rocksalt family - 6.15 X 48584
Cr-H CrH hex ZnO,hP4,186 P63 mc 0.272,0.272,0.443,90,90,120 adamantane structure - 6.20 X 316
Cr-H CrH0.08 W,cI2,229 Im-3m 0.2888,0.2888,0.2888,90,90,90 b.c.c. family - 7.18 F 5362
Cr-H CrH2 CaF2,cF12,225 Fm-3m 0.38605,0.38605,0.38605,90,90,90 fluorite family - 6.24 X 316
Cr-Hf HfCr2 ht2 MgZn2,hP12,194 P63 /mmc 0.5067,0.5067,0.8237,90,90,120 Friauf-Laves phase - 10.25 X 1528
Cr-Hf HfCr2 rt MgCu2,cF24,227 Fd-3m 0.715,0.715,0.715,90,90,90 Friauf-Laves phase - 10.27 X 45378
Cr-Hf Hf1.11 Cr1.89 ht1 MgNi2,hP24,194 P63 /mmc 0.508,0.508,1.656,90,90,120 Friauf-Laves phase - 10.64 A 7745
Cr-I CrI2 mon CuBr2,mS6,12 C12/m1 0.7545,0.3929,0.7505,90,115.52,90 - - 5.06 X 1598
Cr-I CrI2 orth CrI2,oS12,36 Cmc21 0.3915,0.756,1.3553,90,90,90 - brown red 5.06 X 7119
Cr-I CrI3 CrCl3,hP24,151 P3112 0.685,0.685,1.989,90,90,120 - - 5.33 A 6611
Cr-In Cr0.25 In0.75 Cu,cF4,225 Fm-3m 0.469,0.469,0.469,90,90,90 close-packed structure - 6.38 X 2323
Cr-Ir Cr0.2 Ir0.8 Cu,cF4,225 Fm-3m 0.38,0.38,0.38,90,90,90 close-packed structure - 19.87 X 719
Cr-Ir Cr0.5 Ir0.5 Mg,hP2,194 P63 /mmc 0.2674,0.2674,0.4278,90,90,120 close-packed structure - 15.31 X 7491
Cr-Ir Cr3Ir Cr3Si,cP8,223 Pm-3n 0.4681,0.4681,0.4681,90,90,90 Frank-Kasper phase - 11.28 X 3823
Cr-Mn Cr0.2Mn0.8 ht2 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.8865,0.8865,0.4598,90,90,90 Frank-Kasper phase - 7.49 A 1324
Cr-Mn Cr0.4Mn0.6 W,cI2,229 Im-3m 0.29,0.29,0.29,90,90,90 b.c.c. family - 7.32 X 12561
Cr-Mo Cr0.3Mo0.7 W,cI2,229 Im-3m 0.3083,0.3083,0.3083,90,90,90 b.c.c. family - 9.38 X 26021
Cr-N CrN lt CrN,oP4,59 Pmmn 0.29698,0.41318,0.28796,90,90,90 - - 6.20 X 4518
Cr-N CrN rt NaCl,cF8,225 Fm-3m 0.4155,0.4155,0.4155,90,90,90 rocksalt family gray dark 6.11 X 34606
Cr-N Cr2N prec W2C,hP11,162 P-31m 0.48,0.48,0.4472,90,90,120 - - 6.59 X 47543
Cr-N Cr2N0.9 rt Fe2N,hP9,162 P-31m 0.4752,0.4752,0.4429,90,90,120 - gray silver 6.71 X 23519
Cr-Nb NbCr2 ht1 Ti2Ni,cF96,227 Fd-3m 1.146,1.146,1.146,90,90,90 - - 6.95 A 3116
Cr-Nb NbCr2 ht2 MgZn2,hP12,194 P63 /mmc 0.4931,0.4931,0.8123,90,90,120 Friauf-Laves phase - 7.65 A 19107
Cr-Nb NbCr2 rt MgCu2,cF24,227 Fd-3m 0.6912,0.6912,0.6912,90,90,90 Friauf-Laves phase - 7.92 X 56407
Cr-Nb Nb0.04 Cr0.96 W,cI2,229 Im-3m 0.2891,0.2891,0.2891,90,90,90 b.c.c. family - 7.37 X 1450
Cr-Nb Nb0.98 Cr0.02 W,cI2,229 Im-3m 0.3255,0.3255,0.3255,90,90,90 b.c.c. family - 8.87 X 1450
Cr-Ni CrNi2 rt *,cF*,* - 1.064,1.064,1.064,90,90,90 close-packed structure - 7.47 N 795
Cr-Ni Cr0.114 Ni0.886 ht Cu,cF4,225 Fm-3m 0.3543,0.3543,0.3543,90,90,90 close-packed structure - 8.65 X 57085
Cr-Ni Cr0.7 Ni0.3 m (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.8825,0.8825,0.4598,90,90,90 Frank-Kasper phase - 7.51 A 6918
Cr-Ni Cr0.8 Ni0.2 W,cI2,229 Im-3m 0.2872,0.2872,0.2872,90,90,90 b.c.c. family - 7.48 X 390
Cr-Ni Cr3.5 Ni0.5 m Cr3Si,cP8,223 Pm-3n 0.4588,0.4588,0.4588,90,90,90 Frank-Kasper phase - 7.27 X 6918
Cr-O CrO0.87 NaCl,cF8,225 Fm-3m 0.404,0.404,0.404,90,90,90 rocksalt family gray silver 6.64 X 3664
Cr-O CrO2 hp CaCl2,oP6,58 Pnnm 0.42818,0.43874,0.28779,90,90,90 - - 5.16 X 47323
Cr-O CrO2 TiO2,tP6,136 P42 /mnm 0.4419,0.4419,0.29154,90,90,90 - - 4.90 X 6897
Cr-O CrO3 CrO3,oS16,40 Ama2 0.5743,0.8557,0.4789,90,90,90 - red dark 2.82 X 5005
Cr-O Cr2O CaF2,cF12,225 Fm-3m 0.5512,0.5512,0.5512,90,90,90 fluorite family - 4.76 X 46280
Cr-O Cr2O3 Al2O3,hR30,167 R-3c 0.4821,0.4821,1.324,90,90,120 eskolaite black 5.68 X 56914
Cr-O Cr3O Cr3Si,cP8,223 Pm-3n 0.4544,0.4544,0.4544,90,90,90 Frank-Kasper phase - 6.09 X 589
Cr-O Cr5O12 Cr5O12,oP68,60 Pbcn 1.2044,0.8212,0.8177,90,90,90 - - 3.71 X 2514
Cr-O Cr6O11 Ti6O11,aP34,2 P-1 0.53,0.68999,0.90975,87.148,82.039,72.499 - - 5.16 A 8390
Cr-O Cr8O21 rt Cr8O21,aP29,2 P-1 0.5433,0.6557,1.2044,74.87,89.25,77.96 - - 3.09 X 25104
Cr-Os Cr0.1 Os0.9 Mg,hP2,194 P63 /mmc 0.2676,0.2676,0.4277,90,90,120 close-packed structure - 22.09 X 985
Cr-Os Cr0.67 Os0.33 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.905,0.905,0.469,90,90,90 Frank-Kasper phase - 12.66 X 12978
Cr-Os Cr0.75 Os0.25 W,cI2,229 Im-3m 0.2927,0.2927,0.2927,90,90,90 b.c.c. family - 11.46 X 2174
Cr-Os Cr2.88 Os1.12 rt Cr3Si,cP8,223 Pm-3n 0.46842,0.46842,0.46842,90,90,90 Frank-Kasper phase - 11.72 X 3823
Cr-P CrP FeAs,oP8,62 Pnma 0.5356,0.3117,0.6007,90,90,90 AlB2 family - 5.50 X 6518
Cr-P CrP2 OsGe2,mS12,12 C12/m1 0.8213,0.3034,0.7098,90,119.47,90 - black 4.92 A 7193
Cr-P CrP4 hp CrP4,mS20,15 C12/c1 0.51914,1.07600,0.57712,90,110.648,90 - black 3.87 X 6404
Cr-P Cr12P 7 V12P 7,hP26,176 P63 /m 0.8981,0.8981,0.3313,90,90,120 - brown dark 6.03 X 12186
Cr-P Cr2P rt Cr2P,oI36,44 Imm2 0.66097,1.04023,0.63371,90,90,90 - - 6.17 X 32046
Cr-P Cr3P Ni3P,tI32,82 I-4 0.91887,0.91887,0.45593,90,90,90 - - 6.45 X 6930
Cr-Pd Cr0.25Pd0.75 ht Cu,cF4,225 Fm-3m 0.3589,0.3589,0.3589,90,90,90 close-packed structure - 13.33 X 17063
Cr-Pd Cr0.495Pd0.505 rt In,tI2,139 I4/mmm 0.2745,0.2745,0.3784,90,90,90 close-packed structure - 9.26 X 650
Cr-Pd Cr1.33Pd2.67 rt Cu3Au,cP4,221 Pm-3m 0.3852,0.3852,0.3852,90,90,90 close-packed structure - 10.26 X 3773
Cr-Pt CrPt rt CuAu,tP2,123 P4/mmm 0.27146,0.27146,0.3827,90,90,90 close-packed structure - 14.55 X 47421
Cr-Pt CrPt3 rt Cu3Au,cP4,221 Pm-3m 0.3876,0.3876,0.3876,90,90,90 close-packed structure - 18.17 X 19197
Cr-Pt Cr0.5Pt0.5 ht Cu,cF4,225 Fm-3m 0.3825,0.3825,0.3825,90,90,90 close-packed structure - 14.66 X 44129
Cr-Pt Cr2.52Pt1.48 cub2 Cu3Au,cP4,221 Pm-3m 0.3775,0.3775,0.3775,90,90,90 close-packed structure - 12.96 X 807
Cr-Pt Cr3.16Pt0.84 cub1 Cr3Si,cP8,223 Pm-3n 0.47058,0.47058,0.47058,90,90,90 Frank-Kasper phase - 10.46 X 3823
Cr-Re Cr0.003 Re0.997 Mg,hP2,194 P63 /mmc 0.2762,0.2762,0.4458,90,90,120 close-packed structure - 20.95 X 47131
Cr-Re Cr0.4 Re0.6 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.93,0.93,0.485,90,90,90 Frank-Kasper phase - 15.74 X 2081
Cr-Re Cr0.8 Re0.2 W,cI2,229 Im-3m 0.2935,0.2935,0.2935,90,90,90 b.c.c. family - 10.36 X 16338
Cr-Rh CrRh3 Cu3Au,cP4,221 Pm-3m 0.3786,0.3786,0.3786,90,90,90 close-packed structure - 11.04 X 4876
Cr-Rh Cr0.05 Rh0.95 Cu,cF4,225 Fm-3m 0.377,0.377,0.377,90,90,90 close-packed structure - 12.44 X 719
Cr-Rh Cr0.5 Rh0.5 Mg,hP2,194 P63 /mmc 0.2667,0.2667,0.4262,90,90,120 close-packed structure - 9.80 X 7488
Cr-Rh Cr3Rh rt Cr3Si,cP8,223 Pm-3n 0.46731,0.46731,0.46731,90,90,90 Frank-Kasper phase - 8.43 X 3823
Cr-Ru Cr0.4 Ru0.6 Mg,hP2,194 P63 /mmc 0.2665,0.2665,0.4265,90,90,120 close-packed structure - 10.31 X 719
Cr-Ru Cr0.67 Ru0.33 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.90635,0.90635,0.4743,90,90,90 Frank-Kasper phase - 8.72 X 12978
Cr-Ru Cr0.95 Ru0.05 W,cI2,229 Im-3m 0.2898,0.2898,0.2898,90,90,90 b.c.c. family - 7.43 X 14329
Cr-Ru Cr2.88 Ru1.12 ht Cr3Si,cP8,223 Pm-3n 0.46768,0.46768,0.46768,90,90,90 Frank-Kasper phase - 8.54 X 3823
Handbook of Inorganic Substances – Edition 2015 : Data 71

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cr-S CrS m ZnS,cF8,216 F-43m 0.5387,0.5387,0.5387,90,90,90 adamantane structure - 3.57 X 47391


Cr-S CrS rt CrS,mS8,15 C12/c1 0.3826,0.5913,0.6089,90,101.6,90 AlB2 family - 4.14 X 845
Cr-S Cr0.67 S ht NiAs,hP4,194 P63/mmc 0.3419,0.3419,0.5551,90,90,120 AlB2 family - 3.95 X 20287
Cr-S Cr1.78 S3 rt rhom Cr2S3,hR30,148 R-3 0.59384,0.59384,1.66683,90,90,120 - - 3.69 X 6090
Cr-S Cr2S3 rt trig Cr2S3,hP20,163 P-31c 0.5941,0.5941,1.1188,90,90,120 - - 3.89 X 845
Cr-S Cr3S4 rt Cr3S4,mS14,12 C12/m1 1.25792,0.34211,0.59538,90,116.712,90 brezinaite brown gray 4.12 X 31891
Cr-S Cr5S6 rt Cr5S6,hP22,163 P-31c 0.5962,0.5962,1.1506,90,90,120 murchisite - 4.24 X 3701
Cr-S Cr5S8 rt V5S8 ,mS26,12 C12/m1 1.1063,0.6786,0.8023,90,132.76,90 - - 3.88 A 4645
Cr-S Cr5.2 S8 rt Cr7Se8,mS30,12 C12/m1 1.10332,0.67933,0.79562,90,132.663,90 - black gray 3.99 X 40998
Cr-Sb CrSb2 hp CuAl2,tI12,140 I4/mcm 0.64913,0.64913,0.5744,90,90,90 - gray 8.11 X 35865
Cr-Sb CrSb2 FeAs2,oP6,58 Pnnm 0.60275,0.68738,0.32715,90,90,90 pyrite-marcasite family - 7.24 X 5053
Cr-Sb Cr0.1 Sb0.9 m Po,cP1,221 Pm-3m 0.3074,0.3074,0.3074,90,90,90 - - 6.56 X 6915
Cr-Sb Cr1.04 Sb0.96 NiAs,hP4,194 P63/mmc 0.412,0.412,0.5464,90,90,120 AlB2 family - 7.07 X 56407
Cr-Se CrSe 2 m CdI2 ,hP3,164 P-3m1 0.3399,0.3399,0.5915,90,90,120 CdI2-PbI2 polytype - 5.89 A 13611
Cr-Se Cr0.67 Se ht2 NiAs,hP4,194 P63/mmc 0.36083,0.36083,0.57757,90,90,120 AlB2 family - 5.80 X 29207
Cr-Se Cr0.68 Se ht1 Cr0.88 S,hP4,164 P-3m1 0.3612,0.3612,0.5775,90,90,120 - - 5.82 X 5237
Cr-Se Cr2Se3 ht Cr+ Cr2S3,hP20,163 P-31c 0.62577,0.62577,1.1602,90,90,120 - - 5.75 A 20222
Cr-Se Cr2Se3 rt Cr2S3,hR30,148 R-3 0.625,0.625,1.728,90,90,120 - - 5.81 X 29204
Cr-Se Cr2.80 Se4 rt Cr3S4,mS14,12 C12/m1 1.3132,0.3598,0.6270,90,117.34,90 - - 5.82 X 13481
Cr-Se Cr5Se8 V5S8 ,mS26,12 C12/m1 1.1462,0.7148,0.8348,90,132.29,90 - - 5.85 A 4645
Cr-Se Cr5.095 Se8 rt Cr7Se8,mS30,12 C12/m1 1.14486,0.71275,0.83334,90,132.452,90 - - 5.93 X 42519
Cr-Si CrSi FeSi,cP8,198 P213 0.462,0.462,0.462,90,90,90 - - 5.39 X 70
Cr-Si CrSi2 CrSi2,hP9,180 P6222 0.44283,0.44283,0.6368,90,90,120 - - 4.98 X 39304
Cr-Si Cr0.001 Si0.999 C,cF8,227 Fd-3m 0.54324,0.54324,0.54324,90,90,90 - - 2.33 X 48613
Cr-Si Cr0.93 Si0.07 W,cI2,229 Im-3m 0.28826,0.28826,0.28826,90,90,90 b.c.c. family - 6.98 X 1449
Cr-Si Cr3Si Cr3Si,cP8,223 Pm-3n 0.45599,0.45599,0.45599,90,90,90 Frank-Kasper phase - 6.45 X 14972
Cr-Si Cr5Si3 rt W5Si3,tI32,140 I4/mcm 0.917,0.917,0.4636,90,90,90 - - 5.87 X 785
Cr-Sn CrSn2 Mg2 Cu,oF48,70 Fddd 0.5417,0.944,1.8396,90,90,90 - - 8.17 X 28807
Cr-Ta TaCr2 ht MgZn2,hP12,194 P63/mmc 0.4933,0.4933,0.8085,90,90,120 Friauf-Laves phase - 11.11 A 22428
Cr-Ta TaCr2 rt MgCu2,cF24,227 Fd-3m 0.701,0.701,0.701,90,90,90 Friauf-Laves phase - 10.99 X 45378
Cr-Ta Ta0.04 Cr0.96 stab Mg,hP2,194 P63/mmc 0.2847,0.2847,0.4796,90,90,120 close-packed structure - 5.64 X 1297
Cr-Ta Ta0.05 Cr0.95 W,cI2,229 Im-3m 0.2911,0.2911,0.2911,90,90,90 b.c.c. family - 7.87 X 2652
Cr-Ta Ta0.85 Cr0.15 W,cI2,229 Im-3m 0.3291,0.3291,0.3291,90,90,90 b.c.c. family - 15.06 X 2768
Cr-Ta Ta1.05 Cr1.95 stab Ti2Ni,cF96,227 Fd-3m 1.145,1.145,1.145,90,90,90 - - 10.31 A 2652
Cr-Ta Ta1.2 Cr1.8 rt MgNi2,hP24,194 P63/mmc 0.4963,0.4963,1.626,90,90,120 Friauf-Laves phase - 11.90 A 7645
Cr-Tc Cr0.25 Tc0.75 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.929,0.929,0.4846,90,90,90 Frank-Kasper phase - 10.30 A 1682
Cr-Te CrTe hp FeAs,oP8,62 Pnma 0.5699,0.3476,0.6133,90,90,90 AlB2 family - 9.82 X 38771
Cr-Te CrTe 2 rt *,aP*,* - 0.497,0.95889,1.278,107.285,90.37,97.915 - - - N 39697
Cr-Te CrTe 3 CrTe 3,mP32,14 P121/c1 0.7887,1.122,1.156,90,118.41,90 - - 6.42 X 15044
Cr-Te Cr0.67 Te ht2 NiAs,hP4,194 P63/mmc 0.39335,0.39335,0.60353,90,90,120 AlB2 family - 6.67 X 29207
Cr-Te Cr0.83 Te ht Cr0.83 Te,mS16,12 C12/m1 1.3935,0.3954,0.6857,90,118.3,90 - - 6.82 X 5058
Cr-Te Cr0.92 Te ht NiAs,hP4,194 P63/mmc 0.401,0.401,0.62537,90,90,120 AlB2 family black 6.69 X 46679
Cr-Te Cr2Te 3 rt Cr2S3,hP20,163 P-31c 0.6814,0.6814,1.2073,90,90,120 - black 6.66 X 9382
Cr-Te Cr3Te 4 rt Cr3S4,mS14,12 C12/m1 1.39156,0.3932,0.6854,90,118.301,90 - - 6.70 A 31935
Cr-Te Cr5Te 8 mon Cr7Se8,mS30,12 C12/m1 1.20727,0.78587,0.90559,90,131.453,90 - black 6.61 X 33594
Cr-Te Cr5Te 8 trig Cr5Te8,hP26,165 P-3c1 0.7824,0.7824,1.202,90,90,120 - black 6.68 X 16160
Cr-Te Cr7Te 8 rt Cr7Se8,mS30,12 C12/m1 1.24,0.802,0.9138,90,131.92,90 - - 6.80 A 26270
Cr-Ti TiCr1.968 ht2 MgNi2,hP24,194 P63/mmc 0.49031,0.49031,1.5953,90,90,120 Friauf-Laves phase - 6.01 X 54587
Cr-Ti TiCr2 rt MgCu2,cF24,227 Fd-3m 0.6939,0.6939,0.6939,90,90,90 Friauf-Laves phase - 6.04 X 11512
Cr-Ti Ti0.14 Cr0.86 ht W,cI2,229 Im-3m 0.2932,0.2932,0.2932,90,90,90 b.c.c. family - 6.78 X 10133
Cr-Ti Ti0.95 Cr0.05 m (Ti0.95 Cr0.05),hP3,164 P-3m1 0.461,0.461,0.283,90,90,120 - - 4.60 X 684
Cr-Ti Ti1.07 Cr1.93 ht1 MgZn2,hP12,194 P63/mmc 0.49261,0.49261,0.79724,90,90,120 Friauf-Laves phase - 6.01 A 45372
Cr-U U0.9864 Cr0.0136 ht1 U,tP30,136 P42/mnm 1.052,1.052,0.557,90,90,90 Frank-Kasper phase - 19.03 A 419
Cr-V V0.5 Cr0.5 W,cI2,229 Im-3m 0.29572,0.29572,0.29572,90,90,90 b.c.c. family - 6.61 X 59645
Cr-W Cr0.5W0.5 W,cI2,229 Im-3m 0.3048,0.3048,0.3048,90,90,90 b.c.c. family - 13.83 X 16621
Cr-Zn Zn0.008 Cr0.992 W,cI2,229 Im-3m 0.288,0.288,0.288,90,90,90 b.c.c. family - 7.24 X 190
Cr-Zn Zn19 Cr *,hP*,* - 1.289,1.289,3.05,90,90,120 - - - N 190
Cr-Zr ZrCr2 ht1 MgNi2,hP24,194 P63/mmc 0.51,0.51,1.661,90,90,120 Friauf-Laves phase - 6.93 X 7646
Cr-Zr ZrCr2 ht2 MgZn2,hP12,194 P63/mmc 0.5113,0.5113,0.8309,90,90,120 Friauf-Laves phase gray 6.89 X 30193
Cr-Zr ZrCr2 rt MgCu2,cF24,227 Fd-3m 0.72067,0.72067,0.72067,90,90,90 Friauf-Laves phase - 6.93 X 56782
Cs-D CsD NaCl,cF8,225 Fm-3m 0.63741,0.63741,0.63741,90,90,90 rocksalt family - 3.46 X 24394
Cs-F CsF hp CsCl,cP2,221 Pm-3m 0.339,0.339,0.339,90,90,90 b.c.c. family - 6.47 X 2267
Cs-F CsF NaCl,cF8,225 Fm-3m 0.6259,0.6259,0.6259,90,90,90 rocksalt family yellow 4.12 X 17591
Cs-Ga CsGa3 RbGa3,tI24,119 I-4m2 0.6393,0.6393,1.5289,90,90,90 - - 5.45 X 18073
Cs-Ga CsGa7 RbGa7,hR48,166 R-3m 0.662,0.662,2.9045,90,90,120 - - 5.61 X 18073
Cs-Ga Cs8Ga11 K8In11,hR114,167 R-3c 0.99962,0.99962,5.0839,90,90,120 - - 4.14 X 33062
Cs-Ge CsGe hp NaPb,tI64,142 I41/acd 1.138,1.138,1.85,90,90,90 - - 4.56 A 16888
Cs-Ge CsGe KGe,cP64,218 P-43n 1.3654,1.3654,1.3654,90,90,90 - blue 4.29 X 45823
Cs-Ge CsGe 4 *,cP*,* - 0.658,0.658,0.658,90,90,90 - - - N 22843
Cs-Ge Cs12 Ge17 *,hP*,* - 1.4585,1.4585,2.372,90,90,120 - gray dark - N 41732
Cs-Ge Cs4Ge22.2 Cs4Sn22,cP78,223 Pm-3n 1.08238,1.08238,1.08238,90,90,90 - gray steel 5.61 X 57394
Cs-Ge Cs4Ge9 Cs4Ge9,tP208,76 P41 1.55074,1.55074,3.13997,90,90,90 - red ruby 4.17 X 32846
Cs-H CsH hp1 CsCl,cP2,221 Pm-3m 0.382,0.382,0.382,90,90,90 b.c.c. family - 3.99 X 18748
Cs-H CsH hp2 TlI,oS8,63 Cmcm 0.3368,0.9514,0.3908,90,90,90 CrB(TlI)-FeB colorless 7.10 A 30933
Cs-H CsH rt NaCl,cF8,225 Fm-3m 0.6365,0.6365,0.6365,90,90,90 rocksalt family - 3.45 X 18748
Cs-Hg CsHg KHg,aP8,2 P-1 0.7154,0.747,0.7635,107.82,103.34,90.95 b.c.c. family bronze 5.89 X 23011
Cs-Hg CsHg2 rt KHg2,oI12,74 Imma 0.5488,0.8727,0.9082,90,90,90 AlB2 family black 8.16 X 21921
Cs-Hg Cs2Hg27 lt Cs2Hg27,cI174,204 Im-3 1.6557,1.6557,1.6557,90,90,90 - - 12.47 X 51577
72 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cs-Hg Cs3Hg20 Rb3Hg20,cP46,223 Pm-3n 1.0913,1.0913,1.0913,90,90,90 - - 11.27 X 37568


Cs-Hg Cs5Hg19 Rb5Hg19,tI48,87 I4/m 1.1803,1.1803,1.0814,90,90,90 - - 9.87 X 37568
Cs-I CsI hp1 CuAu,tP2,123 P4/mmm 0.3499,0.3499,0.4084,90,90,90 close-packed structure - 8.63 X 17382
Cs-I CsI hp2 *,o**,* - 0.3374,0.3542,0.405,90,90,90 - - - N 17382
Cs-I CsI lt *,tP*,* - 0.7746,0.7746,0.412,90,90,90 - - - N 5694
Cs-I CsI rt CsCl,cP2,221 Pm-3m 0.4503,0.4503,0.4503,90,90,90 b.c.c. family - 4.73 X 17381
Cs-I CsI tf NaCl,cF8,225 Fm-3m 0.7631,0.7631,0.7631,90,90,90 rocksalt family - 3.88 X 1502
Cs-I CsI4 CsI4,mP20,14 P121/c1 1.023,0.90,1.119,90,114.33,90 - purple 4.53 X 564
Cs-I Cs[I3] Cs[I3],oP16,62 Pnma 1.0997,0.6751,0.9963,90,90,90 - - 4.61 X 6385
Cs-In CsIn3 RbGa3,tI24,119 I-4m2 0.7047,0.7047,1.6803,90,90,90 - - 5.70 X 17148
Cs-In Cs2In3 Cs2In3,tI20,119 I-4m2 0.6910,0.6910,1.6612,90,90,90 - - 5.11 X 18078
Cs-K CsK2 lt MgZn2,hP12,194 P63 /mmc 0.9065,0.9065,1.4755,90,90,120 Friauf-Laves phase - 1.34 X 10219
Cs-K Cs0.5 K0.5 W,cI2,229 Im-3m 0.571,0.571,0.571,90,90,90 b.c.c. family - 1.53 X 174
Cs-K Cs6K7 lt Cs6K7,hP26,194 P63 /mmc 0.9078,0.9078,3.295,90,90,120 Frank-Kasper phase - 1.51 X 10219
Cs-N Cs[N3] hp1 Cs[N3],mS16,12 C12/m1 0.6072,0.5906,0.8322,90,98.78,90 - - 3.94 X 57184
Cs-N Cs[N3] hp2 *,mP*,* P121/m1 0.8083,0.5716,0.9141,90,110.54,90 - - 5.88 N 57184
Cs-N Cs[N3] ht Cs[N3],cP8,221 Pm-3m 0.4537,0.4537,0.4537,90,90,90 - - 3.11 X 2876
Cs-N Cs[N3] rt K[N3],tI16,140 I4/mcm 0.65412,0.65412,0.80908,90,90,90 - - 3.36 X 7055
Cs-Na CsNa2 lt MgZn2,hP12,194 P63 /mmc 0.7861,0.7861,1.3062,90,90,120 Friauf-Laves phase - 1.70 X 8682
Cs-O Cs[O2] ht NaCl,cF8,225 Fm-3m 0.6553,0.6553,0.6553,90,90,90 rocksalt family yellow 3.89 X 53214
Cs-O Cs[O2] rt CaC2,tI6,139 I4/mmm 0.4477,0.4477,0.735,90,90,90 - - 3.72 X 9820
Cs-O Cs[O3] lt Rb[O3],mP16,14 P121/c1 0.6709,0.6244,0.8997,90,120.85,90 - - 3.71 X 25586
Cs-O Cs11O3 rt Cs11O3,mP56,14 P121/c1 1.7610,0.9218,2.4047,90,100.14,90 - purple 2.61 X 11030
Cs-O Cs2O CdCl2,hR9,166 R-3m 0.4256,0.4256,1.899,90,90,120 - orange 4.71 X 783
Cs-O Cs2[O2] Rb2[O2],oI8,71 Immm 0.4322,0.643,0.7517,90,90,90 - - 4.73 X 918
Cs-O Cs2[O2]1.5 Pu2C3,cI40,220 I-43d 0.98458,0.98458,0.98458,90,90,90 - black 4.37 X 53214
Cs-O Cs3O Cs3O,hP8,193 P63 /mcm 0.878,0.878,0.752,90,90,120 - greenish 2.74 X 784
Cs-O Cs4O lt Cs4O,oP60,33 Pna21 1.6833,2.0569,1.2400,90,90,90 - - 2.54 X 10241
Cs-O Cs7O lt Cs7O,hP24,187 P-6m2 1.6244,1.6244,0.9145,90,90,120 - bronze 2.26 X 10234
Cs-P CsP7 CsP7,oP32,29 Pca21 0.9455,0.9149,0.9651,90,90,90 - - 2.78 X 14080
Cs-P Cs2P 3 Rb2P 3,oF40,69 Fmmm 0.9438,0.9972,1.4999,90,90,90 - blue violet 3.38 X 20846
Cs-P Cs3P 11 ht Cs3P 11,cF188,225 Fm-3m 1.2063,1.2063,1.2063,90,90,90 - red 2.80 X 18661
Cs-P Cs3P 7 rt Cs3P 7,tP40,76 P41 0.9046,0.9046,1.6714,90,90,90 - yellow 2.99 X 20832
Cs-P Cs3P 8.33 ht Cs3P 8.33 ,cF592,225 Fm-3m 1.1495,1.1495,1.1495,90,90,90 - orange 2.87 X 20832
Cs-Pb CsPb rt NaPb,tI64,142 I41/acd 1.2244,1.2244,2.0001,90,90,90 - gray silver 6.03 X 36762
Cs-Pb Cs4Pb9 Cs4Pb9,mP52,14 P121/c1 1.0042,1.4781,1.72111,90,114.88,90 - - 6.87 X 34349
Cs-Pt Cs0.5 Pt rt *,hR*,* - 0.26505,0.26505,1.8536,90,90,120 - black - N 47678
Cs-Pt Cs2Pt Co1.75 Ge,hP6,194 P63 /mmc 0.5676,0.5676,0.9471,90,90,120 AlB2 family red dark 5.79 X 41132
Cs-Rb Cs0.5 Rb0.5 W,cI2,229 Im-3m 0.584,0.584,0.584,90,90,90 b.c.c. family - 1.82 X 174
Cs-S CsS3 CsS3,aP16,2 P-1 0.467,0.918,1.153,84.87,84.80,89.22 - - 3.10 X 3875
Cs-S Cs2S hp PbCl2,oP12,62 Pnma 0.7,0.541,0.97,90,90,90 - - 5.39 X 56631
Cs-S Cs2S Cs2S,oP12,62 Pnma 0.8541,0.5365,1.0354,90,90,90 - colorless 4.17 X 56631
Cs-S Cs2S2 ht Rb2[O2],oI8,71 Immm 0.5232,0.6992,0.9615,90,90,90 - ochre 3.12 X 12431
Cs-S Cs2S3 K2S3,oS20,36 Cmc21 0.7712,1.0939,0.8111,90,90,90 - - 3.51 X 13765
Cs-S Cs2S5 Tl2S5,oP28,19 P212121 0.678,0.7148,1.848,90,90,90 - orange red 3.16 X 15234
Cs-Sb CsSb mon CsSb,mP32,14 P121/c1 1.5194,0.734,1.4322,90,113.661,90 - - 4.62 X 40959
Cs-Sb CsSb orth NaP,oP16,19 P212121 0.7345,0.7575,1.3273,90,90,90 - black 4.58 X 12874
Cs-Sb Cs1.5 Sb0.5 NaTl,cF16,227 Fd-3m 0.914,0.914,0.914,90,90,90 b.c.c. family black 4.53 X 793
Cs-Sb Cs2Sb Cs2Sb,oP24,62 Pnma 1.5985,0.6319,1.0995,90,90,90 - - 4.64 X 38175
Cs-Sb Cs3Sb7 rt Cs3Sb7,mP160,14 P121/c1 1.6057,1.5711,2.7939,90,96.3,90 - - 4.74 X 38175
Cs-Sb Cs5Sb8 Cs5Sb8,mP52,14 P121/c1 0.7244,1.1352,2.7509,90,96.663,90 - - 4.84 X 40959
Cs-Se CsSe4 CsSe4,oP80,57 Pbcm 1.006,1.3865,1.8964,90,90,90 - red dark 4.51 X 23081
Cs-Se Cs2Se hp Cs2Se,oF24,43 Fdd2 1.175,1.649,0.6775,90,90,90 Friauf-Laves phase colorless 3.49 X 13359
Cs-Se Cs2Se Cs2S,oP12,62 Pnma 0.879,0.555,1.078,90,90,90 - yellow 4.35 A 11031
Cs-Se Cs2Se3 K2S3,oS20,36 Cmc21 0.8015,1.1406,0.8282,90,90,90 - - 4.41 X 13765
Cs-Se Cs2Se5 Tl2S5,oP28,19 P212121 0.7105,0.742,1.8879,90,90,90 - black gray 4.41 X 18743
Cs-Se Cs3Se22 Cs3Se22,tI70,87 I4/m 0.8749,0.8749,1.9554,90,90,90 - black 4.74 X 47603
Cs-Si CsSi hp NaPb,tI64,142 I41/acd 1.123,1.123,1.834,90,90,90 - - 3.70 A 16888
Cs-Si CsSi KGe,cP64,218 P-43n 1.351,1.351,1.351,90,90,90 - red 3.47 X 45829
Cs-Si Cs0.875 Si17 Na1.5 Si17,cF160,227 Fd-3m 1.464,1.464,1.464,90,90,90 clathrate - 2.51 A 5445
Cs-Si Cs12Si17 *,h**,* - 2.8723,2.8723,7.06,90,90,120 - gray dark - N 41732
Cs-Si Cs3.9 Si23 Na4Si23,cP54,223 Pm-3n 1.04176,1.04176,1.04176,90,90,90 clathrate - 3.42 X 51942
Cs-Sn CsSn ht KGe,cP64,218 P-43n 1.4447,1.4447,1.4447,90,90,90 - - 4.43 X 40863
Cs-Sn CsSn rt NaPb,tI64,142 I41/acd 1.2122,1.2122,1.982,90,90,90 - gray silver 4.59 X 36763
Cs-Sn Cs12Sn17 Rb12Sn17,oP136,19 P212121 1.552,1.593,2.217,90,90,90 - gray dark 4.38 A 41732
Cs-Sn Cs2Sn11 rt Cs2Sn11,cI528,230 Ia-3d 2.4256,2.4256,2.4256,90,90,90 clathrate - 5.85 X 48296
Cs-Sn Cs26Sn41 Cs26Sn41,mP560,14 P121/c1 2.712,1.555,5.8782,90,99.157,90 - - 4.52 X 42358
Cs-Sn Cs4Sn22 Na4Si23,cP54,223 Pm-3n 1.2105,1.2105,1.2105,90,90,90 clathrate blackish 5.88 X 38301
Cs-Te CsTe ht CsTe,oP8,55 Pbam 0.61278,1.1629,0.49602,90,90,90 - black violet4.90 X 32602
Cs-Te CsTe4 rt CsTe4,mP20,14 P121/c1 0.7857,0.7286,1.4155,90,93.83,90 - gray 5.29 X 18609
Cs-Te CsTe7 *,tP128,130 P4/ncc 1.8885,1.8885,1.3517,90,90,90 - - 5.66 N 31488
Cs-Te Cs2Te rt Cs2S,oP12,62 Pnma 0.9109,0.5871,1.1494,90,90,90 - yellow 4.25 X 25616
Cs-Te Cs2Te13 *,oP60,57 Pbcm 0.7341,1.3953,2.2652,90,90,90 - - 5.51 N 31488
Cs-Te Cs2Te3 K2S3,oS20,36 Cmc21 0.8666,1.2065,0.868,90,90,90 - black 4.75 X 13316
Cs-Te Cs2Te5 Cs2Te5,oS28,63 Cmcm 0.9373,1.2288,1.014,90,90,90 - gray 5.14 X 15677
Cs-Te Cs3Te22 Cs3Te22,tI50,87 I4/m 0.9586,0.9586,2.0537,90,90,90 - gray 5.64 X 29873
Cs-Te Cs4.75 Te2.88 rt K4.75 Se2.85 ,mS32,12 C12/m1 2.14862,0.6655,1.50699,90,135.541,90 - - 4.40 X 25616
Cs-Tl CsTl CsTl,oF96,70 Fddd 0.924,1.5136,3.214,90,90,90 - gray dark 5.98 X 31616
Handbook of Inorganic Substances – Edition 2015 : Data 73

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cs-Tl Cs15 Tl27 Rb15 Tl27,hP42,189 P-62m 1.0503,1.0503,1.8142,90,90,120 - - 7.20 X 31609


Cs-Zn Cs0.34 Zn4 Cs0.34 Zn4,oI20,74 Imma 0.2642,0.7208,1.76,90,90,90 - - 6.08 X 46673
Cu-Dy CuDy CsCl,cP2,221 Pm-3m 0.3462,0.3462,0.3462,90,90,90 b.c.c. family - 9.05 X 8492
Cu-Dy Cu0.991 Dy0.009 Cu,cF4,225 Fm-3m 0.36158,0.36158,0.36158,90,90,90 close-packed structure - 9.05 X 26084
Cu-Dy Cu2Dy KHg2,oI12,74 Imma 0.4299,0.6794,0.729,90,90,90 AlB2 family - 9.03 A 58484
Cu-Dy Cu23 Dy6 hp Th6Mn23,cF116,225 Fm-3m 1.214,1.214,1.214,90,90,90 - - 9.05 A 17156
Cu-Dy Cu5Dy rt Be5Au,cF24,216 F-43m 0.7027,0.7027,0.7027,90,90,90 Friauf-Laves phase - 9.19 X 4722
Cu-Dy Cu5.44 Dy0.78 ht Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4932,0.4932,0.4156,90,90,120 CaCu5-Zr4Al3 - 8.96 A 15616
Cu-Dy Cu9Dy2 *,t**,* - 0.5002,0.5002,1.399,90,90,90 - - - N 27403
Cu-Er CuEr CsCl,cP2,221 Pm-3m 0.34,0.34,0.34,90,90,90 b.c.c. family gray silver 9.75 X 22845
Cu-Er Cu0.991 Er0.009 Cu,cF4,225 Fm-3m 0.36156,0.36156,0.36156,90,90,90 close-packed structure - 9.06 X 26084
Cu-Er Cu2Er KHg2,oI12,74 Imma 0.42809,0.67502,0.72659,90,90,90 AlB2 family - 9.31 A 54198
Cu-Er Cu5Er Be5Au,cF24,216 F-43m 0.7003,0.7003,0.7003,90,90,90 Friauf-Laves phase - 9.38 X 4722
Cu-Eu CuEu rt FeB-b,oP8,62 Pnma 0.7976,0.4407,0.6054,90,90,90 CrB(TlI)-FeB - 6.73 A 18046
Cu-Eu CuEu stab CsCl,cP2,221 Pm-3m 0.3479,0.3479,0.3479,90,90,90 b.c.c. family - 8.50 X 2945
Cu-Eu CuEu2 Ca2Cu,oP12,62 Pnma 0.64,0.421,1.508,90,90,90 - - 6.01 A 18046
Cu-Eu Cu0.996 Eu0.004 Cu,cF4,225 Fm-3m 0.36153,0.36153,0.36153,90,90,90 close-packed structure - 8.98 X 26084
Cu-Eu Cu2Eu KHg2,oI12,74 Imma 0.4434,0.7234,0.7539,90,90,90 AlB2 family - 7.67 A 18046
Cu-Eu Cu5Eu CaCu5,hP6,191 P6/mmm 0.511,0.511,0.414,90,90,120 - - 8.33 X 50107
Cu-F CuF ZnS,cF8,216 F-43m 0.4255,0.4255,0.4255,90,90,90 adamantane structure - 7.12 X 63
Cu-F CuF2 rt CuF2,mP6,14 P121/c1 0.32973,0.45624,0.53499,90,121.035,90 - blue 4.89 X 25266
Cu-F CuF2 stab CaF2 ,cF12,225 Fm-3m 0.5406,0.5406,0.5406,90,90,90 fluorite family - 4.27 X 63
Cu-Fe Cu0.003 Fe0.997 rt W,cI2,229 Im-3m 0.28679,0.28679,0.28679,90,90,90 b.c.c. family - 7.87 X 3264
Cu-Fe Cu0.3 Fe0.7 m Cu,cF4,225 Fm-3m 0.3614,0.3614,0.3614,90,90,90 close-packed structure - 8.18 X 30465
Cu-Fe Cu0.3 Fe0.7 m W,cI2,229 Im-3m 0.2879,0.2879,0.2879,90,90,90 b.c.c. family - 8.09 X 30465
Cu-Fe Cu0.77 Fe0.23 ht Cu,cF4,225 Fm-3m 0.363,0.363,0.363,90,90,90 close-packed structure - 8.58 X 52607
Cu-Ga CuGa2 Fe0.92 Si2,tP3,123 P4/mmm 0.283,0.283,0.5839,90,90,90 - blue yellow7.21 X 7069
Cu-Ga Cu0.785 Ga0.215 ht Mg,hP2,194 P63/mmc 0.25993,0.25993,0.42406,90,90,120 close-packed structure - 8.68 X 48622
Cu-Ga Cu0.85 Ga0.15 Cu,cF4,225 Fm-3m 0.3659,0.3659,0.3659,90,90,90 close-packed structure - 8.74 X 55406
Cu-Ga Cu29 Ga19.33 Cu30.5(Cu0.27 Al0.73 )3Al16,hR153,160 R3m 1.2258,1.2258,1.50444,90,90,120 - - 8.12 X 55202
Cu-Ga Cu7.15 Ga5.85 rt *,cP52,* - 0.86949,0.86949,0.86949,90,90,90 - - - N 4845
Cu-Ga Cu8.2 Ga4.8 *,cP52,* - 0.87373,0.87373,0.87373,90,90,90 - - - N 4845
Cu-Ga Cu8.62 Ga4.38 ht Cu9Al4,cP52,215 P-43m 0.87462,0.87462,0.87462,90,90,90 γ-brass - 8.47 A 48622
Cu-Ga Cu9Ga4 rt Cu9Al4,cP52,215 P-43m 0.8747,0.8747,0.8747,90,90,90 γ-brass - 8.44 X 7990
Cu-Gd CuGd hp AuCd,oP4,51 Pmma 0.4481,0.3042,0.4814,90,90,90 close-packed structure - 11.17 A 33099
Cu-Gd CuGd rt cub CsCl,cP2,221 Pm-3m 0.3518,0.3518,0.3518,90,90,90 b.c.c. family - 8.42 X 57144
Cu-Gd CuGd rt orth FeB-b,oP8,62 Pnma 0.711,0.4536,0.5509,90,90,90 CrB(TlI)-FeB - 8.25 A 52733
Cu-Gd Cu0.988 Gd0.012 Cu,cF4,225 Fm-3m 0.36165,0.36165,0.36165,90,90,90 close-packed structure - 9.08 X 26084
Cu-Gd Cu2Gd KHg2,oI12,74 Imma 0.4326,0.6882,0.7322,90,90,90 AlB2 family - 8.66 A 59414
Cu-Gd Cu5Gd ht CaCu5,hP6,191 P6/mmm 0.501,0.501,0.412,90,90,120 - - 8.81 X 22705
Cu-Gd Cu5Gd rt Be5Au,cF24,216 F-43m 0.706,0.706,0.706,90,90,90 Friauf-Laves phase - 8.97 A 51975
Cu-Gd Cu5.4 Gd0.8 ht Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4974,0.4974,0.4145,90,90,120 CaCu5-Zr4Al3 - 8.77 A 16156
Cu-Gd Cu6Gd Cu6Ce,oP28,62 Pnma 0.8023,0.5027,1.0075,90,90,90 - - 8.80 X 52618
Cu-Gd Cu9Gd2 lt *,t**,* - 0.5,0.5,1.39,90,90,90 - - - N 16156
Cu-Ge Cu0.85 Ge0.15 Mg,hP2,194 P63/mmc 0.25923,0.25923,0.42217,90,90,120 close-packed structure - 8.77 X 1851
Cu-Ge Cu0.9075 Ge0.0925 Cu,cF4,225 Fm-3m 0.3664,0.3664,0.3664,90,90,90 close-packed structure - 8.69 X 11129
Cu-Ge Cu2.5 Ge ht BiF3 ,cF16,225 Fm-3m 0.5906,0.5906,0.5906,90,90,90 b.c.c. family - 7.46 X 6346
Cu-Ge Cu3Ge ht Na3As,hP8,194 P63/mmc 0.417,0.417,0.738,90,90,120 - - 7.87 A 471
Cu-Ge Cu3Ge rt Cu3Ti,oP8,59 Pmmn 0.4576,0.5272,0.42,90,90,90 - - 8.63 X 34520
Cu-H CuH ZnO,hP4,186 P63mc 0.289,0.289,0.461,90,90,120 adamantane structure - 6.43 A 654
Cu-Hf CuHf2 CuZr2,tI6,139 I4/mmm 0.31695,0.31695,1.11333,90,90,90 close-packed structure - 12.49 X 1765
Cu-Hf Cu10 Hf7 Zr7Ni10,oS68,64 Cmce 1.25872,0.92376,0.92354,90,90,90 - - 11.66 A 9093
Cu-Hf Cu51 Hf14 Ag51 Gd14,hP68,175 P6/m 1.118,1.118,0.8235,90,90,120 - - 10.69 X 8848
Cu-Hf Cu8Hf3 Cu8Hf3,oP44,62 Pnma 0.78113,0.81014,0.99470,90,90,90 - - 11.01 X 9586
Cu-Hg Cu14 Hg12 bel Cr4.5(Cr0.56 Al0.44 )9Al12,hR78,160 R3m 1.33463,1.33463,0.8082,90,90,120 belendorffite white silver13.17 X 4452
Cu-Ho CuHo CsCl,cP2,221 Pm-3m 0.3451,0.3451,0.3451,90,90,90 b.c.c. family gray silver 9.23 X 52421
Cu-Ho Cu2Ho KHg2,oI12,74 Imma 0.428,0.676,0.727,90,90,90 AlB2 family - 9.22 X 19195
Cu-Ho Cu5Ho ht CaCu5,hP6,191 P6/mmm 0.496,0.496,0.4016,90,90,120 - - 9.37 X 1529
Cu-Ho Cu5Ho rt Be5Au,cF24,216 F-43m 0.7016,0.7016,0.7016,90,90,90 Friauf-Laves phase - 9.28 X 4722
Cu-I CuI hp cub3 *,cF96,* - 1.1627,1.1627,1.1627,90,90,90 - - - N 5398
Cu-I CuI hp cub4 *,cF96,* - 1.1463,1.1463,1.1463,90,90,90 - - - N 5398
Cu-I CuI hp1 CuI,hR12,166 R-3m 0.40826,0.40826,2.0077,90,90,120 - - 6.55 X 29368
Cu-I CuI hp2 CuI,hR36,166 R-3m 0.4265,0.4265,4.196,90,90,120 - colorless 5.74 X 14851
Cu-I CuI hp3 CuCl,cP16,205 Pa-3 0.5631,0.5631,0.5631,90,90,90 - - 14.17 A 6222
Cu-I CuI hp5 ZnTe,oS8,63 Cmcm 0.53727,0.61154,0.46087,90,90,90 - - 8.35 X 30873
Cu-I CuI hp6 PbO,tP4,129 P4/nmm 0.40229,0.40229,0.56506,90,90,90 - - 6.92 X 29368
Cu-I CuI ht1 CuI,hR12,166 R-3m 0.4155,0.4155,2.04803,90,90,120 - - 6.20 X 27277
Cu-I CuI ht2 UO2 ,cF36,225 Fm-3m 0.6134,0.6134,0.6134,90,90,90 fluorite family - 5.48 X 30352
Cu-I CuI rt CuI,cF20,216 F-43m 0.60847,0.60847,0.60847,90,90,90 marshite - 5.62 X 30352
Cu-I CuI trig CuI,hP12,156 P3m1 0.425,0.425,2.086,90,90,120 - - 5.82 X 1520
Cu-In Cu0.8 In0.2 ht W,cI2,229 Im-3m 0.299,0.299,0.299,90,90,90 b.c.c. family - 9.17 X 26589
Cu-In Cu0.9 In0.1 Cu,cF4,225 Fm-3m 0.3708,0.3708,0.3708,90,90,90 close-packed structure - 8.95 X 9061
Cu-In Cu1.1 In0.9 ht CuAl,mS20,12 C12/m1 1.2814,0.43543,0.7353,90,125.51,90 - - 8.61 X 14775
Cu-In Cu10 In7 Cu10 In7,mS68,12 C12/m1 1.38453,1.18462,0.67388,90,91.063,90 - colorless 8.65 X 51532
Cu-In Cu2In ht Co1.75 Ge,hP6,194 P63/mmc 0.42943,0.42943,0.52328,90,90,120 AlB2 family - 9.61 X 26589
Cu-In Cu7In3 rt Cu7In3,aP40,2 P-1 0.6733,0.9134,1.0074,73.2,82.77,89.76 - gray 8.92 X 33182
Cu-In Cu7In4 ht1 *,oP*,* - 0.5262,0.7395,3.4194,90,90,90 - - - N 7067
Cu-In Cu7In4 ht2 *,oP*,* - 0.5218,0.7405,2.1375,90,90,90 - - - N 7067
74 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cu-In Cu9In4 ht Cu9Al4,cP52,215 P-43m 0.9097,0.9097,0.9097,90,90,90 γ-brass - 9.10 A 26589


Cu-Ir Cu0.95 Ir0.05 Cu,cF4,225 Fm-3m 0.3628,0.3628,0.3628,90,90,90 close-packed structure - 9.73 X 4914
Cu-La CuLa FeB-b,oP8,62 Pnma 0.7538,0.4619,0.5727,90,90,90 CrB(TlI)-FeB - 6.74 A 48541
Cu-La Cu13La ht NaZn13,cF112,226 Fm-3c 1.16,1.16,1.16,90,90,90 - - 8.21 A 14273
Cu-La Cu2La AlB2,hP3,191 P6/mmm 0.4342,0.4342,0.3817,90,90,120 AlB2 family - 7.09 X 18115
Cu-La Cu4La Cu4La,tI90,119 I-4m2 0.8904,0.8904,1.9210,90,90,90 - - 7.71 X 18115
Cu-La Cu5La CaCu5,hP6,191 P6/mmm 0.51827,0.51827,0.41155,90,90,120 - - 7.92 X 48689
Cu-La Cu6La ht Cu6Ce,oP28,62 Pnma 0.81954,0.51584,1.02524,90,90,90 - - 7.97 X 23710
Cu-La Cu6La rt Cu6La,mP28,14 P121/c1 0.51364,1.01763,0.81072,90,92.186,90 - - 8.16 X 23710
Cu-Lu Cu2Lu KHg2,oI12,74 Imma 0.4245,0.6627,0.722,90,90,90 AlB2 family - 9.88 A 1830
Cu-Lu Cu23Lu6 hp Th6Mn23,cF116,225 Fm-3m 1.2,1.2,1.2,90,90,90 - - 9.65 A 17156
Cu-Lu Cu5Lu Be5Au,cF24,216 F-43m 0.697,0.697,0.697,90,90,90 Friauf-Laves phase - 9.67 X 6031
Cu-Mg MgCu2 MgCu2,cF24,227 Fd-3m 0.7034,0.7034,0.7034,90,90,90 Friauf-Laves phase - 5.78 X 16806
Cu-Mg Mg0.03 Cu0.97 Cu,cF4,225 Fm-3m 0.36272,0.36272,0.36272,90,90,90 close-packed structure - 8.68 X 362
Cu-Mg Mg2Cu Mg2Cu,oF48,70 Fddd 0.5275,0.9044,1.8328,90,90,90 - - 3.41 X 27116
Cu-Mn Cu0.15 Mn0.85 ht Cu,cF4,225 Fm-3m 0.3743,0.3743,0.3743,90,90,90 close-packed structure - 7.12 X 1104
Cu-Mn Cu0.15 Mn0.85 rt In,tI2,139 I4/mmm 0.26707,0.26707,0.3635,90,90,90 close-packed structure - 7.20 X 1104
Cu-Mo Cu0.75 Mo0.25 m Cu,cF4,225 Fm-3m 0.337,0.337,0.337,90,90,90 close-packed structure - 12.43 X 33266
Cu-N CuN0.33 hp CoO,tI4,139 I4/mmm 0.2655,0.2655,0.3911,90,90,90 rocksalt family - 8.21 X 53442
Cu-N Cu[N3] orth Cu[N3],oP32,61 Pbca 0.6625,1.1021,0.7234,90,90,90 - blue 2.66 X 55316
Cu-N Cu[N3] tet Cu[N3],tI32,88 I41/a 0.8653,0.8653,0.5594,90,90,90 - colorless 3.35 X 283
Cu-N Cu[N3]2 Cu[N3]2,oP28,62 Pnma 1.3454,0.3079,0.9084,90,90,90 - black 2.61 X 3841
Cu-N Cu3N hp1 Cu3.24 N1.08 ,tP8,123 P4/mmm 0.3745,0.3745,0.378,90,90,90 - - 6.41 X 55342
Cu-N Cu3N ReO3,cP4,221 Pm-3m 0.3819,0.3819,0.3819,90,90,90 - green 6.10 X 23544
Cu-Nd CuNd rt FeB-b,oP8,62 Pnma 0.731,0.4564,0.5583,90,90,90 CrB(TlI)-FeB gray 7.41 X 43793
Cu-Nd Cu2Nd KHg2,oI12,74 Imma 0.43843,0.70326,0.74194,90,90,90 AlB2 family gray 7.88 X 24918
Cu-Nd Cu4Nd *,o**,* - 0.45,0.806,0.915,90,90,90 - gray - N 13418
Cu-Nd Cu5Nd rt CaCu5,hP6,191 P6/mmm 0.51,0.51,0.41,90,90,120 - gray 8.31 X 26178
Cu-Nd Cu6Nd lt Cu6La,mP28,14 P121/c1 0.50568,1.00933,0.804,90,91.163,90 - - 8.51 X 23710
Cu-Nd Cu6Nd rt Cu6Ce,oP28,62 Pnma 0.80777,0.50672,1.01268,90,90,90 - gray 8.42 X 23710
Cu-Ni Cu0.5 Ni0.5 rt Cu,cF4,225 Fm-3m 0.3572,0.3572,0.3572,90,90,90 close-packed structure - 8.91 X 28869
Cu-O CuO lt CuO,mS8,9 C1c1 0.46927,0.34283,0.51370,90,99.546,90 - black gray 6.48 X 24917
Cu-O CuO rt CuO,mS8,15 C12/c1 0.46837,0.34226,0.51288,90,99.54,90 tenorite black 6.52 X 5023
Cu-O Cu2O hp1 *,hP12,* - 0.29,0.29,1.931,90,90,120 - - 6.76 N 15477
Cu-O Cu2O hp2 CdCl2,hR9,166 R-3m 0.282,0.282,1.27,90,90,120 - - 8.15 A 15477
Cu-O Cu2O rt Cu2O,cP6,224 Pn-3m 0.42685,0.42685,0.42685,90,90,90 cuprite red 6.11 X 23106
Cu-O Cu4O3 Cu4O3,tI28,141 I41/amd 0.5837,0.5837,0.9932,90,90,90 paramelaconite - 5.93 X 11359
Cu-O Cu64O Cu64O,oS130,38 Amm2 1.058,0.974,1.62,90,90,90 - - 8.12 X 17860
Cu-O Cu8O Cu8O,oS18,38 Amm2 0.602,0.547,0.934,90,90,90 - - 5.66 X 16911
Cu-P CuP 10 CuP 10,aP44,2 P-1 0.7131,1.1437,1.175,68.53,83.6,84.39 - red dark 2.80 X 49789
Cu-P CuP 2 CuP 2,mP12,14 P121/c1 0.58004,0.48063,0.75263,90,112.70,90 - - 4.31 X 15666
Cu-P Cu0.985 P0.015 Cu,cF4,225 Fm-3m 0.36119,0.36119,0.36119,90,90,90 close-packed structure - 8.89 X 136
Cu-P Cu2P 7 Cu2P 7,mS72,12 C12/m1 1.2658,0.7256,1.4630,90,107.46,90 - black 3.56 X 15666
Cu-P Cu2.82P ht Cu3P,hP24,185 P63 cm 0.69593,0.69593,0.7143,90,90,120 - gray silver 6.99 X 6506
Cu-Pb Cu0.95Pb0.05 Cu,cF4,225 Fm-3m 0.3688,0.3688,0.3688,90,90,90 close-packed structure - 9.37 X 15240
Cu-Pd Cu0.5 Pd0.5 Cu,cF4,225 Fm-3m 0.375,0.375,0.375,90,90,90 close-packed structure - 10.70 X 54868
Cu-Pd Cu1.04Pd0.96 rt CsCl,cP2,221 Pm-3m 0.3096,0.3096,0.3096,90,90,90 skaergaardite - 9.41 X 56428
Cu-Pd Cu3Pd rt Pd+ Cu3Pd,oP320,58 Pnnm 2.942,3.711,0.3711,90,90,90 close-packed structure - 9.74 X 789
Cu-Pd Cu3Pd rt Cu3Pd,tP28,123 P4/mmm 0.371,0.371,2.5655,90,90,90 nielsenite - 9.78 X 5452
Cu-Pd Cu3.18Pd0.82 rt Cu3Au,cP4,221 Pm-3m 0.3676,0.3676,0.3676,90,90,90 close-packed structure - 9.67 X 10100
Cu-Pd Cu4Pd Cu4Pd,tP20,84 P42 /m 0.5826,0.5826,0.7328,90,90,90 - - 9.63 X 638
Cu-Pr CuPr FeB-b,oP8,62 Pnma 0.7242,0.4336,0.6307,90,90,90 CrB(TlI)-FeB - 6.86 A 38821
Cu-Pr Cu2Pr rt KHg2,oI12,74 Imma 0.44071,0.7054,0.744,90,90,90 AlB2 family - 7.70 A 41694
Cu-Pr Cu4Pr *,o**,* - 0.454,0.808,0.922,90,90,90 - - - N 12657
Cu-Pr Cu5Pr CaCu5,hP6,191 P6/mmm 0.5128,0.5128,0.4106,90,90,120 - - 8.14 X 5646
Cu-Pr Cu6Pr lt Cu6La,mP28,14 P121/c1 0.5094,1.0154,0.8088,90,91.33,90 - - 8.29 X 20464
Cu-Pr Cu6Pr rt Cu6Ce,oP28,62 Pnma 0.80921,0.50845,1.01458,90,90,90 - - 8.31 X 23710
Cu-Pt CuPt rt CuPt,hR6,166 R-3m 0.27,0.27,1.2918,90,90,120 close-packed structure - 15.80 X 49696
Cu-Pt CuPt3 rt Cu3Au,cP4,221 Pm-3m 0.3849,0.3849,0.3849,90,90,90 close-packed structure - 18.89 X 52451
Cu-Pt CuPt7 rt CuPt7,cF32,225 Fm-3m 0.7757,0.7757,0.7757,90,90,90 kitagohaite - 20.34 X 246
Cu-Pt Cu0.70Pt0.30 ht Cu,cF4,225 Fm-3m 0.3705,0.3705,0.3705,90,90,90 close-packed structure - 13.45 X 56809
Cu-Pt Cu3Pt rt Cu3Au,cP4,221 Pm-3m 0.3641,0.3641,0.3641,90,90,90 close-packed structure - 13.27 X 56809
Cu-Pt Cu3Pt rt SrPb3,tP4,123 P4/mmm 0.3708,0.3708,0.3692,90,90,90 close-packed structure - 12.62 X 723
Cu-Pu Cu2Pu KHg2,oI12,74 Imma 0.4332,0.6686,0.7376,90,90,90 AlB2 family - 11.54 A 6710
Cu-Pu Cu4Pu *,oP20,* - 0.432,0.8264,0.9229,90,90,90 - - - N 6710
Cu-Pu Cu6Pu Cu6Ce,oP28,62 Pnma 0.805,0.5025,1.0059,90,90,90 - - 10.21 A 3725
Cu-Rh Cu0.5 Rh0.5 ht Cu,cF4,225 Fm-3m 0.373,0.373,0.373,90,90,90 close-packed structure - 10.65 X 2228
Cu-Ru CuRux Cu,cF4,225 Fm-3m 0.3613,0.3613,0.3613,90,90,90 close-packed structure - 8.95 X 20203
Cu-S CuS lt CuS,oS24,63 Cmcm 0.3760,0.6564,1.622,90,90,90 - - 4.76 X 21992
Cu-S CuS rt CuS-b,hP12,194 P63 /mmc 0.3757,0.3757,1.619,90,90,120 covellite - 4.81 X 18684
Cu-S CuS2 hp FeS2,cP12,205 Pa-3 0.57891,0.57891,0.57891,90,90,90 pyrite-marcasite family purple 4.37 X 12234
Cu-S CuS2 rt FeS2,oP6,58 Pnnm 0.4651,0.5793,0.3532,90,90,90 pyrite-marcasite family - 4.46 A 12051
Cu-S Cu1.8 S ht dig Cu2Se,cF44,225 Fm-3m 0.5564,0.5564,0.5564,90,90,90 digenite high black 5.65 X 25069
Cu-S Cu1.96 S m Cu1.96 S,tP12,92 P41212 0.39962,0.39962,1.1287,90,90,90 - - 5.77 X 2088
Cu-S Cu2S ht cha Cu2S,hP16,194 P63 /mmc 0.3967,0.3967,0.6795,90,90,120 chalcocite high gray steel 5.71 X 14651
Cu-S Cu2S ht Cu2S,mP144,14 P121/c1 1.5228,1.1884,1.3494,90,116.22,90 chalcocite low - 5.79 X 12842
Cu-S Cu29S16 Cu29S16,aP180,2 P-1 1.34051,1.3409,1.54852,90.022,90.021,90.02 roxbyite - 5.62 X 57819
Cu-S Cu31S16 rt dju Cu31S16,mP376,14 P121/c1 1.3465,1.5745,3.0052,90,116.49,90 djurleite black 5.78 X 12842
Handbook of Inorganic Substances – Edition 2015 : Data 75

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cu-S Cu7S4 rt ani Cu7S4,oP44,62 Pnma 0.789,0.784,1.101,90,90,90 anilite - 5.59 X 5034


Cu-S Cu9S5 dig Cu9S5,hR42,166 R-3m 0.39192,0.39192,4.80024,90,90,120 digenite low black 5.71 X 959
Cu-Sb Cu0.8 Sb0.2 ht Mg,hP2,194 P63/mmc 0.2688,0.2688,0.4328,90,90,120 close-packed structure - 9.22 X 2776
Cu-Sb Cu0.9995 Sb0.0005 Cu,cF4,225 Fm-3m 0.367,0.367,0.367,90,90,90 close-packed structure - 8.54 X 15734
Cu-Sb Cu10 Sb3 ht Cu10 Sb3,hP26,176 P63/m 0.992,0.992,0.43197,90,90,120 close-packed structure - 9.03 X 1030
Cu-Sb Cu11 Sb3 rt Cu11 Sb3,oS28,38 Amm2 0.4324,1.908,0.4724,90,90,90 close-packed structure - 9.07 X 15737
Cu-Sb Cu2Sb Cu2Sb,tP6,129 P4/nmm 0.40021,0.40021,0.61038,90,90,90 - violet 8.45 X 40832
Cu-Sb Cu3Sb ht1 Cu3Ti,oP8,59 Pmmn 0.4353,0.5504,0.4768,90,90,90 close-packed structure - 9.08 X 1030
Cu-Sb Cu3Sb ht2 BiF3 ,cF16,225 Fm-3m 0.5908,0.5908,0.5908,90,90,90 b.c.c. family - 10.06 X 15734
Cu-Sb Cu39.89 Sb9.11 Au12 (Au0.58 Cd0.42)36Cd,hP98,194 P63/mmc 1.9124,1.9124,0.4326,90,90,120 - - 8.83 X 6867
Cu-Sc CuSc CsCl,cP2,221 Pm-3m 0.324,0.324,0.324,90,90,90 b.c.c. family - 5.30 X 2178
Cu-Sc Cu2Sc MoSi2,tI6,139 I4/mmm 0.329,0.329,0.8388,90,90,90 b.c.c. family - 6.29 A 3340
Cu-Sc Cu4Sc *,tI*,* - 0.6536,0.6536,0.4031,90,90,90 - - - N 31756
Cu-Se CuSe ht orth *,oS*,* - 0.3949,0.6935,1.72,90,90,90 - - - N 4827
Cu-Se CuSe ht1 CuS,oS24,63 Cmcm 0.396,0.6947,1.7253,90,90,90 - - 5.98 A 30647
Cu-Se CuSe ht2 CuS-b,hP12,194 P63/mmc 0.3988,0.3988,1.7264,90,90,120 - gray 5.97 A 30647
Cu-Se CuSe tf *,hP2,* - 0.394,0.394,0.288,90,90,120 - - - N 6482
Cu-Se CuSe 0.75 tf CuSe0.75 ,hR12,166 R-3m 0.414,0.414,1.015,90,90,120 - - 8.12 X 12253
Cu-Se CuSe 2 hp FeS2 ,cP12,205 Pa-3 0.6116,0.6116,0.6116,90,90,90 pyrite-marcasite family blue 6.43 X 9774
Cu-Se CuSe 2 rt FeS2 ,oP6,58 Pnnm 0.5005,0.6182,0.374,90,90,90 krutaite gray 6.36 X 9774
Cu-Se Cu0.87 Se rt Cu0.87 Se,hP26,194 P63/mmc 0.3939,0.3939,1.725,90,90,120 klockmannite - 5.77 X 14508
Cu-Se Cu1.75 Se ht1 Cu2Se,cF44,225 Fm-3m 0.5755,0.5755,0.5755,90,90,90 berzelianite black 6.63 X 46677
Cu-Se Cu1.80 Se lt cub *,cP*,* - 1.1414,1.1414,1.1414,90,90,90 - - - N 4827
Cu-Se Cu1.80 Se lt tet *,tP*,* - 0.8071,0.8071,1.1414,90,90,90 - - - N 4827
Cu-Se Cu1.80 Se rt CaF2 ,cF12,225 Fm-3m 0.5751,0.5751,0.5751,90,90,90 fluorite family - 6.75 X 4827
Cu-Se Cu1.98 Se tricl *,aP*,* - 0.71,0.713,1.234,89.74,89.56,72.06 - - - N 42041
Cu-Se Cu2Se bel *,tP96,134 P42/nnm 1.152,1.152,1.174,90,90,90 bellidoite white - N 8996
Cu-Se Cu2Se orth *,oP*,* - 0.4118,0.7032,2.0381,90,90,90 - - - N 4827
Cu-Se Cu2Se rt hex *,hP*,* - 0.707,0.707,0.668,90,90,120 - - - N 10207
Cu-Se Cu2Se rt mon Cu2Se,mS144,15 C12/c1 0.71379,1.23823,2.73904,90,94.308,90 - - 6.80 X 55914
Cu-Se Cu3Se 2 rt Cu3Se2,tP10,113 P-421m 0.64024,0.64024,0.42786,90,90,90 umangite black blue 6.60 X 9774
Cu-Si Cu0.83 Si0.17 ht *,tP*,* - 0.8815,0.8815,0.7903,90,90,90 - - - N 4875
Cu-Si Cu0.83 Si0.17 rt Mn,cP20,213 P4132 0.6222,0.6222,0.6222,90,90,90 - - 7.93 X 48567
Cu-Si Cu0.875Si0.125 ht Mg,hP2,194 P63/mmc 0.256,0.256,0.4186,90,90,120 close-packed structure - 8.26 X 48567
Cu-Si Cu0.9 Si0.1 Cu,cF4,225 Fm-3m 0.3621,0.3621,0.3621,90,90,90 close-packed structure - 8.39 X 48567
Cu-Si Cu15 Si4 rt Cu15 Si4,cI76,220 I-43d 0.9718,0.9718,0.9718,90,90,90 - - 7.71 X 48567
Cu-Si Cu3Si ht *,hR*,166 R-3m 0.4047,0.4047,0.244,90,90,120 - - - N 48621
Cu-Si Cu3Si rt *,oS*,* - 0.7,2.194,7.676,90,90,90 - - - N 11137
Cu-Si Cu6.75 Si2.25 ht1 Cu(Cu0.96Si0.04 )6Si2,hR27,148 R-3 0.69998,0.69998,0.73152,90,90,120 - - 7.90 X 11137
Cu-Si Cu7Si2 Li7Pb2,hP9,164 P-3m1 0.4052,0.4052,0.7321,90,90,120 b.c.c. family - 7.99 X 48567
Cu-Sm CuSm cub CsCl,cP2,221 Pm-3m 0.353,0.353,0.353,90,90,90 b.c.c. family - 8.08 X 29415
Cu-Sm CuSm orth FeB-b,oP8,62 Pnma 0.7225,0.4166,0.6316,90,90,90 CrB(TlI)-FeB - 7.48 A 17051
Cu-Sm Cu0.991 Sm0.009 Cu,cF4,225 Fm-3m 0.36163,0.36163,0.36163,90,90,90 close-packed structure - 9.04 X 26084
Cu-Sm Cu2Sm KHg2,oI12,74 Imma 0.4362,0.6928,0.7378,90,90,90 AlB2 family - 8.27 A 28764
Cu-Sm Cu5Sm CaCu5,hP6,191 P6/mmm 0.507,0.507,0.4104,90,90,120 - - 8.51 X 22415
Cu-Sm Cu6Sm rt Cu6Ce,oP28,62 Pnma 0.806,0.5034,1.0049,90,90,90 - - 8.66 X 5317
Cu-Sm Cu9Sm2 *,t**,* - 0.712,0.712,0.715,90,90,90 - - - N 22415
Cu-Sn Cu0.35 Sn0.65 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3188,0.3188,0.2976,90,90,120 - - 6.30 X 2985
Cu-Sn Cu0.86 Sn0.14 ht W,cI2,229 Im-3m 0.30189,0.30189,0.30189,90,90,90 b.c.c. family - 8.60 X 731
Cu-Sn Cu0.9 Sn0.1 Cu,cF4,225 Fm-3m 0.3699,0.3699,0.3699,90,90,90 close-packed structure - 9.06 X 55402
Cu-Sn Cu1.2 Sn ht Co1.75 Ge,hP6,194 P63/mmc 0.42372,0.42372,0.51349,90,90,120 AlB2 family - 8.11 X 57572
Cu-Sn Cu10 Sn3 ht Cu10 Sn3,hP26,173 P63 0.733,0.733,0.7864,90,90,120 - - 9.00 X 8857
Cu-Sn Cu3Sn ht BiF3 ,cF16,225 Fm-3m 0.61166,0.61166,0.61166,90,90,90 b.c.c. family - 8.98 X 731
Cu-Sn Cu3Sn rt Cu3Sn,oS80,63 Cmcm 0.5529,4.775,0.4323,90,90,90 close-packed structure - 9.00 X 15944
Cu-Sn Cu40.4 Sn11 ht Cu41 Sn11,cF416,216 F-43m 1.7980,1.7980,1.7980,90,90,90 γ-brass - 8.85 X 10431
Cu-Sn Cu6Sn5 rt Cu6Sn5,mS44,15 C12/c1 1.1022,0.7282,0.9827,90,98.84,90 - gray 8.31 X 28521
Cu-Sn Cu6.75 Sn2.25 m (Ag0.56 Zn0.44 )8Zn,hP9,147 P-3 0.729,0.729,0.259,90,90,120 b.c.c. family - 9.70 X 904
Cu-Sr SrCu BaCu,hP8,194 P63/mmc 0.4325,0.4325,1.537,90,90,120 - - 4.03 A 50309
Cu-Sr SrCu5 CaCu5,hP6,191 P6/mmm 0.52635,0.52635,0.4047,90,90,120 - golden 6.93 X 29626
Cu-Tb CuTb lt1 CuTi,tP2,123 P4/mmm 0.3457,0.3457,0.3497,90,90,90 b.c.c. family - 8.84 X 8492
Cu-Tb CuTb rt CsCl,cP2,221 Pm-3m 0.3481,0.3481,0.3481,90,90,90 b.c.c. family gray silver 8.76 X 8492
Cu-Tb Cu0.993 Tb0.007 Cu,cF4,225 Fm-3m 0.36157,0.36157,0.36157,90,90,90 close-packed structure - 9.02 X 26084
Cu-Tb Cu2Tb KHg2,oI12,74 Imma 0.4318,0.6891,0.7326,90,90,90 AlB2 family - 8.72 A 27535
Cu-Tb Cu23 Tb6 hp Th6Mn23,cF116,225 Fm-3m 1.22,1.22,1.22,90,90,90 - - 8.83 A 17156
Cu-Tb Cu5Tb ht CaCu5,hP6,191 P6/mmm 0.50798,0.50798,0.41476,90,90,120 - - 8.54 X 30985
Cu-Tb Cu5Tb rt Be5Au,cF24,216 F-43m 0.7041,0.7041,0.7041,90,90,90 Friauf-Laves phase - 9.07 A 4722
Cu-Tb Cu5.44 Tb0.78 ht Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4942,0.4942,0.4164,90,90,120 CaCu5-Zr4Al3 - 8.86 X 5646
Cu-Te CuTe CuTe,oP4,59 Pmmn 0.31526,0.40914,0.69473,90,90,90 vulcanite bronze 7.08 X 58500
Cu-Te CuTe 2 hp FeS2 ,cP12,205 Pa-3 0.66052,0.66052,0.66052,90,90,90 pyrite-marcasite family gray silver 7.35 A 4031
Cu-Te CuTe 2 CdI2 ,hP3,164 P-3m1 0.395,0.395,0.549,90,90,120 CdI2-PbI2 polytype - 7.14 X 26361
Cu-Te Cu1.43 Te ht1 Cu1.43 Te,cF28,216 F-43m 0.6032,0.6032,0.6032,90,90,90 - purple red 6.61 X 6240
Cu-Te Cu1.43 Te ht2 *,h**,* - 2.023,2.023,4.191,90,90,120 - - - N 4827
Cu-Te Cu1.46 Te rt Cu1.43 Te,oP6,59 Pmmn 0.39727,0.4002,0.61066,90,90,90 - purple red 7.54 X 27123
Cu-Te Cu1.65 Te ht1 Cu2Sb,tP6,129 P4/nmm 0.398,0.398,0.655,90,90,90 rickardite purple red 7.44 X 4857
Cu-Te Cu1.75 Te rt Cu1.75 Te,hP18,187 P-6m2 0.417,0.417,2.165,90,90,120 - - 7.30 X 4849
Cu-Te Cu1.77 Te rt *,cI*,229 Im-3m 1.019,1.019,1.019,90,90,90 - - - N 4827
Cu-Te Cu1.79 Te ht Cu1.81 Te,hP72,156 P3m1 0.83124,0.83124,2.1546,90,90,120 weissite black 7.46 X 59710
Cu-Te Cu1.82 Te rt *,hP*,* - 0.8378,0.8378,1.0877,90,90,120 - - - N 16297
76 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Cu-Te Cu1.85 Te ht2 Cu1.43 Te,cF28,216 F-43m 0.6103,0.6103,0.6103,90,90,90 - - 7.16 A 24683


Cu-Te Cu1.9 Te ht2 *,hP*,* - 0.853,0.853,3.603,90,90,120 - - - N 16297
Cu-Te Cu1.9 Te rt *,o**,* - 0.4234,1.0186,1.0308,90,90,90 - - - N 16297
Cu-Te Cu1.94 Te ht1 *,oP*,* - 0.7308,1.6876,2.1702,90,90,90 - - - N 4827
Cu-Te Cu1.94 Te ht2 *,o**,* - 0.4227,0.729,0.7403,90,90,90 - - - N 4827
Cu-Te Cu1.94 Te ht3 Cu2Te,hP6,191 P6/mmm 0.4267,0.4267,0.7317,90,90,120 - - 7.22 A 4827
Cu-Te Cu1.94 Te rt *,o**,* - 0.4187,0.7189,0.7207,90,90,90 - - - N 4827
Cu-Te Cu2Te hex *,hP*,* - 0.418,0.418,0.7237,90,90,120 - - - N 826
Cu-Te Cu2Te ht1 Cu2Te,hP6,191 P6/mmm 0.4237,0.4237,0.7274,90,90,120 - blue gray 7.48 X 260
Cu-Te Cu2Te rt *,o**,* - 0.7319,2.2236,3.6458,90,90,90 - - - N 16297
Cu-Te Cu7Te4 rt Cu7Te4,hP22,156 P3m1 0.828,0.828,0.722,90,90,120 - - 7.40 X 3736
Cu-Te Cu7.2 Te4 ht mon Pd9Te4,mP52,14 P121/c1 0.7199,1.46,0.873,90,90.33,90 - - 7.01 A 16297
Cu-Th CuTh2 CuAl2,tI12,140 I4/mcm 0.7324,0.7324,0.5816,90,90,90 - black 11.23 X 6743
Cu-Th Cu0.9999 Th0.0001 Cu,cF4,225 Fm-3m 0.36151,0.36151,0.36151,90,90,90 close-packed structure - 8.94 X 6024
Cu-Th Cu2Th AlB2,hP3,191 P6/mmm 0.43789,0.43789,0.34877,90,90,120 AlB2 family gray 10.30 X 6754
Cu-Th Cu51Th14 Ag51Gd14,hP68,175 P6/m 1.18262,1.18262,0.88223,90,90,120 - gray 10.08 A 6754
Cu-Th Cu6Th ht Cu6Ce,oP28,62 Pnma 0.81103,0.50817,1.01046,90,90,90 - gray 9.78 X 6024
Cu-Ti CuTi tet1 CuTi,tP4,129 P4/nmm 0.3108,0.3108,0.5887,90,90,90 b.c.c. family - 6.51 X 389
Cu-Ti CuTi tet2 CuTi,tP2,123 P4/mmm 0.3140,0.3140,0.2856,90,90,90 b.c.c. family - 6.57 X 389
Cu-Ti CuTi2 rt CuZr2,tI6,139 I4/mmm 0.29438,0.29438,1.07861,90,90,90 close-packed structure - 5.66 X 2023
Cu-Ti CuTi2 stab Ti2Ni,cF96,227 Fd-3m 1.124,1.124,1.124,90,90,90 - - 5.96 A 456
Cu-Ti CuTi3 CuTi3,tP4,123 P4/mmm 0.4158,0.4158,0.3594,90,90,90 close-packed structure - 5.54 X 389
Cu-Ti Cu0.95 Ti0.05 Cu,cF4,225 Fm-3m 0.36375,0.36375,0.36375,90,90,90 close-packed structure - 8.66 X 15473
Cu-Ti Cu1.6 Ti5.4 rt Cu(Cu0.6Ti0.4 )Ti5,oP28,55 Pbam 1.19802,1.20357,0.29872,90,90,90 - - 5.56 X 41008
Cu-Ti Cu2Ti ht Au2 V,oS12,63 Cmcm 0.7988,0.4458,0.4397,90,90,90 close-packed structure - 7.42 A 5569
Cu-Ti Cu3Ti2 rt Cu3Ti2,tP10,129 P4/nmm 0.313,0.313,1.395,90,90,90 b.c.c. family - 6.96 X 2855
Cu-Ti Cu4Ti Au4Zr,oP20,62 Pnma 0.45,0.43,1.29,90,90,90 close-packed structure - 8.04 A 18427
Cu-Ti Cu4Ti3 Cu4Ti3,tI14,139 I4/mmm 0.313,0.313,1.994,90,90,90 b.c.c. family - 6.76 X 2855
Cu-Tl Cu0.997 Tl0.003 Cu,cF4,225 Fm-3m 0.36122,0.36122,0.36122,90,90,90 close-packed structure - 9.02 X 263
Cu-Tm CuTm rt CsCl,cP2,221 Pm-3m 0.3406,0.3406,0.3406,90,90,90 b.c.c. family gray silver 9.77 X 13403
Cu-Tm Cu2Tm KHg2,oI12,74 Imma 0.4267,0.6713,0.7248,90,90,90 AlB2 family - 9.47 A 27536
Cu-Tm Cu5Tm Be5Au,cF24,216 F-43m 0.6991,0.6991,0.6991,90,90,90 Friauf-Laves phase - 9.46 X 4722
Cu-U Cu5U Be5Au,cF24,216 F-43m 0.704,0.704,0.704,90,90,90 Friauf-Laves phase - 10.58 X 8501
Cu-W Cu0.84 W0.16 Cu,cF4,225 Fm-3m 0.335,0.335,0.335,90,90,90 close-packed structure - 14.63 X 33266
Cu-Y CuY CsCl,cP2,221 Pm-3m 0.34765,0.34765,0.34765,90,90,90 b.c.c. family - 6.03 X 58549
Cu-Y Cu0.971 Y0.029 Cu,cF4,225 Fm-3m 0.36158,0.36158,0.36158,90,90,90 close-packed structure - 9.03 X 33248
Cu-Y Cu2Y rt KHg2,oI12,74 Imma 0.4301,0.6851,0.7288,90,90,90 AlB2 family - 6.68 X 58549
Cu-Y Cu3Y0.75 Cu3Y0.75 ,mP16,10 P12/m1 0.5,0.4105,0.8765,90,91.09,90 - - 9.50 X 58549
Cu-Y Cu3Y2 m *,o**,* - 0.745,0.89,0.948,90,90,90 - - - N 34456
Cu-Y Cu5Y CaCu5,hP6,191 P6/mmm 0.5005,0.5005,0.4097,90,90,120 - - 7.60 X 5646
Cu-Y Cu5Y1.25 Cu5Y1.25 ,mP16,10 P12/m1 0.5,0.4105,0.8765,90,91.09,90 - - 7.92 X 53385
Cu-Y Cu5.34 Y0.83 Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.49771,0.49771,0.4128,90,90,120 CaCu5-Zr4Al3 - 7.75 X 37428
Cu-Y Cu51Y14 Ag51Gd14,hP68,175 P6/m 1.1569,1.1569,0.8674,90,90,120 - - 7.41 X 53385
Cu-Y Cu9Y m *,o**,* - 0.9623,1.6667,1.6667,90,90,90 - - - N 27071
Cu-Y Cu9Y2 tf *,tP*,130 P4/ncc 0.502,0.502,1.398,90,90,90 - - - N 34457
Cu-Yb CuYb FeB-b,oP8,62 Pnma 0.75653,0.42553,0.57667,90,90,90 CrB(TlI)-FeB gray 8.47 X 33928
Cu-Yb Cu0.99 Yb0.01 Cu,cF4,225 Fm-3m 0.36162,0.36162,0.36162,90,90,90 close-packed structure - 9.08 X 26084
Cu-Yb Cu2Yb hp MgZn2,hP12,194 P63 /mmc 0.526,0.526,0.8567,90,90,120 Friauf-Laves phase - 9.71 A 19090
Cu-Yb Cu2Yb KHg2,oI12,74 Imma 0.4291,0.6899,0.7386,90,90,90 AlB2 family - 9.12 X 6031
Cu-Yb Cu23Yb6 hp Th6Mn23,cF116,225 Fm-3m 1.203,1.203,1.203,90,90,90 - - 9.54 A 17156
Cu-Yb Cu4.5 Yb *,mS7448,5 C121 4.8961,4.8994,4.5643,90,91.24,90 - - - N 31844
Cu-Yb Cu5Yb hp Be5Au,cF24,216 F-43m 0.6973,0.6973,0.6973,90,90,90 Friauf-Laves phase - 9.61 A 34478
Cu-Yb Cu5Yb rt CaCu5,hP6,191 P6/mmm 0.4995,0.4995,0.4176,90,90,120 - - 9.03 X 35718
Cu-Yb Cu5.36 Yb0.82 Cu5.36 Yb0.82 ,hP14,191 P6/mmm 0.5004,0.5004,0.4118,90,90,120 CaCu5-Zr4Al3 - 8.97 X 6741
Cu-Zn CuZn rt CsCl,cP2,221 Pm-3m 0.29582,0.29582,0.29582,90,90,90 b.c.c. family - 8.27 X 4915
Cu-Zn Cu0.025 Zn0.975 Mg,hP2,194 P63 /mmc 0.26773,0.26773,0.48317,90,90,120 close-packed structure - 7.23 X 2146
Cu-Zn Cu0.2 Zn0.8 Mg,hP2,194 P63 /mmc 0.27383,0.27383,0.42939,90,90,120 close-packed structure - 7.74 X 1636
Cu-Zn Cu0.53 Zn0.47 ht W,cI2,229 Im-3m 0.2955,0.2955,0.2955,90,90,90 zhanghengite - 8.29 X 6865
Cu-Zn Cu0.7 Zn2 ht Cu0.7 Zn2,hP3,187 P-6m2 0.4275,0.4275,0.259,90,90,120 AlB2 family - 7.10 X 6346
Cu-Zn Cu0.85 Zn0.15 rt Cu,cF4,225 Fm-3m 0.3649,0.3649,0.3649,90,90,90 close-packed structure - 8.73 X 57353
Cu-Zn Cu5Zn8 Cu5Zn8,cI52,217 I-43m 0.8856,0.8856,0.8856,90,90,90 γ-brass - 8.04 X 45016
Cu-Zr CuZr ht CsCl,cP2,221 Pm-3m 0.3262,0.3262,0.3262,90,90,90 b.c.c. family - 7.40 X 13404
Cu-Zr CuZr2 ht CuZr2,tI6,139 I4/mmm 0.3218,0.3218,1.118,90,90,90 close-packed structure - 7.06 X 43695
Cu-Zr CuZr2 rt *,tP150,* - 1.592,1.592,1.132,90,90,90 - - - N 19770
Cu-Zr Cu0.5 Zr0.5 ht Zr+ Cu,cF4,225 Fm-3m 0.421,0.421,0.421,90,90,90 close-packed structure - 6.89 X 19770
Cu-Zr Cu10Zr7 Zr7Ni10,oS68,64 Cmce 1.2675,0.9313,0.9347,90,90,90 - - 7.67 A 14262
Cu-Zr Cu24Zr13 ht *,o*37,* - 0.646,0.7912,1.119,90,90,90 - - - N 19770
Cu-Zr Cu5Zr Be5Au,cF24,216 F-43m 0.687,0.687,0.687,90,90,90 Friauf-Laves phase - 8.38 X 13141
Cu-Zr Cu5Zr8 ht *,o*26,* - 0.5641,0.7806,1.121,90,90,90 - - - N 19770
Cu-Zr Cu51Zr14 Ag51Gd14,hP68,175 P6/m 1.12444,1.12444,0.82815,90,90,120 - - 8.27 A 9093
Cu-Zr Cu8Zr3 ht Cu8Hf3,oP44,62 Pnma 0.78693,0.81547,0.99848,90,90,90 - - 8.11 A 9093
D-Dy DyD0.2 rt Mg,hP2,194 P63 /mmc 0.3594,0.3594,0.5655,90,90,120 close-packed structure - 8.55 F 14275
D-Dy DyD2.01 BiF3,cF16,225 Fm-3m 0.5206,0.5206,0.5206,90,90,90 b.c.c. family - 7.84 X 58886
D-Dy DyD3 HoH3,hP24,165 P-3c1 0.63442,0.63442,0.65984,90,90,120 - - 7.30 X 36456
D-Er ErD1.93 CaF2,cF12,225 Fm-3m 0.5116,0.5116,0.5116,90,90,90 fluorite family blue dark 8.49 X 45456
D-Er ErD2.1 BiF3,cF16,225 Fm-3m 0.51166,0.51166,0.51166,90,90,90 b.c.c. family - 8.50 X 46121
D-Er ErD3 HoH3,hP24,165 P-3c1 0.62577,0.62577,0.65146,90,90,120 - - 7.82 X 51598
D-Eu EuD2 PbCl2,oP12,62 Pnma 0.6239,0.3796,0.7196,90,90,90 - violet 6.08 X 37328
Handbook of Inorganic Substances – Edition 2015 : Data 77

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

D-F DF lt HCl,oS8,36 Cmc21 0.331,0.522,0.426,90,90,90 - - 1.90 X 8775


D-Fe FeD FeH,hP14,194 P63/mmc 0.2668,0.2668,0.875,90,90,120 - - 7.13 X 34404
D-Fe FeD0.42 NiAs,hP4,194 P63/mmc 0.2583,0.2583,0.4176,90,90,120 AlB2 family - 7.80 X 34404
D-Ge GeD4 lt GeH4,oP20,19 P212121 0.45393,0.73556,0.81593,90,90,90 - - 1.97 X 50006
D-H [HD] *,tI*,79 I4 0.339,0.339,0.586,90,90,90 - - - N 1525
D-Hf HfD1.628 CaF2 ,cF12,225 Fm-3m 0.468,0.468,0.468,90,90,90 fluorite family - 11.78 X 747
D-Hf HfD1.98 ThH2,tI6,139 I4/mmm 0.34556,0.34556,0.4345,90,90,90 fluorite family - 11.68 X 747
D-Ho HoD0.2 Mg,hP2,194 P63/mmc 0.3581,0.3581,0.5633,90,90,120 close-packed structure - 8.78 F 14275
D-Ho HoD2 CaF2 ,cF12,225 Fm-3m 0.515,0.515,0.515,90,90,90 fluorite family - 8.22 X 1911
D-Ho HoD3 HoH3,hP24,165 P-3c1 0.62991,0.62991,0.65538,90,90,120 - - 7.56 X 51598
D-I DI lt1 HCl,cF52,225 Fm-3m 0.63062,0.63062,0.63062,90,90,90 close-packed structure - 3.41 X 27851
D-I DI lt2 HBr,oS12,64 Cmce 0.65517,0.60143,0.60835,90,90,90 - - 3.57 X 27851
D-I DI lt3 HI,aP16,2 P-1 0.84403,0.84562,0.87919,118.410,118.171,90.601 - - 3.69 X 27851
D-La LaD2 CaF2 ,cF12,225 Fm-3m 0.5648,0.5648,0.5648,90,90,90 fluorite family - 5.27 X 12914
D-La LaD2.50 rt CeH2.43 ,tI32,141 I41/amd 0.56194,0.56194,1.12732,90,90,90 - - 5.37 X 32005
D-La LaD3 lt4 CeH3,cF44,225 Fm-3m 0.5602,0.5602,0.5602,90,90,90 fluorite family - 5.48 X 11617
D-La La2D4.5 rt La2H4.5 ,tI28,139 I4/mmm 0.56175,0.56175,1.13055,90,90,90 - - 5.34 X 30875
D-Li LiD NaCl,cF8,225 Fm-3m 0.40615,0.40615,0.40615,90,90,90 rocksalt family colorless 0.89 X 18885
D-Lu LuD0.19 rt ScH0.33 ,hP6,194 P63/mmc 0.3523,0.3523,0.5607,90,90,120 - - 9.66 A 8345
D-Lu LuD2 CaF2 ,cF12,225 Fm-3m 0.5022,0.5022,0.5022,90,90,90 fluorite family - 9.39 X 10717
D-Mg MgD2 hp Fe2N0.94 ,oP12,60 Pbcn 0.45056,0.54212,0.49183,90,90,90 - - 1.57 X 35880
D-Mg MgD2 TiO2 ,tP6,136 P42/mnm 0.45029,0.45029,0.30126,90,90,90 - - 1.54 X 52461
D-Mn MnD0.65 NiAs,hP4,194 P63/mmc 0.268,0.268,0.435,90,90,120 AlB2 family - 6.90 X 11529
D-Mn Mn2 D CdI2 ,hP3,164 P-3m1 0.268,0.268,0.435,90,90,120 CdI2-PbI2 polytype - 6.87 X 18747
D-N [ND3] hp1 Mg,hP2,194 P63/mmc 0.3588,0.3588,0.587,90,90,120 close-packed structure - 1.02 X 17158
D-N [ND3] hp2 [NH3],oP16,19 P212121 0.31868,0.52559,0.55433,90,90,90 - - 1.43 X 53182
D-N [ND3] lt [NH3],cP16,198 P213 0.5035,0.5035,0.5035,90,90,90 - - 1.04 X 17158
D-Na NaD NaCl,cF8,225 Fm-3m 0.48714,0.48714,0.48714,90,90,90 rocksalt family - 1.44 X 50139
D-Nb NbD VH0.5 ,cI14,229 Im-3m 0.344,0.344,0.344,90,90,90 - - 7.74 X 44778
D-Nb NbD0.95 rt NbH0.95 ,oP8,48 Pnnn 0.3447,0.486,0.486,90,90,90 - - 7.74 X 4269
D-Nb NbD1.9 rt CaF2 ,cF12,225 Fm-3m 0.454,0.454,0.454,90,90,90 fluorite family - 6.87 X 26049
D-Nd NdD2 CaF2 ,cF12,225 Fm-3m 0.5453,0.5453,0.5453,90,90,90 fluorite family brown dark 6.07 X 12914
D-Nd NdD3 NdH3,hP26,165 P-3c1 0.66581,0.66581,0.68778,90,90,120 - brown dark 5.67 X 37435
D-Nd Nd2 D4.54 rt Nd2H4.54 ,tI28,141 I41/amd 0.54254,0.54254,1.08819,90,90,90 - - 6.17 X 38920
D-Ni NiD0.75 NaCl,cF8,225 Fm-3m 0.372,0.372,0.372,90,90,90 rocksalt family - 7.77 X 11529
D-O [D2O] IX [H2O],tP36,92 P41212 0.66748,0.66748,0.66838,90,90,90 ice-D IX - 1.34 X 52364
D-O [D2O] Ic [H2O],cF40,227 Fd-3m 0.6353,0.6353,0.6353,90,90,90 ice-D I cubic - 1.04 X 4118
D-O [D2O] XIII [H2O],mP84,14 P121/c1 1.0297,0.74724,0.92417,90,109.687,90 ice-D XIII - 1.39 X 47440
D-O [D2O] XIV [H2O],oP44,19 P212121 0.40825,0.81391,0.83499,90,90,90 ice-D XIV - 1.44 X 47440
D-O [D2O] XV hp [H2O],aP30,2 P-1 0.57903,0.62323,0.62438,90.08,90.06,90.01 - - 1.48 X 53256
D-O [D2O] hp II [H2O],hR108,148 R-3 1.28708,1.28708,0.61827,90,90,120 ice-D II - 1.35 X 52364
D-O [D2O] hp III [H2O],tP60,92 P41212 0.673,0.673,0.683,90,90,90 ice-D III - 1.29 X 7504
D-O [D2O] hp IV [H2O],hR240,167 R-3c 0.86238,0.86238,1.6934,90,90,120 ice-D IV - 1.46 X 42405
D-O [D2O] hp VI [H2O],tP50,137 P42/nmc 0.6186,0.6186,0.57157,90,90,90 ice-D VI - 1.52 X 52364
D-O [D2O] hp VII [H2O],cP10,224 Pn-3m 0.33501,0.33501,0.33501,90,90,90 ice-D VII - 1.77 X 18145
D-O [D2O] hp VIII [H2O],tI24,141 I41/amd 0.46744,0.46744,0.67972,90,90,90 ice-D VIII - 1.79 X 29335
D-O [D2O] hp XII [H2O],tI60,122 I-42d 0.8304,0.8304,0.4024,90,90,90 ice-D XII - 1.44 X 34991
D-O [D2O] lt (KOD) [H2O],oS24,36 Cmc21 0.45019,0.77978,0.73280,90,90,90 - - 1.03 X 18144
D-O [D2O] lt1 [H2O],hP20,194 P63/mmc 0.45222,0.45222,0.73638,90,90,120 ice-D I hexagonal - 1.02 X 51177
D-O [D2O2] lt [H2O2],tP16,92 P41212 0.4035,0.4035,0.797,90,90,90 - - 1.84 X 9111
D-Pd PdD0.038 rt NaCl,cF8,225 Fm-3m 0.39033,0.39033,0.39033,90,90,90 rocksalt family - 11.89 X 59730
D-Pd PdD0.65 rt PdH0.65 ,cP64,223 Pm-3n 0.8036,0.8036,0.8036,90,90,90 - - 11.03 X 30359
D-Pd PdD0.78 lt PdH0.78 ,tI20,87 I4/m 0.6391,0.6391,0.4052,90,90,90 - - 10.83 X 31841
D-Pr PrD1.95 CaF2 ,cF12,225 Fm-3m 0.5491,0.5491,0.5491,90,90,90 fluorite family - 5.81 X 18562
D-Pr Pr2D4.72 Nd2H4.72 ,tI28,109 I41md 0.5463,0.5463,1.0992,90,90,90 - - 5.90 A 16182
D-Pu PuD2.25 BiF3 ,cF16,225 Fm-3m 0.5344,0.5344,0.5344,90,90,90 b.c.c. family - 10.82 X 17545
D-Rb RbD NaCl,cF8,225 Fm-3m 0.60255,0.60255,0.60255,90,90,90 rocksalt family - 2.66 X 56433
D-S [D2S] lt2 [H2S],cP4,205 Pa-3 0.57647,0.57647,0.57647,90,90,90 - - 1.25 X 24273
D-S [D2S] lt3 [H2S],oP24,57 Pbcm 0.4076,1.33801,0.67215,90,90,90 - - 1.31 X 24273
D-Sc ScD0.33 ScH0.33 ,hP6,194 P63/mmc 0.3338,0.3338,0.5299,90,90,120 - - 2.96 X 16436
D-Sc ScD2 rt CaF2 ,cF12,225 Fm-3m 0.47774,0.47774,0.47774,90,90,90 fluorite family - 2.98 X 52940
D-Sc ScD2.87 hp ScH2.9 ,hP10,194 P63/mmc 0.3361,0.3361,0.6101,90,90,120 - - 2.82 X 47309
D-Se [D2Se] CaF2 ,cF12,225 Fm-3m 0.5973,0.5973,0.5973,90,90,90 fluorite family - 2.59 X 211
D-Si SiD4 lt1 *,tP*,* - 1.263,1.263,1.434,90,90,90 - - - N 10197
D-Sm SmD2 CaF2 ,cF12,225 Fm-3m 0.5362,0.5362,0.5362,90,90,90 fluorite family - 6.65 X 14428
D-Sm SmD3 HoH3,hP24,165 P-3c1 0.6539,0.6539,0.6767,90,90,120 - - 6.22 X 48138
D-Sm Sm3 D7 *,tI*,87 I4/m 0.37716,0.37716,0.53503,90,90,90 - - - N 14428
D-Sn SnD4 CF4,mS20,15 C12/c1 0.88743,0.45474,0.8757,90,119.288,90 - - 2.73 X 50006
D-Sr SrD2 PbCl2,oP12,62 Pnma 0.6361,0.3857,0.7303,90,90,90 - white 3.40 X 31577
D-Ta TaD NbH0.95 ,oP8,48 Pnnn 0.341,0.482,0.482,90,90,90 - - 15.34 X 9184
D-Ta TaD0.11 rt W,cI2,229 Im-3m 0.3324,0.3324,0.3324,90,90,90 b.c.c. family - 16.38 F 8503
D-Ta TaD0.27 ht W,cI2,229 Im-3m 0.3348,0.3348,0.3348,90,90,90 b.c.c. family - 16.06 F 8503
D-Ta TaD0.5 rt TaH0.5 ,oS8,21 C222 0.3398,0.4738,0.4763,90,90,90 - - 15.76 X 17113
D-Ta TaD0.665 *,mS*,* - 0.3394,0.3447,0.3394,90,90.4,90 - - - N 8503
D-Ta Ta2D rt Ta2H,oS6,21 C222 0.3409,0.4750,0.4773,90,90,90 - - 15.64 X 18576
D-Ta Ta4D3 Ta4H3,oI14,23 I222 0.341,0.482,0.964,90,90,90 - - 15.30 X 9184
D-Tb TbD0.2 rt Mg,hP2,194 P63/mmc 0.361,0.361,0.5695,90,90,120 close-packed structure - 8.23 F 14275
D-Tb TbD2 rt CaF2 ,cF12,225 Fm-3m 0.5233,0.5233,0.5233,90,90,90 fluorite family - 7.55 X 10893
78 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

D-Tb TbD3 HoH3,hP24,165 P-3c1 0.63928,0.63928,0.66412,90,90,120 - - 6.99 X 51598


D-Tb Tb2D4.5 lt La2H4.5 ,tI28,139 I4/mmm 0.52196,0.52196,1.04462,90,90,90 - - 7.63 X 30317
D-Th Th4D15 Cu15Si4,cI76,220 I-43d 0.911,0.911,0.911,90,90,90 - - 8.42 X 10700
D-Ti TiD m2 NbH0.95 ,oP8,48 Pnnn 0.415,0.434,0.434,90,90,90 - - 4.24 X 9325
D-Ti TiD0.85 m1 TiH0.85 ,oS8,66 Cccm 0.4189,0.4230,0.4584,90,90,90 - - 4.06 X 21027
D-Ti TiD1.94 lt ThH2,tI6,139 I4/mmm 0.31608,0.31608,0.4394,90,90,90 fluorite family - 3.92 X 26605
D-Ti TiD2 rt CaF2,cF12,225 Fm-3m 0.44316,0.44316,0.44316,90,90,90 fluorite family - 3.96 X 41680
D-Tm TmD0.09 ScH0.33 ,hP6,194 P63 /mmc 0.35463,0.35463,0.5584,90,90,120 - - 9.24 X 16240
D-Tm TmD3 HoH3,hP24,165 P-3c1 0.62169,0.62169,0.6477,90,90,120 - - 8.04 X 51598
D-U UD3 m Cr3Si,cP8,223 Pm-3n 0.4147,0.4147,0.4147,90,90,90 Frank-Kasper phase - 11.37 X 9954
D-U UD3 UH3,cP32,223 Pm-3n 0.6635,0.6635,0.6635,90,90,90 - - 11.10 X 23507
D-V VD0.43 rt *,tI*,* - 0.3009,0.3009,0.3287,90,90,90 - - 5.78 N 6799
D-V VD0.5 ht VH0.5 ,cI14,229 Im-3m 0.314,0.314,0.314,90,90,90 b.c.c. family - 5.57 X 7430
D-V VD0.5 lt *,tI*,* - 0.298,0.298,0.34,90,90,90 - - 5.71 N 6799
D-V VD0.77 lt1 NbH0.95 ,oP8,48 Pnnn 0.3158,0.4466,0.4466,90,90,90 - - 5.54 X 7723
D-V VD2 rt CaF2,cF12,225 Fm-3m 0.426,0.426,0.426,90,90,90 fluorite family - 4.72 X 19102
D-V V2D rt mon V2H,mS6,12 C12/m1 0.446,0.3,0.446,90,95.5,90 - - 5.81 X 7430
D-V V2D rt tet V2H1.1 ,tI56,141 I41/amd 0.6022,0.6022,0.659,90,90,90 - - 5.78 X 7723
D-V V4D2.88 lt2 V4H3,oP14,49 Pccm 0.4445,0.6286,0.4445,90,90,90 - - 5.60 X 7723
D-Y YD0.18 YH0.18 ,hP8,194 P63 /mmc 0.3665,0.3665,0.5779,90,90,120 - - 4.41 X 20175
D-Y YD1.96 rt CaF2,cF12,225 Fm-3m 0.5192,0.5192,0.5192,90,90,90 fluorite family - 4.41 X 13618
D-Y YD3 DyH3,hP32,165 P-3c1 0.6344,0.6344,0.65999,90,90,120 - - 4.11 X 31962
D-Yb YbD2 PbCl2,oP12,62 Pnma 0.5879,0.3565,0.6758,90,90,90 - - 8.30 X 16173
D-Yb YbD2.6 ht BiF3,cF16,225 Fm-3m 0.5168,0.5168,0.5168,90,90,90 b.c.c. family - 8.58 X 19161
D-Yb Yb3D8 Yb3H8,hP33,162 P-31m 0.63428,0.63428,0.90018,90,90,120 - black 8.50 X 40873
D-Zr ZrD orth TiH0.85 ,oS8,66 Cccm 0.4549,0.4618,0.4965,90,90,90 - - 5.94 X 28920
D-Zr ZrD1.5 CaF2,cF12,225 Fm-3m 0.4768,0.4768,0.4768,90,90,90 fluorite family - 5.78 X 1850
D-Zr ZrD2 pyr ThH2,tI6,139 I4/mmm 0.3506,0.3506,0.4455,90,90,90 fluorite family - 5.78 X 37276
Dy-Er Dy0.53 Er0.47 Mg,hP2,194 P63 /mmc 0.35773,0.35773,0.56182,90,90,120 close-packed structure - 8.79 X 7476
Dy-F DyF3 ht HoH3,hP24,165 P-3c1 0.701,0.701,0.705,90,90,120 - - 7.29 A 6277
Dy-F DyF3 rt Fe3C-b,oP16,62 Pnma 0.64545,0.68909,0.43618,90,90,90 - - 7.52 A 13708
Dy-Fe DyFe2 lt *,t**,* - 0.7314,0.7314,0.7312,90,90,90 - - - N 14512
Dy-Fe DyFe2 rt MgCu2,cF24,227 Fd-3m 0.7327,0.7327,0.7327,90,90,90 Friauf-Laves phase - 9.26 X 18037
Dy-Fe DyFe3 PuNi3,hR36,166 R-3m 0.51203,0.51203,2.4521,90,90,120 Laves-CaCu5 - 8.86 X 55210
Dy-Fe DyFe5 CaCu5,hP6,191 P6/mmm 0.49,0.49,0.41,90,90,120 - - 8.60 X 1291
Dy-Fe Dy2Fe17 ht Th2Ni17,hP38,194 P63 /mmc 0.84653,0.84653,0.82962,90,90,120 CaCu5-Zr4Al3 - 8.22 X 36002
Dy-Fe Dy2Fe17 rt Zn17Th2,hR57,166 R-3m 0.852,0.852,1.251,90,90,120 CaCu5-Zr4Al3 - 8.07 A 26286
Dy-Fe Dy6Fe23 Th6Mn23,cF116,225 Fm-3m 1.256,1.256,1.256,90,90,90 - - 7.57 A 30313
Dy-Ga DyGa TlI,oS8,63 Cmcm 0.43,1.089,0.4067,90,90,90 CrB(TlI)-FeB - 8.10 X 1397
Dy-Ga DyGa2 AlB2,hP3,191 P6/mmm 0.4194,0.4194,0.4061,90,90,120 AlB2 family - 8.11 X 52225
Dy-Ga DyGa3 ht1 Ta(Rh0.33Pd0.67 )3,hP40,194 P63 /mmc 0.617,0.617,2.3035,90,90,120 close-packed structure - 8.13 X 14252
Dy-Ga DyGa3 ht2 Cu3Au,cP4,221 Pm-3m 0.4271,0.4271,0.4271,90,90,90 close-packed structure - 7.92 X 58999
Dy-Ga DyGa3 rt Mg3In,hR48,166 R-3m 0.6169,0.6169,2.7726,90,90,120 close-packed structure - 8.10 X 14252
Dy-Ga DyGa6 PuGa6,tP14,125 P4/nbm 0.593,0.593,0.755,90,90,90 - - 7.27 A 19105
Dy-Ga Dy3Ga2 Gd3Ga2,tI80,140 I4/mcm 1.1566,1.1566,1.483,90,90,90 - - 8.40 A 19061
Dy-Ga Dy3Ga5 Tm3Ga5,oP32,62 Pnma 1.143,0.9652,0.608,90,90,90 - - 8.28 A 16150
Dy-Ga Dy5Ga3 Cr5B3,tI32,140 I4/mcm 0.7642,0.7642,1.391,90,90,90 - - 8.35 X 4602
Dy-Gd Gd0.6 Dy0.4 rt Mg,hP2,194 P63 /mmc 0.3605,0.3605,0.5652,90,90,120 close-packed structure - 8.32 X 49395
Dy-Ge DyGe TlI,oS8,63 Cmcm 0.4254,1.0623,0.3904,90,90,90 CrB(TlI)-FeB - 8.85 X 21329
Dy-Ge DyGe1.3 rt AlB2,hP3,191 P6/mmm 0.3918,0.3918,0.41191,90,90,120 AlB2 family - 7.79 X 33299
Dy-Ge DyGe1.591 rt *,m**,* - 0.3944,0.68,0.4135,90,90.12,90 - - - N 35830
Dy-Ge DyGe1.85 DyGe1.85 ,oS24,36 Cmc21 0.41027,2.9705,0.39316,90,90,90 - - 8.23 X 22222
Dy-Ge DyGe1.9 TbGe2,oS24,65 Cmmm 0.4091,2.9807,0.3987,90,90,90 - - 8.21 X 23581
Dy-Ge DyGe2 *,oP*,* - 0.799,0.812,1.489,90,90,90 - - - N 3177
Dy-Ge DyGe3 DyGe3,oS16,63 Cmcm 0.4042,2.072,0.3919,90,90,90 - - 7.70 X 26086
Dy-Ge Dy11Ge10 Ho11Ge10,tI84,139 I4/mmm 1.081,1.081,1.629,90,90,90 - - 8.77 A 2905
Dy-Ge Dy11Ge18 Dy11Ge18,oF232,43 Fdd2 1.3692,6.2997,0.57159,90,90,90 - - 8.34 X 35846
Dy-Ge Dy3Ge4 Er3Ge4,oS28,63 Cmcm 0.40242,1.0602,1.4175,90,90,90 - - 8.54 X 33299
Dy-Ge Dy3Ge5 ht Sm3Ge5,hP16,190 P-62c 0.68387,0.68387,0.8293,90,90,120 - - 8.41 X 52565
Dy-Ge Dy3Ge5 rt Y3Ge5,oF64,43 Fdd2 0.5729,1.719,1.3678,90,90,90 - - 8.39 X 23581
Dy-Ge Dy5Ge3 Mn5Si3,hP16,193 P63 /mcm 0.844,0.844,0.633,90,90,120 - - 8.76 X 4619
Dy-Ge Dy5Ge4 Sm5Ge4,oP36,62 Pnma 0.7603,1.464,0.768,90,90,90 - - 8.57 A 56511
Dy-H DyH0.2 rt Mg,hP2,194 P63 /mmc 0.3592,0.3592,0.5653,90,90,120 close-packed structure - 8.55 F 14275
Dy-H DyH2 CaF2,cF12,225 Fm-3m 0.51994,0.51994,0.51994,90,90,90 fluorite family - 7.77 X 28374
Dy-H DyH3 HoH3,hP24,165 P-3c1 0.6359,0.6359,0.6615,90,90,120 - - 7.12 A 2271
Dy-Hg HgDy CsCl,cP2,221 Pm-3m 0.3676,0.3676,0.3676,90,90,90 b.c.c. family gray silver 12.14 X 2673
Dy-Hg Hg2Dy Cd2Ce,hP3,164 P-3m1 0.4816,0.4816,0.3466,90,90,120 AlB2 family - 13.45 A 4094
Dy-Hg Hg3Dy Mg3Cd,hP8,194 P63 /mmc 0.6543,0.6543,0.488,90,90,120 close-packed structure - 14.03 A 3135
Dy-Ho Dy0.5 Ho0.5 rt Mg,hP2,194 P63 /mmc 0.35851,0.35851,0.56338,90,90,120 close-packed structure - 8.67 X 7476
Dy-I DyI2 CdCl2,hR9,166 R-3m 0.46178,0.46178,2.0806,90,90,120 - - 5.40 A 28128
Dy-I DyI3 rt BiI3,hR24,148 R-3 0.7488,0.7488,2.0833,90,90,120 - - 5.35 A 2185
Dy-In DyIn rt CsCl,cP2,221 Pm-3m 0.3791,0.3791,0.3791,90,90,90 b.c.c. family - 8.45 X 16143
Dy-In DyIn3 Cu3Au,cP4,221 Pm-3m 0.45806,0.45806,0.45806,90,90,90 close-packed structure - 8.76 X 52448
Dy-In Dy2In Co1.75 Ge,hP6,194 P63 /mmc 0.5349,0.5349,0.6675,90,90,120 AlB2 family - 8.83 X 21318
Dy-In Dy3In SrPb3,tP4,123 P4/mmm 0.4602,0.4602,0.4945,90,90,90 close-packed structure - 9.55 X 1398
Dy-In Dy3In5 Pu3Pd5,oS32,63 Cmcm 0.9835,0.799,1.026,90,90,90 - - 8.75 A 14288
Dy-In Dy5In3 W5Si3,tI32,140 I4/mcm 1.217,1.217,0.5988,90,90,90 - - 8.67 X 8290
Dy-Ir DyIr2 MgCu2,cF24,227 Fd-3m 0.7517,0.7517,0.7517,90,90,90 Friauf-Laves phase - 17.11 X 3261
Handbook of Inorganic Substances – Edition 2015 : Data 79

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Dy-Ir DyIr3 Cu3Au,cP4,221 Pm-3m 0.3842,0.3842,0.3842,90,90,90 close-packed structure - 21.64 X 19989


Dy-Ir Dy3 Ir Fe3C-b,oP16,62 Pnma 0.7187,0.9237,0.6344,90,90,90 - - 10.72 A 12087
Dy-Ir Dy3 Ir2 Y3Rh2,tI140,140 I4/mcm 1.1183,1.1183,2.5,90,90,90 - - 12.97 A 13352
Dy-Ir Dy5 Ir2 Mn5 C2,mS28,15 C12/c1 1.5676,0.6442,0.7197,90,96.89,90 - - 11.02 A 13333
Dy-Ir Dy5 Ir3 ht Mn5 Si3,hP16,193 P63/mcm 0.8172,0.8172,0.6334,90,90,120 - - 12.59 A 15271
Dy-Ir Dy5 Ir3 rt Pu5Rh3,tP32,130 P4/ncc 1.0866,1.0866,0.6276,90,90,90 - - 12.45 A 13352
Dy-La La0.5 Dy0.5 rt Mg,hP2,194 P63/mmc 0.36534,0.36534,0.58071,90,90,120 close-packed structure - 7.46 X 8303
Dy-La La0.6 Dy0.4 rt Sm,hR9,166 R-3m 0.36119,0.36119,2.61257,90,90,120 close-packed structure - 7.51 A 8303
Dy-La La0.9 Dy0.1 rt Nd,hP4,194 P63/mmc 0.38199,0.38199,1.2521,90,90,120 close-packed structure - 5.93 X 8303
Dy-Mg MgDy CsCl,cP2,221 Pm-3m 0.3776,0.3776,0.3776,90,90,90 b.c.c. family gray silver 5.76 X 25686
Dy-Mg Mg0.25 Dy0.75 ht W,cI2,229 Im-3m 0.3896,0.3896,0.3896,90,90,90 b.c.c. family - 7.19 X 22687
Dy-Mg Mg0.965 Dy0.035 Mg,hP2,194 P63/mmc 0.3218,0.3218,0.5215,90,90,120 close-packed structure - 2.07 X 25686
Dy-Mg Mg1.33 Dy0.67 Mg+ NaTl,cF16,227 Fd-3m 0.7402,0.7402,0.7402,90,90,90 b.c.c. family - 4.63 X 3765
Dy-Mg Mg2 Dy MgZn2,hP12,194 P63/mmc 0.60303,0.60303,0.97726,90,90,120 Friauf-Laves phase - 4.56 X 57343
Dy-Mg Mg24 Dy5 Ti5Re24,cI58,217 I-43m 1.1246,1.1246,1.1246,90,90,90 - white silver3.26 X 2375
Dy-Mg Mg3 Dy rt BiF3 ,cF16,225 Fm-3m 0.7296,0.7296,0.7296,90,90,90 b.c.c. family - 4.03 X 25686
Dy-Mn DyMn12 ThMn12,tI26,139 I4/mmm 0.868,0.868,0.476,90,90,90 CaCu5-Zr4Al3 - 7.61 X 2929
Dy-Mn DyMn2 ht-hp MgZn2,hP12,194 P63/mmc 0.538,0.538,0.8767,90,90,120 Friauf-Laves phase - 8.23 A 30745
Dy-Mn DyMn2 MgCu2,cF24,227 Fd-3m 0.7582,0.7582,0.7582,90,90,90 Friauf-Laves phase - 8.30 X 54204
Dy-Mn DyMn5 *,o**,* - 0.311,0.44,0.718,90,90,90 - - - N 1291
Dy-Mn Dy6 Mn23 Th6Mn23,cF116,225 Fm-3m 1.2439,1.2439,1.2439,90,90,90 - - 7.73 A 13343
Dy-N DyN NaCl,cF8,225 Fm-3m 0.49028,0.49028,0.49028,90,90,90 rocksalt family - 9.95 X 48640
Dy-N Dy2 N3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.058,1.058,1.058,90,90,90 - - 8.23 A 6879
Dy-Nd Nd0.3 Dy0.7 rt Mg,hP2,194 P63/mmc 0.3598,0.3598,0.5744,90,90,120 close-packed structure - 8.10 X 6806
Dy-Nd Nd0.5 Dy0.5 rt Sm,hR9,166 R-3m 0.36,0.36,2.601,90,90,120 close-packed structure - 7.85 A 6806
Dy-Nd Nd0.7 Dy0.3 rt Nd,hP4,194 P63/mmc 0.3616,0.3616,1.1652,90,90,120 close-packed structure - 7.54 X 6806
Dy-Ni DyNi FeB-b,oP8,62 Pnma 0.703,0.417,0.544,90,90,90 CrB(TlI)-FeB - 9.21 X 7017
Dy-Ni DyNi2 lt *,t*24,* - 0.7134,0.7134,0.7146,90,90,90 - - - N 14622
Dy-Ni DyNi2 rt MgCu2,cF24,227 Fd-3m 0.7156,0.7156,0.7156,90,90,90 Friauf-Laves phase - 10.15 X 23634
Dy-Ni DyNi3 PuNi3,hR36,166 R-3m 0.4966,0.4966,2.437,90,90,120 Laves-CaCu5 gray 9.72 X 57654
Dy-Ni DyNi5 CaCu5,hP6,191 P6/mmm 0.487,0.487,0.3971,90,90,120 - - 9.28 X 52533
Dy-Ni Dy0.95 Ni2 rt TmNi2,cF192,216 F-43m 1.4282,1.4282,1.4282,90,90,90 Friauf-Laves phase - 9.91 X 46379
Dy-Ni Dy2 Ni17 Th2Ni17,hP38,194 P63/mmc 0.829,0.829,0.803,90,90,120 CaCu5-Zr4Al3 - 9.19 A 3474
Dy-Ni Dy2 Ni7 hex Ce2Ni7,hP36,194 P63/mmc 0.4928,0.4928,2.41,90,90,120 Laves-CaCu5 - 9.64 A 5333
Dy-Ni Dy2 Ni7 rhom Gd2Co 7,hR54,166 R-3m 0.4946,0.4946,3.6191,90,90,120 Laves-CaCu5 gray 9.56 X 57608
Dy-Ni Dy3 Ni Fe3C-b,oP16,62 Pnma 0.685,0.96,0.626,90,90,90 - - 8.81 A 3471
Dy-Ni Dy3 Ni2 Dy3Ni2,mS20,12 C12/m1 1.3321,0.3662,0.9512,90,105.72,90 - - 9.00 X 7971
Dy-O DyO1.5 ht1 NdO1.5 ,cI26,229 Im-3m 0.425,0.425,0.425,90,90,90 - - 8.07 A 5888
Dy-O DyO1.5 tf CaF2 ,cF12,225 Fm-3m 0.52127,0.52127,0.52127,90,90,90 fluorite family - 8.75 X 51235
Dy-O Dy2 O3 ht2 Sm2 O3,mS30,12 C12/m1 1.39,0.3504,0.8624,90,100.06,90 - - 8.99 X 47285
Dy-O Dy2 O3 ht3 La2O3,hP5,164 P-3m1 0.3864,0.3864,0.6173,90,90,120 - - 7.76 A 2579
Dy-O Dy2 O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.06706,1.06706,1.06706,90,90,90 - colorless 8.16 X 31428
Dy-Os DyOs2 MgZn2,hP12,194 P63/mmc 0.5306,0.5306,0.8788,90,90,120 Friauf-Laves phase - 16.83 A 3261
Dy-Os Dy3 Os Fe3C-b,oP16,62 Pnma 0.7347,0.9064,0.6254,90,90,90 - - 10.81 A 13334
Dy-P DyP lt *,t*8,* - 0.5655,0.5655,0.5638,90,90,90 - - - N 4826
Dy-P DyP rt NaCl,cF8,225 Fm-3m 0.5653,0.5653,0.5653,90,90,90 rocksalt family black 7.11 X 4826
Dy-P DyP 5 NdP 5,mP12,11 P121/m1 0.4901,0.9396,0.5338,90,102.53,90 - black 4.39 X 35314
Dy-Pb DyPb3 Cu3Au,cP4,221 Pm-3m 0.4806,0.4806,0.4806,90,90,90 close-packed structure - 11.73 X 2175
Dy-Pb Dy5 Pb3 Mn5 Si3,hP16,193 P63/mcm 0.8957,0.8957,0.6546,90,90,120 - - 10.47 X 2882
Dy-Pb Dy5 Pb4 Sm5 Ge4,oP36,62 Pnma 0.8127,1.538,0.8127,90,90,90 - - 10.73 A 4282
Dy-Pd DyPd ht CsCl,cP2,221 Pm-3m 0.3486,0.3486,0.3486,90,90,90 b.c.c. family - 10.54 X 9389
Dy-Pd DyPd3 Cu3Au,cP4,221 Pm-3m 0.4066,0.4066,0.4066,90,90,90 close-packed structure - 11.90 X 25721
Dy-Pd Dy0.08Pd0.92 rt Cu,cF4,225 Fm-3m 0.3957,0.3957,0.3957,90,90,90 close-packed structure - 11.89 X 27393
Dy-Pd Dy2.12Pd0.88 ht Dy2(Dy0.12 Pd0.88 ),cF112,227 Fd-3m 1.3545,1.3545,1.3545,90,90,90 - - 9.37 X 58886
Dy-Pd Dy2.125 Pd0.875 rt Dy2.12Pd0.88 ,cF144,227 Fd-3m 1.3529,1.3529,1.3529,90,90,90 - - 9.41 X 8305
Dy-Pd Dy3 Pd2 rt U3Si2,tP10,127 P4/mbm 0.7767,0.7767,0.3893,90,90,90 - - 9.90 A 7474
Dy-Pd Dy3 Pd4 Pu3Pd4,hR42,148 R-3 1.3131,1.3131,0.569,90,90,120 b.c.c. family - 10.71 A 8276
Dy-Po DyPo NaCl,cF8,225 Fm-3m 0.6214,0.6214,0.6214,90,90,90 rocksalt family - 10.28 X 3160
Dy-Pt DyPt FeB-b,oP8,62 Pnma 0.69687,0.44808,0.55436,90,90,90 CrB(TlI)-FeB - 13.72 A 15257
Dy-Pt DyPt2 MgCu2,cF24,227 Fd-3m 0.75966,0.75966,0.75966,90,90,90 Friauf-Laves phase - 16.75 X 1398
Dy-Pt DyPt3 Cu3Au,cP4,221 Pm-3m 0.4072,0.4072,0.4072,90,90,90 close-packed structure - 18.39 X 4728
Dy-Pt DyPt5 *,o*72,* - 0.5237,0.9098,2.647,90,90,90 - - - N 7793
Dy-Pt Dy2 Pt Co2Si-b,oP12,62 Pnma 0.7101,0.4747,0.8731,90,90,90 - - 11.74 A 11341
Dy-Pt Dy3 Pt Fe3C-b,oP16,62 Pnma 0.7049,0.9485,0.6417,90,90,90 - - 10.57 A 12087
Dy-Pt Dy3 Pt4 Pu3Pd4,hR42,148 R-3 1.3107,1.3107,0.5673,90,90,120 b.c.c. family - 14.97 A 10744
Dy-Pt Dy5 Pt3 Mn5 Si3,hP16,193 P63/mcm 0.8367,0.8367,0.621,90,90,120 - - 12.33 A 11341
Dy-Pt Dy5 Pt4 Sm5 Ge4,oP36,62 Pnma 0.7452,1.4533,0.7526,90,90,90 - - 12.98 A 11278
Dy-Re DyRe2 MgZn2,hP12,194 P63/mmc 0.5398,0.5398,0.8807,90,90,120 Friauf-Laves phase - 15.99 A 5527
Dy-Rh DyRh CsCl,cP2,221 Pm-3m 0.3401,0.3401,0.3401,90,90,90 b.c.c. family - 11.20 X 7828
Dy-Rh DyRh2 MgCu2,cF24,227 Fd-3m 0.7488,0.7488,0.7488,90,90,90 Friauf-Laves phase - 11.65 X 7828
Dy-Rh DyRh5 ht CaCu5,hP6,191 P6/mmm 0.5144,0.5144,0.4294,90,90,120 - - 11.43 X 7828
Dy-Rh Dy3 Rh Fe3C-b,oP16,62 Pnma 0.7142,0.9397,0.6276,90,90,90 - - 9.31 A 7828
Dy-Rh Dy3 Rh2 Y3Rh2,tI140,140 I4/mcm 1.116,1.116,2.507,90,90,90 - - 10.32 A 9564
Dy-Rh Dy5 Rh3 ht Mn5 Si3,hP16,193 P63/mcm 0.8153,0.8153,0.6365,90,90,120 - - 10.16 A 15271
Dy-Rh Dy5 Rh3 rt *,c**,* - 1.53,1.53,1.53,90,90,90 - - - N 7828
Dy-Rh Dy7 Rh3 Th7Fe3,hP20,186 P63mc 0.9749,0.9749,0.6107,90,90,120 - - 9.56 A 7500
Dy-Ru DyRu2 MgZn2,hP12,194 P63/mmc 0.5275,0.5275,0.8854,90,90,120 Friauf-Laves phase - 11.35 A 17698
Dy-Ru Dy0.05 Ru0.95 Mg,hP2,194 P63/mmc 0.2719,0.2719,0.4289,90,90,120 close-packed structure - 12.60 X 17698
80 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Dy-Ru Dy3Ru Fe3C-b,oP16,62 Pnma 0.7275,0.9175,0.6247,90,90,90 - - 9.38 A 17698


Dy-Ru Dy3Ru2 Er3Ru2,hP10,176 P63 /m 0.7953,0.7953,0.3972,90,90,120 - - 10.53 A 23566
Dy-Ru Dy44Ru25 Y44Ru25,oP276,52 Pnna 2.795,1.5125,1.5125,90,90,90 - - 10.05 A 23566
Dy-Ru Dy5Ru2 Mn5C2,mS28,15 C12/c1 1.5658,0.62899,0.72584,90,97.25,90 - - 9.50 X 12969
Dy-S DyS lt *,t*8,* - 0.5487,0.5487,0.5458,90,90,90 - - - N 15500
Dy-S DyS rt NaCl,cF8,225 Fm-3m 0.5485,0.5485,0.5485,90,90,90 rocksalt family orange 7.83 X 2580
Dy-S DyS2 hp1-ht NdS2,tP24,117 P-4b2 0.7696,0.7696,0.7861,90,90,90 - black gray 6.47 A 5227
Dy-S DyS2 hp2-ht *,c*24,* - 0.7809,0.7809,0.7809,90,90,90 - black gray - N 5227
Dy-S DyS2 rt CeSe2,mP12,14 P121/c1 0.7844,0.38912,0.78063,90,90.106,90 - - 6.32 A 57465
Dy-S Dy10S19 Ce10Se19,tP58,86 P42 /n 0.86123,0.86123,1.57254,90,90,90 - - 6.36 A 59478
Dy-S Dy12S21.2 Dy12S21.2 ,mP70,11 P121/m1 1.10044,1.1539,1.10294,90,91.107,90 - red 6.24 X 29429
Dy-S Dy2S3 ht1 Th2S3,oP20,62 Pnma 1.06245,0.38659,1.04436,90,90,90 - black 6.52 X 26972
Dy-S Dy2S3 mon Ho2S3,mP30,11 P121/m1 1.017,0.402,1.757,90,98.5,90 - - 5.91 A 1231
Dy-S Dy2S3 rt Cr3C2-b,oP20,62 Pnma 0.7284,0.3881,1.5143,90,90,90 - brown red 6.54 X 24407
Dy-S Dy2.67 S4 ht2 Th3P 4,cI28,220 I-43d 0.8308,0.8308,0.8308,90,90,90 - black 6.51 A 11834
Dy-S Dy5S7 Y5S7,mS24,12 C12/m1 1.279,0.381,1.156,90,104.85,90 - black 6.32 A 3940
Dy-S Dy8S14.9 Y8S14.8 ,mS174,5 C121 1.54,1.5789,1.1584,90,90.34,90 - red 6.29 X 58282
Dy-Sb DySb lt *,t**,* - 0.6154,0.6154,0.6113,90,90,90 - - - N 4826
Dy-Sb DySb rt NaCl,cF8,225 Fm-3m 0.6155,0.6155,0.6155,90,90,90 rocksalt family gray 8.10 X 21892
Dy-Sb DySb2 hp HoSb2,oS6,21 C222 0.3273,0.5888,0.7965,90,90,90 - - 8.78 A 4623
Dy-Sb Dy2Sb5 Dy2Sb5,mP28,11 P121/m1 1.3066,0.41627,1.4584,90,102.213,90 - - 8.00 X 39470
Dy-Sb Dy4Sb3 rt Th3P 4,cI28,220 I-43d 0.924,0.924,0.924,90,90,90 - - 8.55 A 40151
Dy-Sb Dy5Sb3 hex Mn5Si3,hP16,193 P63 /mcm 0.888,0.888,0.627,90,90,120 - - 9.14 X 26290
Dy-Sb Dy5Sb3 orth Yb5Sb3,oP32,62 Pnma 1.1942,0.8984,0.7896,90,90,90 - - 9.23 A 56226
Dy-Sc Sc0.5 Dy0.5 rt Mg,hP2,194 P63 /mmc 0.346,0.346,0.547,90,90,120 close-packed structure - 6.07 X 25382
Dy-Se DySe lt *,t*8,* - 0.5697,0.5697,0.5677,90,90,90 - - - N 15500
Dy-Se DySe rt NaCl,cF8,225 Fm-3m 0.569,0.569,0.569,90,90,90 rocksalt family orange 8.71 X 15500
Dy-Se DySe tf ZnO,hP4,186 P63 mc 0.4,0.4,0.698,90,90,120 adamantane structure - 8.29 X 11078
Dy-Se DySe1.84 tet UAs2,tP6,129 P4/nmm 0.40124,0.40124,0.8261,90,90,90 - - 7.69 X 27185
Dy-Se DySe1.84 DySe1.84 ,oP6,31 Pmn21 0.39912,0.8206,0.39863,90,90,90 - - 7.83 X 32917
Dy-Se DySe2 mon CeSe2,mP12,14 P121/c1 0.82276,0.40551,0.81939,90,90.09,90 - - 7.79 A 57465
Dy-Se Dy0.67 Se ht NaCl,cF8,225 Fm-3m 0.579,0.579,0.579,90,90,90 rocksalt family black 6.43 X 2138
Dy-Se Dy0.75 Se Sc0.685 S,hR12,166 R-3m 0.40429,0.40429,1.97981,90,90,120 - blue 7.14 A 3930
Dy-Se Dy10Se19 Ce10Se19,tP58,86 P42 /n 0.89871,0.89871,1.64828,90,90,90 - - 7.80 A 59478
Dy-Se Dy2Se3 rt Th2S3,oP20,62 Pnma 1.1077,0.4007,1.0912,90,90,90 - black 7.71 X 10312
Dy-Se Dy2.67 Se4 ht1 Th3P 4,cI28,220 I-43d 0.862,0.862,0.862,90,90,90 - - 7.77 A 5081
Dy-Se Dy3Se4 ht Th3P 4,cI28,220 I-43d 0.867,0.867,0.867,90,90,90 - brown 8.19 A 15176
Dy-Se Dy8Se14.8 Gd8Se14.9 ,oS150,38 Amm2 1.2036,1.606,1.6475,90,90,90 - gray silver 7.72 X 49617
Dy-Si DySi ht FeB-b,oP8,62 Pnma 0.78604,0.38018,0.56614,90,90,90 CrB(TlI)-FeB gray 7.48 X 54774
Dy-Si DySi lt mon1 DySi,mP8,14 P121/c1 0.38031,0.78662,0.68234,90,123.85,90 - - 7.47 X 56741
Dy-Si DySi lt mon2 DySi,mS8,12 C12/m1 1.04844,0.42512,0.38054,90,90.133,90 - - 7.46 X 56741
Dy-Si DySi rt TlI,oS8,63 Cmcm 0.42438,1.04857,0.38151,90,90,90 CrB(TlI)-FeB - 7.46 X 46652
Dy-Si DySi1.6 ht1 ThSi2,tI12,141 I41/amd 0.398,0.398,1.336,90,90,90 - - 6.51 A 25233
Dy-Si DySi1.67 ht2 AlB2,hP3,191 P6/mmm 0.383,0.383,0.4116,90,90,120 AlB2 family - 6.65 X 40244
Dy-Si DySi1.75 rt GdSi1.4 ,oI12,74 Imma 0.3952,0.4052,1.338,90,90,90 - gray 6.56 X 22489
Dy-Si Dy10Si17 Dy10Si17,oI54,44 Imm2 0.82562,1.9144,0.66571,90,90,90 - - 6.64 X 47701
Dy-Si Dy2Si2.7 rt Ho2Si2.67 ,oS24,63 Cmcm 0.41955,2.3811,0.3805,90,90,90 - gray 7.00 X 44860
Dy-Si Dy5Si3 Mn5Si3,hP16,193 P63 /mcm 0.83953,0.83953,0.63138,90,90,120 - - 7.73 X 47006
Dy-Si Dy5Si4 Gd5Si4,oP36,62 Pnma 0.73673,1.45245,0.76616,90,90,90 - - 7.49 X 46652
Dy-Sn DySn2 ZrSi2,oS12,63 Cmcm 0.4377,1.6158,0.4283,90,90,90 close-packed structure - 8.77 X 54585
Dy-Sn DySn3 hp Cu3Au,cP4,221 Pm-3m 0.4659,0.4659,0.4659,90,90,90 close-packed structure - 8.52 X 6653
Dy-Sn DySn3 ht DyGe3,oS16,63 Cmcm 0.4378,2.1807,0.4339,90,90,90 - - 8.32 X 50624
Dy-Sn Dy0.941 Sn0.059 rt Mg,hP2,194 P63 /mmc 0.358,0.358,0.5636,90,90,120 close-packed structure - 8.49 X 26168
Dy-Sn Dy11Sn10 Ho11Ge10,tI84,139 I4/mmm 1.1503,1.1503,1.688,90,90,90 - - 8.85 A 26168
Dy-Sn Dy2Sn5 Er2Ge5,oP14,59 Pmmn 0.4317,0.4398,1.899,90,90,90 - - 8.46 X 50624
Dy-Sn Dy3Sn7 ht *,o*20,* - 0.4328,0.4416,2.6566,90,90,90 - - - N 27463
Dy-Sn Dy3Sn7 rt Tb3Sn7,oS28,65 Cmmm 0.4351,2.6248,0.4426,90,90,90 close-packed structure - 8.66 A 50624
Dy-Sn Dy5Sn11 Dy5Sn11,oI32,71 Immm 0.4328,0.4411,4.25,90,90,90 - - 8.67 X 50624
Dy-Sn Dy5Sn13 Dy5Sn13,oI36,71 Immm 0.4341,0.4405,4.805,90,90,90 - - 8.51 X 50624
Dy-Sn Dy5Sn3 rt Mn5Si3,hP16,193 P63 /mcm 0.8873,0.8873,0.6455,90,90,120 - - 8.82 A 44539
Dy-Sn Dy5Sn4 Sm5Ge4,oP36,62 Pnma 0.796,1.536,0.811,90,90,90 - - 8.62 A 26168
Dy-Tc DyTc2 MgZn2,hP12,194 P63 /mmc 0.5365,0.5365,0.883,90,90,120 Friauf-Laves phase - 10.82 A 2225
Dy-Te DyTe rt NaCl,cF8,225 Fm-3m 0.6102,0.6102,0.6102,90,90,90 rocksalt family gray 8.48 X 9499
Dy-Te DyTe1.7 ht UAs2,tP6,129 P4/nmm 0.427,0.427,0.886,90,90,90 - - 7.80 A 18461
Dy-Te DyTe2.75 NdTe3,oS16,63 Cmcm 0.428,2.528,0.428,90,90,90 - - 7.36 A 18461
Dy-Te Dy2Te Sc2Te,oP36,62 Pnma 2.1922,0.4065,1.1428,90,90,90 - - 8.86 X 38651
Dy-Te Dy2Te3 rt Sc2S3,oF80,70 Fddd 0.8637,1.2216,2.5911,90,90,90 - - 6.88 X 2549
Dy-Te Dy2Te4.5 ht Nd2Te5,oS28,63 Cmcm 0.43,4.32,0.43,90,90,90 - brown 7.48 A 18461
Dy-Th Th0.113 Dy0.887 rt Mg,hP2,194 P63 /mmc 0.359,0.359,0.5689,90,90,120 close-packed structure - 8.91 X 6931
Dy-Th Th0.43 Dy0.57 rt Cu,cF4,225 Fm-3m 0.505,0.505,0.505,90,90,90 close-packed structure - 9.92 X 4836
Dy-Tl TlDy lt CuTi,tP2,123 P4/mmm 0.352,0.352,0.421,90,90,90 b.c.c. family - 11.68 X 14458
Dy-Tl TlDy rt CsCl,cP2,221 Pm-3m 0.3747,0.3747,0.3747,90,90,90 b.c.c. family - 11.58 X 14458
Dy-Tl TlDy2 Co1.75 Ge,hP6,194 P63 /mmc 0.5301,0.5301,0.6652,90,90,120 AlB2 family - 10.86 X 21290
Dy-Tl Tl3Dy Cu3Au,cP4,221 Pm-3m 0.4672,0.4672,0.4672,90,90,90 close-packed structure - 12.63 X 3135
Dy-Tl Tl3Dy5 Tl+ Cr5B3,tI32,140 I4/mcm 0.801,0.801,1.429,90,90,90 - - 10.33 A 21290
Dy-Tl Tl3Dy5 Tl- Mn5Si3,hP16,193 P63 /mcm 0.891,0.891,0.656,90,90,120 - - 10.50 A 21290
Dy-Tl Tl5Dy3 Pu3Pd5,oS32,63 Cmcm 0.995,0.803,1.033,90,90,90 - - 12.15 A 14288
Dy-Y Y0.17 Dy0.83 rt Mg,hP2,194 P63 /mmc 0.361,0.361,0.566,90,90,120 close-packed structure - 7.80 X 5529
Handbook of Inorganic Substances – Edition 2015 : Data 81

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Dy-Zn ZnDy lt CuTi,tP2,123 P4/mmm 0.3564,0.3564,0.3553,90,90,90 b.c.c. family - 8.38 X 8492


Dy-Zn ZnDy rt CsCl,cP2,221 Pm-3m 0.3563,0.3563,0.3563,90,90,90 b.c.c. family gray silver 8.37 X 8492
Dy-Zn Zn11 Dy3 La3Al11,oI28,71 Immm 0.4395,0.883,1.2922,90,90,90 - - 7.99 A 5331
Dy-Zn Zn12 Dy ThMn12,tI26,139 I4/mmm 0.8872,0.8872,0.5204,90,90,90 CaCu5-Zr4Al3 - 7.68 A 2632
Dy-Zn Zn17 Dy2 Zn+ Th2Ni17,hP38,194 P63/mmc 0.8956,0.8956,0.8776,90,90,120 CaCu5-Zr4Al3 - 7.83 X 3579
Dy-Zn Zn17 Dy2 ht Dy+ Zn17 Th2,hR57,166 R-3m 0.89658,0.89658,1.31339,90,90,120 CaCu5-Zr4Al3 gray 7.83 X 20156
Dy-Zn Zn2Dy KHg2,oI12,74 Imma 0.4481,0.7107,0.7619,90,90,90 AlB2 family - 8.03 X 23668
Dy-Zn Zn23 Dy6 Th6Mn23,cF116,225 Fm-3m 1.271,1.271,1.271,90,90,90 - - 8.02 A 3117
Dy-Zn Zn3Dy Zn3Y,oP16,62 Pnma 0.67,0.4398,1.006,90,90,90 - - 8.04 X 3809
Dy-Zn Zn5Dy CaCu5,hP6,191 P6/mmm 0.5411,0.5411,0.4199,90,90,120 - - 7.63 X 7490
Dy-Zn Zn57 Dy13 Zn57 Dy13,oP280,62 Pnma 1.406,1.426,2.47,90,90,90 - - 7.83 X 40810
Dy-Zr Dy0.5 Zr0.5 m Mg,hP2,194 P63/mmc 0.34,0.34,0.5375,90,90,120 close-packed structure - 7.83 X 6916
Er-F ErF3 ht HoH3,hP24,165 P-3c1 0.697,0.697,0.827,90,90,120 - - 6.42 A 3073
Er-F ErF3 rt Fe3C-b,oP16,62 Pnma 0.63452,0.68457,0.43895,90,90,90 - - 7.81 X 45525
Er-Fe ErFe 2 hp-ht MgZn2,hP12,194 P63/mmc 0.533,0.533,0.857,90,90,120 Friauf-Laves phase - 8.79 A 18072
Er-Fe ErFe 2 rt MgCu2,cF24,227 Fd-3m 0.79,0.79,0.79,90,90,90 Friauf-Laves phase - 7.52 X 38828
Er-Fe ErFe 3 PuNi3,hR36,166 R-3m 0.50897,0.50897,2.4464,90,90,120 Laves-CaCu5 - 9.12 A 54599
Er-Fe Er1.8 Fe17.4 Lu1.82 Fe17.35 ,hP80,194 P63/mmc 0.8425,0.8425,0.8317,90,90,120 CaCu5-Zr4Al3 - 8.27 A 44897
Er-Fe Er2Fe 17 Th2Ni17,hP38,194 P63/mmc 0.8451,0.8451,0.8264,90,90,120 CaCu5-Zr4Al3 - 8.34 X 59288
Er-Fe Er6Fe 23 Th6Mn23,cF116,225 Fm-3m 1.1994,1.1994,1.1994,90,90,90 - - 8.81 X 17073
Er-Ga ErGa TlI,oS8,63 Cmcm 0.426,1.0722,0.4028,90,90,90 CrB(TlI)-FeB - 8.56 A 27481
Er-Ga ErGa2 AlB2 ,hP3,191 P6/mmm 0.4186,0.4186,0.4018,90,90,120 AlB2 family - 8.35 X 15309
Er-Ga ErGa3 Cu3Au,cP4,221 Pm-3m 0.4205,0.4205,0.4205,90,90,90 close-packed structure - 8.41 X 20268
Er-Ga ErGa6 PuGa6,tP14,125 P4/nbm 0.591,0.591,0.753,90,90,90 - - 7.39 A 19105
Er-Ga Er3Ga2 Gd3Ga2,tI80,140 I4/mcm 1.1385,1.1385,1.454,90,90,90 - - 9.04 A 19061
Er-Ga Er3Ga5 Tm3 Ga5,oP32,62 Pnma 1.1309,0.9566,0.6012,90,90,90 - - 8.68 A 27481
Er-Ga Er5Ga3 ht Mn5 Si3,hP16,193 P63/mcm 0.8497,0.8497,0.6377,90,90,120 - - 8.71 X 4602
Er-Ga Er5Ga3 rt Ba5Si3,tP32,130 P4/ncc 0.7554,0.7554,1.391,90,90,90 - - 8.75 A 28801
Er-Gd Gd0.51 Er0.49 Mg,hP2,194 P63/mmc 0.3602,0.3602,0.5691,90,90,120 close-packed structure - 8.42 X 2338
Er-Ge ErGe TlI,oS8,63 Cmcm 0.42199,1.0581,0.3906,90,90,90 CrB(TlI)-FeB - 9.13 X 18117
Er-Ge ErGe 1.5 ht AlB2 ,hP3,191 P6/mmm 0.38845,0.38845,0.4067,90,90,120 AlB2 family - 8.63 X 53395
Er-Ge ErGe 1.594 rt ErGe 1.59 ,mS6,12 C12/m1 0.39208,0.67547,0.40945,90,90.189,90 - - 8.67 X 50003
Er-Ge ErGe 1.83 rt DyGe1.85 ,oS24,36 Cmc21 0.40523,2.9485,0.38846,90,90,90 - - 8.59 X 33140
Er-Ge ErGe 2 rt *,m*6,* - 0.3919,0.6748,0.4093,90,90.19,90 - - - N 35932
Er-Ge ErGe 2.16 ErGe 2.16 ,oS16,63 Cmcm 0.4039,1.5662,0.39093,90,90,90 - - 8.70 X 35886
Er-Ge ErGe 2.83 DyGe3,oS16,63 Cmcm 0.3997,2.0605,0.3887,90,90,90 - - 7.73 A 35886
Er-Ge Er11 Ge10 Ho11 Ge10,tI84,139 I4/mmm 1.076,1.076,1.609,90,90,90 - - 9.15 A 14593
Er-Ge Er2Ge5 Er2Ge5,oP14,59 Pmmn 0.3872,0.3993,1.8125,90,90,90 - - 8.27 X 35886
Er-Ge Er26 Ge22.77 Er26 Ge22.77 ,tP98,129 P4/nmm 1.4576,1.4576,1.0228,90,90,90 - - 9.17 X 22228
Er-Ge Er3Ge4 rt Er3Ge4,oS28,63 Cmcm 0.39883,1.0513,1.4083,90,90,90 - - 8.91 X 33355
Er-Ge Er5Ge3 Mn5 Si3,hP16,193 P63/mcm 0.836,0.836,0.62754,90,90,120 - - 9.22 X 46887
Er-Ge Er5Ge4 Sm5 Ge4,oP36,62 Pnma 0.75448,1.4515,0.76081,90,90,90 - - 8.98 A 43780
Er-H ErH0.3 rt Mg,hP2,194 P63/mmc 0.3608,0.3608,0.5705,90,90,120 close-packed structure - 8.65 F 9922
Er-H ErH2 rt CaF2 ,cF12,225 Fm-3m 0.51288,0.51288,0.51288,90,90,90 fluorite family blue dark 8.33 X 51209
Er-H ErH3 hp BiF3 ,cF16,225 Fm-3m 0.523,0.523,0.523,90,90,90 b.c.c. family - 7.91 X 48695
Er-H ErH3 trig HoH3,hP24,165 P-3c1 0.6272,0.6272,0.6526,90,90,120 - - 7.63 A 2271
Er-Hg HgEr CsCl,cP2,221 Pm-3m 0.3645,0.3645,0.3645,90,90,90 b.c.c. family gray silver 12.61 X 2673
Er-Hg Hg2 Er Hg2U,hP3,191 P6/mmm 0.479,0.479,0.3442,90,90,120 AlB2 family - 13.80 X 2308
Er-Hg Hg3 Er Mg3 Cd,hP8,194 P63/mmc 0.6505,0.6505,0.4866,90,90,120 close-packed structure - 14.32 A 3135
Er-Ho Ho0.53 Er0.47 Mg,hP2,194 P63/mmc 0.35692,0.35692,0.56026,90,90,120 close-packed structure - 8.92 X 7476
Er-I ErI3 BiI3,hR24,148 R-3 0.7451,0.7451,2.078,90,90,120 - - 5.46 A 2185
Er-I Er4I5 Er4I5 ,mS18,12 C12/m1 1.8521,0.4015,0.8478,90,103.07,90 - black 7.05 X 13364
Er-I Er6I7 Er6I7 ,mS26,12 C12/m1 2.1375,0.3869,1.2319,90,123.50,90 - black 7.40 X 13890
Er-I Er7I10 Er7I10 ,mS38,12 C12/m1 2.0966,0.4187,1.4585,90,96.56,90 - black 6.37 X 13364
Er-In ErIn rt CsCl,cP2,221 Pm-3m 0.3745,0.3745,0.3745,90,90,90 b.c.c. family - 8.92 X 2487
Er-In ErIn3 Cu3Au,cP4,221 Pm-3m 0.45658,0.45658,0.45658,90,90,90 close-packed structure - 8.93 X 52448
Er-In Er2In Co1.75 Ge,hP6,194 P63/mmc 0.5297,0.5297,0.6641,90,90,120 AlB2 family - 9.25 X 27598
Er-In Er3In5 Pu3Pd5,oS32,63 Cmcm 0.977,0.7955,1.025,90,90,90 - - 8.97 A 14288
Er-In Er5In3 Mn5 Si3,hP16,193 P63/mcm 0.8889,0.8889,0.6558,90,90,120 - - 8.74 A 4104
Er-Ir ErIr CsCl,cP2,221 Pm-3m 0.3367,0.3367,0.3367,90,90,90 b.c.c. family - 15.64 X 23067
Er-Ir ErIr2 MgCu2,cF24,227 Fd-3m 0.7488,0.7488,0.7488,90,90,90 Friauf-Laves phase - 17.46 X 23067
Er-Ir Er3Ir Fe3C-b,oP16,62 Pnma 0.716,0.9072,0.6302,90,90,90 - - 11.26 A 23067
Er-Ir Er3Ir2 Y3Rh2,tI140,140 I4/mcm 1.1047,1.1047,2.4775,90,90,90 - - 13.63 A 23067
Er-Ir Er5Ir2 Mn5 C2,mS28,15 C12/c1 1.5395,0.6385,0.7159,90,96.9,90 - - 11.61 A 23067
Er-Ir Er5Ir3 ht Mn5 Si3,hP16,193 P63/mcm 0.8112,0.8112,0.6295,90,90,120 - - 13.08 A 23067
Er-Ir Er5Ir3 rt Pu5Rh3,tP32,130 P4/ncc 1.0754,1.0754,0.6218,90,90,90 - - 13.05 A 23067
Er-Mg MgEr2 hp CuZr2,tI6,139 I4/mmm 0.3724,0.3724,1.2452,90,90,90 close-packed structure gray silver 6.90 X 31740
Er-Mg Mg0.3 Er0.7 ht W,cI2,229 Im-3m 0.3833,0.3833,0.3833,90,90,90 b.c.c. family - 7.34 X 2388
Er-Mg Mg0.96 Er1.04 CsCl,cP2,221 Pm-3m 0.3761,0.3761,0.3761,90,90,90 b.c.c. family gray silver 6.16 X 26533
Er-Mg Mg0.965 Er0.035 Mg,hP2,194 P63/mmc 0.3215,0.3215,0.5215,90,90,120 close-packed structure - 2.09 X 26533
Er-Mg Mg2 Er MgZn2,hP12,194 P63/mmc 0.5971,0.5971,0.968,90,90,120 Friauf-Laves phase - 4.80 X 14223
Er-Mg Mg24 Er5 Ti5Re24,cI58,217 I-43m 1.1263,1.1263,1.1263,90,90,90 - white silver3.30 X 43654
Er-Mn ErMn12 ThMn12,tI26,139 I4/mmm 0.854,0.854,0.474,90,90,90 CaCu5-Zr4Al3 - 7.94 X 3779
Er-Mn ErMn2 MgZn2,hP12,194 P63/mmc 0.5295,0.5295,0.8643,90,90,120 Friauf-Laves phase gray olive 8.77 A 52472
Er-Mn Er6Mn23 Th6Mn23,cF116,225 Fm-3m 1.22,1.22,1.22,90,90,90 - - 8.29 A 52455
Er-N ErN NaCl,cF8,225 Fm-3m 0.4842,0.4842,0.4842,90,90,90 rocksalt family - 10.61 X 12495
Er-Ni ErNi FeB-b,oP8,62 Pnma 0.699,0.412,0.541,90,90,90 CrB(TlI)-FeB - 9.63 X 7095
Er-Ni ErNi2 rt MgCu2,cF24,227 Fd-3m 0.7123,0.7123,0.7123,90,90,90 Friauf-Laves phase - 10.46 X 23634
82 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Er-Ni ErNi3 PuNi3,hR36,166 R-3m 0.49479,0.49479,2.42909,90,90,120 Laves-CaCu5 - 9.96 X 44966


Er-Ni ErNi4 PuNi4,mS30,12 C12/m1 0.4855,0.8444,1.0231,90,99.54,90 - - 9.69 X 8694
Er-Ni ErNi5 CaCu5,hP6,191 P6/mmm 0.48476,0.48476,0.39548,90,90,120 - - 9.51 X 53202
Er-Ni Er0.98 Ni2 TmNi2,cF192,216 F-43m 1.4238,1.4238,1.4238,90,90,90 Friauf-Laves phase - 10.36 X 28375
Er-Ni Er2Ni17 Th2Ni17,hP38,194 P63 /mmc 0.828,0.828,0.801,90,90,120 CaCu5-Zr4Al3 - 9.30 X 10906
Er-Ni Er2Ni7 ht Gd2Co7,hR54,166 R-3m 0.4973,0.4973,3.611,90,90,120 Laves-CaCu5 - 9.60 A 43204
Er-Ni Er2Ni7 rt Ce2Ni7,hP36,194 P63 /mmc 0.4951,0.4951,2.421,90,90,120 Laves-CaCu5 - 9.63 A 4708
Er-Ni Er3Ni Fe3C-b,oP16,62 Pnma 0.689,0.93,0.61,90,90,90 - - 9.52 A 48619
Er-Ni Er3Ni2 Er3Ni2,hR45,148 R-3 0.8472,0.8472,1.5680,90,90,120 - - 9.49 X 7949
Er-Ni Er4Ni17 *,hP126,* - 0.4869,0.4869,8.407,90,90,120 - - - N 4107
Er-Ni Er5Ni22 *,hP108,* - 0.4862,0.4862,7.177,90,90,120 - - - N 4107
Er-O ErO1.5 tf CaF2,cF12,225 Fm-3m 0.515,0.515,0.515,90,90,90 fluorite family - 9.30 X 9339
Er-O Er2O3 hp Sm2O3,mS30,12 C12/m1 1.38712,0.34684,0.85639,90,100.172,90 - - 9.40 X 51516
Er-O Er2O3 ht La2O3,hP5,164 P-3m1 0.378,0.378,0.605,90,90,120 - - 8.48 A 2582
Er-O Er2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.0536,1.0536,1.0536,90,90,90 - red 8.69 X 25441
Er-Os ErOs2 MgZn2,hP12,194 P63 /mmc 0.5286,0.5286,0.8732,90,90,120 Friauf-Laves phase - 17.22 A 3261
Er-Os Er3Os Fe3C-b,oP16,62 Pnma 0.734,0.8927,0.6183,90,90,90 - - 11.35 A 13334
Er-P ErP rt NaCl,cF8,225 Fm-3m 0.56,0.56,0.56,90,90,90 rocksalt family - 7.50 X 1983
Er-Pb ErPb3 Cu3Au,cP4,221 Pm-3m 0.4799,0.4799,0.4799,90,90,90 close-packed structure - 11.85 X 7486
Er-Pb Er5Pb3 Mn5Si3,hP16,193 P63 /mcm 0.8867,0.8867,0.6504,90,90,120 - - 10.93 X 2882
Er-Pb Er5Pb4 Sm5Ge4,oP36,62 Pnma 0.8081,1.533,0.8117,90,90,90 - - 11.00 A 4345
Er-Pd ErPd ht CsCl,cP2,221 Pm-3m 0.3459,0.3459,0.3459,90,90,90 b.c.c. family - 10.98 X 9389
Er-Pd ErPd3 Cu3Au,cP4,221 Pm-3m 0.4045,0.4045,0.4045,90,90,90 close-packed structure - 12.21 X 25721
Er-Pd Er0.08Pd0.92 Cu,cF4,225 Fm-3m 0.3942,0.3942,0.3942,90,90,90 close-packed structure - 12.07 X 27393
Er-Pd Er2.2Pd0.88 Dy2.12Pd0.88 ,cF144,227 Fd-3m 1.336,1.336,1.336,90,90,90 - - 10.29 A 7474
Er-Pd Er3Pd2 U3Si2,tP10,127 P4/mbm 0.767,0.767,0.3906,90,90,90 - - 10.33 A 7474
Er-Pd Er3Pd4 Pu3Pd4,hR42,148 R-3 1.3,1.3,0.5671,90,90,120 b.c.c. family - 11.13 A 8276
Er-Pt ErPt FeB-b,oP8,62 Pnma 0.6906,0.4451,0.5509,90,90,90 CrB(TlI)-FeB - 14.21 A 13425
Er-Pt ErPt2 MgCu2,cF24,227 Fd-3m 0.7576,0.7576,0.7576,90,90,90 Friauf-Laves phase - 17.03 X 6004
Er-Pt ErPt3 Cu3Au,cP4,221 Pm-3m 0.405,0.405,0.405,90,90,90 close-packed structure - 18.81 X 2487
Er-Pt ErPt5 *,o*72,* - 0.5229,0.9085,2.651,90,90,90 - - - N 7793
Er-Pt Er2Pt Co2Si-b,oP12,62 Pnma 0.7037,0.4705,0.8668,90,90,90 - - 12.26 X 17404
Er-Pt Er3Pt Fe3C-b,oP16,62 Pnma 0.7008,0.9373,0.6374,90,90,90 - - 11.06 A 12087
Er-Pt Er3Pt4 Pu3Pd4,hR42,148 R-3 1.3004,1.3004,0.5651,90,90,120 b.c.c. family - 15.44 A 10744
Er-Pt Er5Pt3 Mn5Si3,hP16,193 P63 /mcm 0.8298,0.8298,0.6181,90,90,120 - - 12.81 A 11341
Er-Pt Er5Pt4 Sm5Ge4,oP36,62 Pnma 0.7386,1.4423,0.7461,90,90,90 - - 13.51 A 14279
Er-Re ErRe2 MgZn2,hP12,194 P63 /mmc 0.5373,0.5373,0.8765,90,90,120 Friauf-Laves phase - 16.36 A 5527
Er-Rh ErRh CsCl,cP2,221 Pm-3m 0.3377,0.3377,0.3377,90,90,90 b.c.c. family - 11.65 X 7706
Er-Rh ErRh2 MgCu2,cF24,227 Fd-3m 0.7465,0.7465,0.7465,90,90,90 Friauf-Laves phase - 11.91 X 7706
Er-Rh ErRh5 ht CaCu5,hP6,191 P6/mmm 0.5118,0.5118,0.4292,90,90,120 - - 11.63 X 22361
Er-Rh Er3Rh Fe3C-b,oP16,62 Pnma 0.7075,0.9235,0.6218,90,90,90 - - 9.89 X 6734
Er-Rh Er3Rh2 Y3Rh2,tI140,140 I4/mcm 1.109,1.109,2.488,90,90,90 - - 10.75 A 9564
Er-Rh Er5Rh3 ht Mn5Si3,hP16,193 P63 /mcm 0.8084,0.8084,0.6306,90,90,120 - - 10.66 X 7465
Er-Rh Er7Rh3 Th7Fe3,hP20,186 P63 mc 0.9643,0.9643,0.607,90,90,120 - - 10.05 X 6734
Er-Ru ErRu2 MgZn2,hP12,194 P63 /mmc 0.5227,0.5227,0.878,90,90,120 Friauf-Laves phase - 11.81 X 1059
Er-Ru Er0.05 Ru0.95 Mg,hP2,194 P63 /mmc 0.2717,0.2717,0.4294,90,90,120 close-packed structure - 12.63 X 17698
Er-Ru Er3Ru Fe3C-b,oP16,62 Pnma 0.7258,0.903,0.6203,90,90,90 - - 9.85 A 23529
Er-Ru Er3Ru2 Er3Ru2,hP10,176 P63 /m 0.7875,0.7875,0.3931,90,90,120 - - 11.07 X 24266
Er-Ru Er44Ru25 Y44Ru25,oP276,52 Pnna 2.7775,1.4998,1.4998,90,90,90 - - 10.51 A 23566
Er-Ru Er5Ru2 Mn5C2,mS28,15 C12/c1 1.5491,0.6221,0.7266,90,97.31,90 - - 9.93 A 23529
Er-S ErS rt NaCl,cF8,225 Fm-3m 0.5422,0.5422,0.5422,90,90,90 rocksalt family - 8.31 X 18387
Er-S ErS2 hp1-ht NdS2,tP24,117 P-4b2 0.763,0.763,0.789,90,90,90 - black gray 6.69 A 11830
Er-S ErS2 lt *,c**,* - 0.7745,0.7745,0.7745,90,90,90 - black gray - N 5227
Er-S ErS2 rt CeSe2,mP12,14 P121/c1 0.781,0.3862,0.7774,90,89.96,90 - - 6.55 X 57465
Er-S Er10S19 Ce10Se19,tP58,86 P42 /n 0.85334,0.85334,1.56525,90,90,90 - - 6.65 A 59478
Er-S Er2S3 cub (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.25518,1.25518,1.25518,90,90,90 - rose 5.79 X 43950
Er-S Er2S3 hp Th2S3,oP20,62 Pnma 1.0526,0.3824,1.0374,90,90,90 - - 6.85 A 9490
Er-S Er2S3 mon1 Tm2S3,mP20,11 P121/m1 1.0901,0.3896,1.1167,90,108.804,90 - golden 6.37 X 27461
Er-S Er2S3 mon2 Ho2S3,mP30,11 P121/m1 1.0072,0.3976,1.7389,90,98.66,90 - yellow 6.23 X 38883
Er-S Er2.67 S4 m Th3P 4,cI28,220 I-43d 0.8338,0.8338,0.8338,90,90,90 - - 6.59 A 26062
Er-S Er5S7 Y5S7,mS24,12 C12/m1 1.267,0.378,1.148,90,104.75,90 - black 6.63 A 3940
Er-Sb ErSb rt NaCl,cF8,225 Fm-3m 0.611,0.611,0.611,90,90,90 rocksalt family gray 8.42 X 23590
Er-Sb ErSb2 hp-ht HoSb2,oS6,21 C222 0.3259,0.5866,0.7926,90,90,90 - - 9.00 A 4623
Er-Sb Er4Sb3 Th3P 4,cI28,220 I-43d 0.902,0.902,0.902,90,90,90 - - 9.36 A 17009
Er-Sb Er5Sb3 ht Yb5Sb3,oP32,62 Pnma 1.1662,0.9136,0.8007,90,90,90 - - 9.36 X 23188
Er-Sb Er5Sb3 rt orth Y5Bi3,oP32,62 Pnma 0.79646,0.9176,1.1662,90,90,90 - - 9.36 X 52282
Er-Sb Er5Sb3 stab? Mn5Si3,hP16,193 P63 /mcm 0.88062,0.88062,0.62139,90,90,120 - - 9.56 X 48619
Er-Se ErSe rt NaCl,cF8,225 Fm-3m 0.5642,0.5642,0.5642,90,90,90 rocksalt family golden red 9.11 X 18387
Er-Se ErSe2 hp UAs2,tP6,129 P4/nmm 0.3973,0.3973,0.8197,90,90,90 - - 8.35 A 5254
Er-Se ErSe2 ht UTe2,oI12,71 Immm 0.4061,0.5571,1.316,90,90,90 - - 7.25 A 2618
Er-Se Er0.75 Se Sc0.685 S,hR12,166 R-3m 0.40002,0.40002,1.9506,90,90,120 - - 7.53 A 3930
Er-Se Er0.8 Se ht NaCl,cF8,225 Fm-3m 0.5649,0.5649,0.5649,90,90,90 rocksalt family brown 7.84 X 3484
Er-Se Er10Se19 rt Ce10Se19,tP58,86 P42 /n 0.89098,0.89098,1.64114,90,90,90 - - 8.09 A 59478
Er-Se Er2Se3 rt Sc2S3,oF80,70 Fddd 0.8093,1.1357,2.4186,90,90,90 - yellow 6.83 X 24882
Er-Se Er2.67 Se4 hp Th3P 4,cI28,220 I-43d 0.8581,0.8581,0.8581,90,90,90 - - 8.02 A 4627
Er-Se Er8Se14.7 rt Er8Se14.7,oS158,38 Amm2 1.1908,1.5921,1.6428,90,90,90 - gray silver 7.99 X 49617
Er-Si ErSi ht FeB-b,oP8,62 Pnma 0.787,0.38,0.5648,90,90,90 CrB(TlI)-FeB - 7.68 A 46652
Er-Si ErSi rt TlI,oS8,63 Cmcm 0.4195,1.0353,0.3779,90,90,90 CrB(TlI)-FeB gray 7.91 X 26276
Handbook of Inorganic Substances – Edition 2015 : Data 83

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Er-Si ErSi1.16 ErSi1.67 ,oP6,47 Pmmm 0.38009,0.40883,0.65734,90,90,90 AlB2 family - 6.50 X 22201
Er-Si ErSi1.56 AlB2 ,hP3,191 P6/mmm 0.37943,0.37943,0.40911,90,90,120 AlB2 family - 6.87 X 50095
Er-Si Er2Si2.67 Ho2Si2.67 ,oS24,63 Cmcm 0.416,2.3615,0.3774,90,90,90 - - 7.34 A 46652
Er-Si Er3Si4.7 Er3Si4.7 ,oS16,38 Amm2 0.40872,1.13516,0.65739,90,90,90 - - 6.90 X 48334
Er-Si Er5Si3 Mn5 Si3,hP16,193 P63/mcm 0.8297,0.8297,0.6221,90,90,120 - - 8.24 X 56235
Er-Si Er5Si4 lt Gd5(Ge0.5 Si0.5)4,mP36,14 P121/c1 1.43752,0.75571,0.7346,90,92.992,90 - - 7.91 X 43754
Er-Si Er5Si4 rt Gd5Si4,oP36,62 Pnma 0.72838,1.43627,0.75943,90,90,90 - - 7.93 X 43754
Er-Sn ErSn2 ZrSi2,oS12,63 Cmcm 0.4346,1.6038,0.4265,90,90,90 close-packed structure - 9.04 X 54585
Er-Sn ErSn3 hp Cu3Au,cP4,221 Pm-3m 0.46498,0.46498,0.46498,90,90,90 close-packed structure - 8.64 X 55456
Er-Sn ErSn3 GdSn2.75 ,oS16,38 Amm2 0.4336,0.4367,2.1685,90,90,90 - - 8.47 A 27463
Er-Sn Er11 Sn10 Ho11 Ge10,tI84,139 I4/mmm 1.1434,1.1434,1.6739,90,90,90 - - 9.19 A 56546
Er-Sn Er2Sn5 Er2Ge5,oP14,59 Pmmn 0.4298,0.4389,1.8867,90,90,90 - - 8.66 A 54573
Er-Sn Er3Sn7 Gd3Sn7,oS20,65 Cmmm 0.43429,2.6072,0.44149,90,90,90 close-packed structure - 8.85 X 55456
Er-Sn Er5Sn3 Mn5 Si3,hP16,193 P63/mcm 0.87333,0.87333,0.6369,90,90,120 - - 9.41 X 37325
Er-Tb Tb0.54 Er0.46 Mg,hP2,194 P63/mmc 0.35862,0.35862,0.56438,90,90,120 close-packed structure - 8.60 X 7476
Er-Tc ErTc 2 MgZn2,hP12,194 P63/mmc 0.534,0.534,0.8792,90,90,120 Friauf-Laves phase - 11.11 A 2225
Er-Te ErTe rt NaCl,cF8,225 Fm-3m 0.606,0.606,0.606,90,90,90 rocksalt family gray 8.80 X 1494
Er-Te ErTe 2 UAs2,tP6,129 P4/nmm 0.4248,0.4248,0.8865,90,90,90 - - 8.77 A 5233
Er-Te ErTe 3 NdTe 3,oS16,63 Cmcm 0.431,2.545,0.431,90,90,90 - golden 7.73 A 18466
Er-Te Er0.86 Te Zr0.65 S,cF64,227 Fd-3m 1.202,1.202,1.202,90,90,90 rocksalt family black 8.31 X 34838
Er-Te Er2Te 3 rt Sc2S3,oF80,70 Fddd 0.8581,1.2127,2.5728,90,90,90 - black 7.12 X 35219
Er-Th Th0.215 Er0.785 Mg,hP2,194 P63/mmc 0.3565,0.3565,0.5671,90,90,120 close-packed structure - 9.64 X 6933
Er-Th Th0.43 Er0.57 rt Cu,cF4,225 Fm-3m 0.503,0.503,0.503,90,90,90 close-packed structure - 10.18 X 4836
Er-Tl TlEr lt CuTi,tP2,123 P4/mmm 0.347,0.347,0.415,90,90,90 b.c.c. family - 12.35 X 20898
Er-Tl TlEr rt CsCl,cP2,221 Pm-3m 0.3709,0.3709,0.3709,90,90,90 b.c.c. family gray silver 12.09 X 20680
Er-Tl Tl3Er Cu3Au,cP4,221 Pm-3m 0.4664,0.4664,0.4664,90,90,90 close-packed structure - 12.77 X 20898
Er-Tl Tl3Er5 Tl+ Cr5B3,tI32,140 I4/mcm 0.7925,0.7925,1.419,90,90,90 - - 10.80 A 20898
Er-Tl Tl3Er5 Tl- Mn5 Si3,hP16,193 P63/mcm 0.8845,0.8845,0.652,90,90,120 - - 10.90 A 20898
Er-Tl Tl5Er3 Pu3Pd5,oS32,63 Cmcm 0.9901,0.8058,1.0314,90,90,90 - - 12.30 A 20680
Er-Y Y0.5 Er0.5 Mg,hP2,194 P63/mmc 0.3605,0.3605,0.56604,90,90,120 close-packed structure - 6.68 X 7476
Er-Zn ZnEr rt CsCl,cP2,221 Pm-3m 0.3535,0.3535,0.3535,90,90,90 b.c.c. family gray silver 8.75 X 45789
Er-Zn Zn12 Er ThMn12,tI26,139 I4/mmm 0.885,0.885,0.5195,90,90,90 CaCu5-Zr4Al3 - 7.77 X 2632
Er-Zn Zn17 Er2 ht Zn17 Th2,hR57,166 R-3m 0.89465,0.89465,1.31199,90,90,120 CaCu5-Zr4Al3 gray 7.92 X 20156
Er-Zn Zn17 Er2 rt Th2Ni17,hP38,194 P63/mmc 0.8954,0.8954,0.8744,90,90,120 CaCu5-Zr4Al3 - 7.91 A 45789
Er-Zn Zn2Er KHg2,oI12,74 Imma 0.4451,0.7001,0.7632,90,90,90 AlB2 family - 8.32 A 45789
Er-Zn Zn23 Er6 Th6Mn23,cF116,225 Fm-3m 1.263,1.263,1.263,90,90,90 - - 8.27 X 2632
Er-Zn Zn3Er Zn3Y,oP16,62 Pnma 0.6678,0.4382,1.0044,90,90,90 - - 8.21 A 45789
Er-Zn Zn5Er hex1 CaCu5,hP6,191 P6/mmm 0.5388,0.5388,0.4185,90,90,120 - - 7.80 X 7490
Er-Zn Zn5Er hex2 Zn5Er,hP36,194 P63/mmc 0.8848,0.8848,0.9164,90,90,120 - - 7.92 X 6030
Er-Zn Zn58 Er13 Zn58 Gd13,hP142,194 P63/mmc 1.423,1.423,1.401,90,90,120 - - 8.07 A 45789
Er-Zn Zn58.82 Er12.89 Zn58.82 Er12.89 ,oP312,33 Pna21 1.4045,2.4695,1.4247,90,90,90 - - 8.07 X 48452
Er-Zr Er0.15 Zr0.85 rt Mg,hP2,194 P63/mmc 0.32786,0.32786,0.51882,90,90,120 close-packed structure - 7.06 X 54810
Er-Zr Er0.5 Zr0.5 m Mg,hP2,194 P63/mmc 0.338,0.338,0.534,90,90,120 close-packed structure - 8.12 X 6916
Er-Zr Er0.89 Zr0.11 Mg,hP2,194 P63/mmc 0.35222,0.35222,0.55305,90,90,120 close-packed structure - 8.88 X 54810
Es-O Es2O3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.0766,1.0766,1.0766,90,90,90 - - 11.75 A 7525
Eu-F EuF2 CaF2 ,cF12,225 Fm-3m 0.5819,0.5819,0.5819,90,90,90 fluorite family beige 6.40 X 27194
Eu-F EuF2.15 *,cF*,225 Fm-3m 0.5816,0.5816,0.5816,90,90,90 - - - N 45885
Eu-F EuF2.25 rt *,tP7,* - 0.4085,0.4085,0.5806,90,90,90 - - 6.67 N 6562
Eu-F EuF2.41 *,hR*,* - 0.4072,0.4072,2.0081,90,90,120 - - - N 45885
Eu-F EuF3 ht1 HoH3,hP24,165 P-3c1 0.69636,0.69636,0.71091,90,90,120 - - 6.97 A 13708
Eu-F EuF3 rt Fe3C-b,oP16,62 Pnma 0.6616,0.7013,0.4392,90,90,90 - white 6.81 X 40290
Eu-F Eu14 F33 *,hR141,148 R-3 1.07938,1.07938,2.0127,90,90,120 - - 6.76 N 11955
Eu-F Eu27 F64 *,cP364,* - 1.73421,1.73421,1.73421,90,90,90 - - 6.77 N 11955
Eu-F Eu3F7 rt *,tI100,* - 0.91363,0.91363,1.73943,90,90,90 - - 6.73 N 11955
Eu-Fe EuFe 2 MgZn2,hP12,194 P63/mmc 0.5889,0.5889,0.9624,90,90,120 Friauf-Laves phase - 6.06 A 18586
Eu-Ga EuGa EuGa,aP8,2 P-1 0.5878,0.6293,0.6546,68.00,78.96,84.51 - - 6.68 X 24243
Eu-Ga EuGa2 ht AlB2 ,hP3,191 P6/mmm 0.4359,0.4359,0.4494,90,90,120 AlB2 family - 6.54 X 17136
Eu-Ga EuGa2 rt KHg2,oI12,74 Imma 0.46459,0.76255,0.76379,90,90,90 AlB2 family gray silver 7.15 X 47747
Eu-Ga EuGa4 BaAl4,tI10,139 I4/mmm 0.4407,0.4407,1.0635,90,90,90 - - 6.93 X 43293
Eu-Ga Eu2.88 Ga8.36 Eu2.88 Ga8.36 ,oI42,71 Immm 0.43732,0.44105,2.5852,90,90,90 - - 6.80 X 47749
Eu-Ga Eu3Ga2 Eu3Ga2,mS20,15 C12/c1 0.868,0.8491,0.8658,90,108.59,90 - - 6.54 X 24243
Eu-Ga Eu3Ga5 Eu3Ga5,oS32,38 Amm2 1.5333,0.4577,1.1018,90,90,90 - - 6.91 X 20245
Eu-Ga Eu5Ga3 Y5Ga3,mS32,12 C12/m1 0.85081,1.4721,0.63776,90,91.3,90 - - 8.06 A 38645
Eu-Ga Eu5Ga9 Eu5Ga9,oS56,63 Cmcm 0.4613,1.0902,2.6097,90,90,90 - gray silver 7.02 X 42014
Eu-Ge EuGe TlI,oS8,63 Cmcm 0.473,1.1194,0.4105,90,90,90 CrB(TlI)-FeB - 6.86 X 2905
Eu-Ge EuGe2 rt EuGe2,hP3,164 P-3m1 0.41035,0.41035,0.49972,90,90,120 AlB2 family gray 6.77 X 43467
Eu-Ge Eu2Ge PbCl2,oP12,62 Pnma 0.7869,0.5077,0.9416,90,90,90 - - 6.65 X 41623
Eu-Ge Eu3Ge 5 rt Pu3Pd5,oS32,63 Cmcm 0.9769,0.7971,0.9851,90,90,90 - - 7.09 X 47007
Eu-Ge Eu5Ge 3 Cr5B3,tI32,140 I4/mcm 0.799,0.799,1.5367,90,90,90 - gray silver 6.62 X 32491
Eu-H EuH2 hp1 Co1.75 Ge,hP6,194 P63/mmc 0.3927,0.3927,0.5243,90,90,120 AlB2 family - 7.30 X 57228
Eu-H EuH2 rt PbCl2,oP12,62 Pnma 0.62513,0.38042,0.72131,90,90,90 - violet 5.96 A 37328
Eu-H EuH3 hp2 EuH3,tI40,87 I4/m 0.8351,0.8351,0.5352,90,90,90 - - 6.90 X 57228
Eu-H EuH3 hp3 LaF3 ,tI8,139 I4/mmm 0.3654,0.3654,0.5211,90,90,90 - - 7.40 X 57228
Eu-Hg HgEu CsCl,cP2,221 Pm-3m 0.388,0.388,0.388,90,90,90 b.c.c. family gray silver 10.02 X 2673
Eu-Hg Hg2 Eu Cd2Ce,hP3,164 P-3m1 0.4978,0.4978,0.371,90,90,120 AlB2 family - 11.54 X 4094
Eu-Hg Hg3 Eu Mg3 Cd,hP8,194 P63/mmc 0.6794,0.6794,0.5074,90,90,120 close-packed structure - 12.34 A 2060
Eu-Hg Hg51 Eu14 Ag51 Gd14,hP68,175 P6/m 1.357,1.357,0.974,90,90,120 - - 13.21 A 12439
Eu-I EuI2 hp1 PbCl2,oP12,62 Pnma 0.8886,0.4579,1.1208,90,90,90 - - 5.91 A 12830
84 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Eu-I EuI2 hp2 *,o*48,* - 0.8391,1.3052,1.761,90,90,90 - - 5.59 N 30249


Eu-I EuI2 mon EuI2,mP12,14 P121/c1 0.764,0.826,0.788,90,98.0,90 - colorless 5.47 X 4361
Eu-I EuI2 orth1 SrI2,oP24,61 Pbca 0.783,1.512,0.818,90,90,90 - - 5.57 X 5631
Eu-I EuI2 orth2 Sr[OH]2,oP12,62 Pnma 1.22665,0.48875,0.83697,90,90,90 - yellow 5.37 X 51702
Eu-In EuIn CuTi,tP2,123 P4/mmm 0.3784,0.3784,0.4288,90,90,90 b.c.c. family - 7.22 X 24243
Eu-In EuIn2 CaIn2,hP6,194 P63 /mmc 0.4975,0.4975,0.7869,90,90,120 AlB2 family - 7.51 X 2405
Eu-In EuIn4 EuIn4,mS20,12 C12/m1 1.1928,0.5099,0.9865,90,114.56,90 - - 7.44 X 24243
Eu-In Eu2In rt Co2Si-b,oP12,62 Pnma 0.7445,0.5573,1.0306,90,90,90 - - 6.50 X 24243
Eu-In Eu8In3 rhom Yb8In3,hR132,167 R-3c 0.9577,0.9577,5.674,90,90,120 - black 6.90 X 55460
Eu-In Eu8In3 tricl Ca8In3,aP22,2 P-1 0.99267,0.99808,1.00789,99.14,101.172,119.452 - black 6.36 X 55460
Eu-Ir EuIr2 MgCu2,cF24,227 Fd-3m 0.7564,0.7564,0.7564,90,90,90 Friauf-Laves phase gray faint 16.47 X 36201
Eu-Ir Eu4Ir ThCl4,tI20,141 I41/amd 0.9326,0.9326,0.8572,90,90,90 - - 7.13 X 22408
Eu-Mg MgEu CsCl,cP2,221 Pm-3m 0.4102,0.4102,0.4102,90,90,90 b.c.c. family - 4.24 X 2137
Eu-Mg Mg17Eu2 Th2Ni17,hP38,194 P63 /mmc 1.0493,1.0493,1.0327,90,90,120 CaCu5-Zr4Al3 - 2.42 X 18116
Eu-Mg Mg2Eu MgZn2,hP12,194 P63 /mmc 0.63877,0.63877,1.03223,90,90,120 Friauf-Laves phase - 3.65 X 43209
Eu-Mg Mg4Eu SrMg4,hP90,194 P63 /mmc 1.0416,1.0416,2.8051,90,90,120 - - 2.83 X 22420
Eu-Mg Mg5.23 Eu Mg5.2 Eu,hP42,194 P63 /mmc 1.0395,1.0395,1.0746,90,90,120 - - 2.77 X 19962
Eu-Mn Eu0.03 Mn0.97 rt Mn,cI58,217 I-43m 0.899,0.899,0.899,90,90,90 - - 7.67 X 7746
Eu-N EuN NaCl,cF8,225 Fm-3m 0.50178,0.50178,0.50178,90,90,90 rocksalt family black 8.73 X 45446
Eu-Ni EuNi2 cub MgCu2,cF24,227 Fd-3m 0.73152,0.73152,0.73152,90,90,90 Friauf-Laves phase - 9.14 X 29478
Eu-Ni EuNi2 hex MgNi2,hP24,194 P63 /mmc 0.539,0.539,1.749,90,90,120 Friauf-Laves phase - 8.13 A 22361
Eu-Ni EuNi5 CaCu5,hP6,191 P6/mmm 0.4924,0.4924,0.3963,90,90,120 - - 8.89 X 18341
Eu-Ni Eu1.7 Ni1.3 hp MgCu2,cF24,227 Fd-3m 0.7334,0.7334,0.7334,90,90,90 Friauf-Laves phase - 11.27 X 23613
Eu-Ni Eu2Ni17 Th2Ni17,hP38,194 P63 /mmc 0.835,0.835,0.806,90,90,120 CaCu5-Zr4Al3 - 8.88 X 3719
Eu-Ni Eu2Ni7 Ce2Ni7,hP36,194 P63 /mmc 0.4967,0.4967,2.4249,90,90,120 Laves-CaCu5 - 9.16 A 29478
Eu-O EuO hp CsCl,cP2,221 Pm-3m 0.283,0.283,0.283,90,90,90 b.c.c. family - 12.31 X 30309
Eu-O EuO rt NaCl,cF8,225 Fm-3m 0.5141,0.5141,0.5141,90,90,90 rocksalt family violet 8.21 X 26592
Eu-O EuO2 tf Cu2Sb,tP6,129 P4/nmm 0.396,0.396,0.663,90,90,90 - - 5.88 A 9324
Eu-O Eu16O21 *,oP*,* - 0.563,0.971,4.95,90,90,90 - orange - N 2054
Eu-O Eu2O3 Eu+ *,o**,* - 0.563,0.708,0.971,90,90,90 - orange - N 1996
Eu-O Eu2O3 ht1 Sm2O3,mS30,12 C12/m1 1.41105,0.36021,0.8808,90,100.037,90 - white 7.95 X 12208
Eu-O Eu2O3 ht2 La2O3,hP5,164 P-3m1 0.3725,0.3725,0.5831,90,90,120 - - 8.34 A 29121
Eu-O Eu2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.08683,1.08683,1.08683,90,90,90 - white 7.28 X 41597
Eu-O Eu3O4 Eu3O4,oP28,62 Pnma 1.0085,0.3502,1.2054,90,90,90 - brown red 8.11 X 2910
Eu-P EuP NaCl,cF8,225 Fm-3m 0.57562,0.57562,0.57562,90,90,90 rocksalt family - 6.37 X 8245
Eu-P EuP 3 SrP 3,mS32,12 C12/m1 1.123,0.7345,0.8394,90,103.34,90 - - 4.83 A 21688
Eu-P EuP 7 rt EuP 7,mP32,14 P121/c1 1.0610,0.5700,1.3305,90,123.94,90 - black 3.67 X 13896
Eu-P Eu3P 4 Sr3As4,oF56,43 Fdd2 1.405,1.7085,0.5738,90,90,90 - black 5.59 X 17584
Eu-P Eu4P 2.67 Th3P 4,cI28,220 I-43d 0.9026,0.9026,0.9026,90,90,90 - - 6.24 X 5574
Eu-Pb EuPb rt CuAu,tP2,123 P4/mmm 0.3696,0.3696,0.4586,90,90,90 close-packed structure - 9.52 X 9914
Eu-Pb EuPb3 Cu3Au,cP4,221 Pm-3m 0.4917,0.4917,0.4917,90,90,90 close-packed structure - 10.81 X 3135
Eu-Pb Eu2Pb Co2Si-b,oP12,62 Pnma 0.787,0.54,1.003,90,90,90 - - 7.96 X 3589
Eu-Pb Eu5Pb3 W5Si3,tI32,140 I4/mcm 1.3184,1.3184,0.6214,90,90,90 - - 8.50 X 5330
Eu-Pd EuPd TlI,oS8,63 Cmcm 0.4082,1.1055,0.4431,90,90,90 CrB(TlI)-FeB - 8.58 A 10716
Eu-Pd EuPd2 MgCu2,cF24,227 Fd-3m 0.77682,0.77682,0.77682,90,90,90 Friauf-Laves phase - 10.34 X 54232
Eu-Pd EuPd3 Cu3Au,cP4,221 Pm-3m 0.41,0.41,0.41,90,90,90 close-packed structure - 11.35 X 15209
Eu-Pd EuPd5 *,oP*,* - 0.5268,0.8984,2.553,90,90,90 - - - N 21053
Eu-Pd Eu0.1 Pd0.9 Cu,cF4,225 Fm-3m 0.39755,0.39755,0.39755,90,90,90 close-packed structure - 11.73 X 6005
Eu-Pd Eu3Pd2 Er3Ni2,hR45,148 R-3 0.9204,0.9204,1.7384,90,90,120 - - 7.84 X 9088
Eu-Pd Eu5Pd2 Mn5C2,mS28,15 C12/c1 1.7399,0.6985,0.7919,90,97.25,90 - - 6.77 A 8298
Eu-Po EuPo NaCl,cF8,225 Fm-3m 0.672,0.672,0.672,90,90,90 rocksalt family - 7.90 X 3160
Eu-Pt EuPt2 MgCu2,cF24,227 Fd-3m 0.7723,0.7723,0.7723,90,90,90 Friauf-Laves phase - 15.64 X 6096
Eu-Pt EuPt5 *,o*72,* - 0.5304,0.9189,2.6366,90,90,90 - - - N 14279
Eu-Pt Eu2Pt7 Ce2Ni7,hP36,194 P63 /mmc 0.5304,0.5304,2.687,90,90,120 Laves-CaCu5 - 16.94 A 14279
Eu-Pt Eu3Pt2 Er3Ni2,hR45,148 R-3 0.9063,0.9063,1.727,90,90,120 - - 10.29 A 14279
Eu-Pt Eu5Pt2 Mn5C2,mS28,15 C12/c1 1.6776,0.6877,0.7843,90,97.24,90 - - 8.51 A 14279
Eu-Pt Eu5Pt4 Sm5Ge4,oP36,62 Pnma 0.7703,1.5217,0.7982,90,90,90 - - 10.93 A 14279
Eu-Pt Eu9Pt *,cF*,* - 0.5857,0.5857,0.5857,90,90,90 - - - N 14279
Eu-Re EuRe2 MgZn2,hP12,194 P63 /mmc 0.5316,0.5316,0.8742,90,90,120 Friauf-Laves phase - 16.28 A 2437
Eu-Rh EuRh2 MgCu2,cF24,227 Fd-3m 0.7498,0.7498,0.7498,90,90,90 Friauf-Laves phase - 11.28 X 10716
Eu-Rh Eu3Rh Fe3C-b,oP16,62 Pnma 0.7818,0.9967,0.6759,90,90,90 - - 7.05 A 16541
Eu-Rh Eu5Rh2 Mn5C2,mS28,15 C12/c1 1.6649,0.676,0.7796,90,96.82,90 - - 7.36 A 16541
Eu-Rh Eu9Rh *,cF*,* - 0.5832,0.5832,0.5832,90,90,90 - - - N 16541
Eu-S EuS rt NaCl,cF8,225 Fm-3m 0.5968,0.5968,0.5968,90,90,90 rocksalt family brown 5.75 X 26592
Eu-S EuS2 lt *,tP24,129 P4/nmm 0.7871,0.7871,0.8041,90,90,90 - black - N 11830
Eu-S Eu2S3 rt Cr3C2-b,oP20,62 Pnma 0.728,0.3742,1.5232,90,90,90 - - 6.40 A 10929
Eu-S Eu3S4 lt Eu3S4,tI28,122 I-42d 0.8508,0.8508,0.8514,90,90,90 - - 6.30 X 43702
Eu-S Eu3S4 rt Th3P 4,cI28,220 I-43d 0.8534,0.8534,0.8534,90,90,90 - black 6.24 X 43702
Eu-Sb EuSb2 CaSb2,mP6,11 P121/m1 0.4768,0.4299,0.91618,90,107.458,90 - - 7.33 X 11735
Eu-Sb Eu11Sb10 Ho11Ge10,tI84,139 I4/mmm 1.2325,1.2325,1.8024,90,90,90 - - 7.01 X 12861
Eu-Sb Eu16Sb11 Ca16Sb11,tP56,113 P-42 1m 1.2674,1.2674,1.172,90,90,90 - - 6.65 X 37729
Eu-Sb Eu2Sb3 Sr2Sb3,mP40,14 P121/c1 0.657,1.276,1.5028,90,90.04,90 - - 7.06 X 13435
Eu-Sb Eu5Sb3 (H) Yb5Sb3,oP32,62 Pnma 1.29826,1.00033,0.86325,90,90,90 - - 6.67 A 12388
Eu-Sb Eu5Sb3 hex Mn5Si3,hP16,193 P63 /mcm 0.94183,0.94183,0.72124,90,90,120 - - 6.74 X 46240
Eu-Sb Eu5Sb3 tet *,tI*,97 I422 0.4903,0.4903,1.71,90,90,90 - - - N 48636
Eu-Se EuSe rt NaCl,cF8,225 Fm-3m 0.6195,0.6195,0.6195,90,90,90 rocksalt family brown red 6.45 X 26592
Eu-Se EuSe2 m SrS2,tI12,140 I4/mcm 0.6391,0.6391,0.7848,90,90,90 - red 6.42 X 34253
Eu-Se Eu0.75 Se Lu0.68 S,oF96,70 Fddd 0.876,1.239,2.628,90,90,90 - - 5.39 A 9042
Handbook of Inorganic Substances – Edition 2015 : Data 85

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Eu-Si EuSi TlI,oS8,63 Cmcm 0.46958,1.11242,0.39799,90,90,90 CrB(TlI)-FeB gray 5.75 X 50107


Eu-Si EuSi1.94 ThSi2,tI12,141 I41/amd 0.4303,0.4303,1.366,90,90,90 - brown red 5.42 X 16145
Eu-Si EuSi6 m Eu(Ga0.33 Ge0.67)6,oS28,63 Cmcm 0.44489,1.02229,1.1616,90,90,90 clathrate - 4.03 X 47529
Eu-Si Eu2Si PbCl2,oP12,62 Pnma 0.783,0.50471,0.9378,90,90,90 - gray silver 5.95 X 40970
Eu-Si Eu3Si4 Eu3Si4,oI18,71 Immm 0.39583,0.46164,1.8229,90,90,90 - - 5.67 X 43390
Eu-Si Eu5Si3 Cr5B3,tI32,140 I4/mcm 0.79188,0.79188,1.5322,90,90,90 - gray dark 5.84 X 35221
Eu-Sn EuSn TlI,oS8,63 Cmcm 0.4976,1.19,0.4456,90,90,90 CrB(TlI)-FeB - 6.81 X 3597
Eu-Sn EuSn3 Cu3Au,cP4,221 Pm-3m 0.476,0.476,0.476,90,90,90 close-packed structure - 7.82 X 28969
Eu-Sn Eu2Sn Co2Si-b,oP12,62 Pnma 0.7857,0.539,0.991,90,90,90 - - 6.69 A 34601
Eu-Sn Eu3Sn5 Pu3Pd5,oS32,63 Cmcm 1.0466,0.8445,1.0662,90,90,90 - black 7.40 X 48808
Eu-Sn Eu5Sn3 W5Si3,tI32,140 I4/mcm 1.3122,1.3122,0.6048,90,90,90 - - 7.12 X 34601
Eu-Te EuTe hp cub1 NaCl,cF8,225 Fm-3m 0.6598,0.6598,0.6598,90,90,90 rocksalt family red ruby 6.46 X 26592
Eu-Te EuTe hp cub2 CsCl,cP2,221 Pm-3m 0.3739,0.3739,0.3739,90,90,90 b.c.c. family - 8.88 X 6939
Eu-Te Eu2Te 3 *,c**,* - 0.656,0.656,0.656,90,90,90 - gray - N 6699
Eu-Te Eu3Te 4 rt *,t**,* - 1.28,1.28,0.64,90,90,90 - brown - N 6699
Eu-Tl TlEu CsCl,cP2,221 Pm-3m 0.397,0.397,0.397,90,90,90 b.c.c. family gray silver 9.46 X 2673
Eu-Tl Tl2Eu CaIn2,hP6,194 P63/mmc 0.5035,0.5035,0.7964,90,90,120 AlB2 family - 10.65 X 2405
Eu-Tl Tl3Eu ht Cu3Au,cP4,221 Pm-3m 0.4718,0.4718,0.4718,90,90,90 close-packed structure - 12.10 X 2945
Eu-Tl Tl3Eu rt Mg3 Cd,hP8,194 P63/mmc 0.7018,0.7018,0.5313,90,90,120 close-packed structure - 11.21 A 3135
Eu-Yb Eu0.4 Yb0.6 rt Cu,cF4,225 Fm-3m 0.5497,0.5497,0.5497,90,90,90 close-packed structure - 6.58 X 20466
Eu-Yb Eu0.5 Yb0.5 ht W,cI2,229 Im-3m 0.4467,0.4467,0.4467,90,90,90 b.c.c. family - 6.05 X 20466
Eu-Zn ZnEu CsCl,cP2,221 Pm-3m 0.3812,0.3812,0.3812,90,90,90 b.c.c. family gray silver 6.52 X 2673
Eu-Zn Zn11 Eu BaCd11,tI48,141 I41/amd 1.072,1.072,0.6877,90,90,90 - - 7.32 A 2632
Eu-Zn Zn12.75 Eu NaZn13,cF112,226 Fm-3c 1.21651,1.21651,1.21651,90,90,90 - gray silver 7.27 X 50655
Eu-Zn Zn2Eu KHg2,oI12,74 Imma 0.4728,0.765,0.7655,90,90,90 AlB2 family - 6.78 X 2060
Eu-Zn Zn5Eu CaCu5,hP6,191 P6/mmm 0.5473,0.5473,0.4286,90,90,120 - - 7.15 X 2632
F-Fe FeF2 TiO2 ,tP6,136 P42/mnm 0.47,0.47,0.331,90,90,90 - - 4.26 X 22167
F-Fe FeF3 (NH3) H0.5(Ta0.5 W0.5)O3,cF64,227 Fd-3m 1.0325,1.0325,1.0325,90,90,90 pyrochlore family green faint 2.72 X 19408
F-Fe FeF3 HTB lt FeF3 ,hP24,176 P63/m 0.7402,0.7402,0.7569,90,90,120 - - 3.13 X 19612
F-Fe FeF3 HTB rt AlF3 ,oS48,63 Cmcm 0.7423,1.273,0.7526,90,90,90 - - 3.16 A 16278
F-Fe FeF3 hex WO3,hP12,191 P6/mmm 0.7413,0.7413,0.37949,90,90,120 - green faint 3.11 X 19612
F-Fe FeF3 ht ReO3,cP4,221 Pm-3m 0.3814,0.3814,0.3814,90,90,90 - - 3.38 X 11398
F-Fe FeF3 rt FeF3 ,hR24,167 R-3c 0.5194,0.5194,1.3335,90,90,120 - green light 3.61 X 18495
F-Fe Fe2F5 *,tP*,* - 0.806,0.806,0.956,90,90,90 - gray steel - N 1027
F-Ga GaF3 ht1 *,tP*,* - 0.365,0.365,0.63,90,90,90 - - - N 7617
F-Ga GaF3 ht2 FeF3 ,hR24,167 R-3c 0.5012,0.5012,1.299,90,90,120 - colorless 4.47 X 39602
F-Ga GaF3 m AlF3 ,oS48,63 Cmcm 0.721,1.2398,0.7333,90,90,90 - - 3.85 X 21577
F-Gd GdF3 ht HoH3,hP24,165 P-3c1 0.68836,0.68836,0.70727,90,90,120 - - 7.35 A 13708
F-Gd GdF3 rt Fe3C-b,oP16,62 Pnma 0.6571,0.6995,0.4393,90,90,90 - - 7.05 A 43179
F-Ge GeF2 ht TeO2,tP12,92 P41212 0.4853,0.4853,0.8579,90,90,90 - - 3.64 A 22544
F-Ge GeF2 rt GeF2,oP12,19 P212121 0.46818,0.51753,0.83153,90,90,90 - colorless 3.65 X 59261
F-Ge GeF4 SiF4 ,cI10,217 I-43m 0.5485,0.5485,0.5485,90,90,90 - - 2.99 X 21312
F-Ge Ge5 F12 Ge5F12,mP34,14 P121/c1 0.8536,0.7570,0.7969,90,93.03,90 - - 3.82 X 7436
F-Ge Ge7 F16 rt Ge7F16,mS92,9 C1c1 1.8167,0.7537,1.0294,90,90.32,90 - colorless 3.83 X 33821
F-H HF lt *,oS4,63 Cmcm 0.342,0.541,0.432,90,90,90 CrB(TlI)-FeB - - P 553
F-Hf HfF4 mon ZrF4 ,mS60,15 C12/c1 1.1725,0.9869,0.7636,90,126.15,90 - colorless 7.11 X 24203
F-Hf HfF4 tet ZrF4 ,tP40,84 P42/m 0.786,0.786,0.771,90,90,90 - - 7.10 A 6967
F-Hg HgF HgCl,tI8,139 I4/mmm 0.367,0.367,1.0901,90,90,90 - yellow 9.93 X 26870
F-Hg HgF2 CaF2 ,cF12,225 Fm-3m 0.554,0.554,0.554,90,90,90 fluorite family white 9.32 X 63
F-Ho HoF3 ht HoH3,hP24,165 P-3c1 0.701,0.701,0.708,90,90,120 - - 7.34 A 6277
F-Ho HoF3 rt Fe3C-b,oP16,62 Pnma 0.641,0.6873,0.4376,90,90,90 - - 7.65 X 10972
F-I IF3 lt ClF3 ,oP16,62 Pnma 0.8755,0.6655,0.465,90,90,90 - yellow 4.51 X 36802
F-I IF5 lt IF5,mS120,15 C12/c1 1.507,0.6836,1.824,90,92.96,90 - - 3.93 X 8191
F-I IF7 lt2 IF7,oS52,64 Cmce 0.6145,0.8843,0.871,90,90,90 - - 3.65 X 28924
F-I IF7 lt3 IF7,oP32,54 Pcca 0.85216,0.59909,0.8841,90,90,90 - - 3.82 X 28924
F-In InF3 ht FeF3 ,hR24,167 R-3c 0.54103,0.54103,1.43775,90,90,120 - colorless 4.70 X 17162
F-In InF3 m AlF3 ,oS48,63 Cmcm 0.7875,1.3499,0.7956,90,90,90 - - 4.05 A 21577
F-In InF3 rt *,tP*,* - 0.397,0.397,0.674,90,90,90 - - - N 7617
F-Ir IrF3 FeF3 ,hR24,167 R-3c 0.49432,0.49432,1.38195,90,90,120 - brown faint 8.49 X 35176
F-Ir IrF4 rt IrF4,oF40,43 Fdd2 0.925,0.964,0.567,90,90,90 - brown light 7.05 X 8102
F-Ir IrF6 lt UF6,oP28,62 Pnma 0.9411,0.8547,0.4952,90,90,90 - - 5.11 X 46442
F-Ir IrF6 rt SF6,cI14,229 Im-3m 0.623,0.623,0.623,90,90,90 - - 4.21 A 3077
F-K KF hp CsCl,cP2,221 Pm-3m 0.306,0.306,0.306,90,90,90 b.c.c. family - 3.37 X 2267
F-K KF NaCl,cF8,225 Fm-3m 0.544,0.544,0.544,90,90,90 carobbiite colorless 2.40 X 16548
F-Kr KrF2 lt XeF2,tI6,139 I4/mmm 0.4179,0.4179,0.6489,90,90,90 - - 3.57 X 38674
F-Kr KrF2 rt KrF2 ,tP6,136 P42/mnm 0.4585,0.4585,0.5827,90,90,90 - - 3.30 X 6976
F-La LaF2 CaF2 ,cF12,225 Fm-3m 0.585,0.585,0.585,90,90,90 fluorite family - 5.87 X 16461
F-La LaF3 hp1 Cu3Ti,oP8,59 Pmmn 0.40305,0.51223,0.41925,90,90,90 close-packed structure - 7.52 X 54098
F-La LaF3 ht HoH3,hP24,165 P-3c1 0.71907,0.71907,0.73531,90,90,120 fluocerite-(La) colorless 5.93 X 51598
F-Li LiF NaCl,cF8,225 Fm-3m 0.402,0.402,0.402,90,90,90 griceite - 2.65 X 19305
F-Lu LuF3 ht HoH3,hP24,165 P-3c1 0.696,0.696,0.83,90,90,120 - - 6.64 A 3073
F-Lu LuF3 rt Fe3C-b,oP16,62 Pnma 0.61091,0.67309,0.44818,90,90,90 - - 8.36 A 13708
F-Mg MgF2 hp1 CaCl2,oP6,58 Pnnm 0.4592,0.4938,0.2959,90,90,90 - - 3.08 X 56299
F-Mg MgF2 hp2 FeS2 ,cP12,205 Pa-3 0.47313,0.47313,0.47313,90,90,90 pyrite-marcasite family - 3.91 X 39339
F-Mg MgF2 hp3 PbCl2,oP12,62 Pnma 0.4914,0.2932,0.5937,90,90,90 - - 4.84 A 39339
F-Mg MgF2 m Fe2N0.94 ,oP12,60 Pbcn 0.4587,0.5511,0.5082,90,90,90 - - 3.22 A 39339
F-Mg MgF2 rt TiO2 ,tP6,136 P42/mnm 0.4628,0.4628,0.3045,90,90,90 sellaite - 3.17 X 12110
F-Mn MnF2 hp1 MnF2,tP12,111 P-42m 0.5122,0.5122,0.5256,90,90,90 - - 4.48 X 12476
86 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

F-Mn MnF2 hp2 Fe2N0.94 ,oP12,60 Pbcn 0.496,0.58,0.5359,90,90,90 - - 4.00 X 1888


F-Mn MnF2 TiO2,tP6,136 P42 /mnm 0.48736,0.48736,0.33102,90,90,90 - - 3.93 X 23269
F-Mn MnF3 rt MnF3,mS48,15 C12/c1 0.89202,0.50472,1.34748,90,92.64,90 - red ruby 3.68 X 28133
F-Mn MnF4 MnF4,tI80,88 I41/a 1.263,1.263,0.6049,90,90,90 - blue dark 3.61 X 20904
F-Mn Mn0.51 F2.03 rhom FeF3,hR24,167 R-3c 0.4892,0.4892,1.3,90,90,120 - blue dark 2.46 X 20904
F-Mn Mn2F5 *,oP56,* - 0.617,0.727,1.544,90,90,90 - violet 3.93 N 8112
F-Mo MoF3 cub ReO3,cP4,221 Pm-3m 0.38985,0.38985,0.38985,90,90,90 - - 4.29 X 368
F-Mo MoF3 rhom FeF3,hR24,167 R-3c 0.52118,0.52118,1.4407,90,90,120 - brown 4.50 X 23541
F-Mo MoF5 rt MoF5,mS48,12 C12/m1 0.961,1.422,0.516,90,94.35,90 - yellow 3.61 X 1688
F-Mo MoF6 lt1 SF6,cI14,229 Im-3m 0.6221,0.6221,0.6221,90,90,90 - - 2.90 A 8718
F-Mo MoF6 lt2 UF6,oP28,62 Pnma 0.9394,0.8543,0.4959,90,90,90 - - 3.50 X 46442
F-Na NaF NaCl,cF8,225 Fm-3m 0.46391,0.46391,0.46391,90,90,90 villiaumite colorless 2.79 X 58918
F-Nb NbF3 ReO3,cP4,221 Pm-3m 0.3903,0.3903,0.3903,90,90,90 - blue 4.19 X 716
F-Nb NbF4 SnF4,tI10,139 I4/mmm 0.4081,0.4081,0.8162,90,90,90 - black 4.13 X 2610
F-Nb NbF5 MoF5,mS48,12 C12/m1 0.962,1.443,0.512,90,96.1,90 - - 3.53 X 2252
F-Nb Nb2F5 Nb2F5,cI42,229 Im-3m 0.81878,0.81878,0.81878,90,90,90 - brown 5.10 X 47259
F-Nd NdF3 HoH3,hP24,165 P-3c1 0.703,0.703,0.72,90,90,120 - brown 6.51 X 21828
F-Ni NiF2 lt CaCl2,oP6,58 Pnnm 0.46472,0.46484,0.30745,90,90,90 - - 4.84 X 27147
F-Ni NiF2 rt TiO2,tP6,136 P42 /mnm 0.46501,0.46501,0.30835,90,90,90 - - 4.82 X 27147
F-Ni NiF3 ht H0.5(Ta0.5 W0.5)O3,cF64,227 Fd-3m 0.996,0.996,0.996,90,90,90 pyrochlore family - 3.11 A 30365
F-Ni NiF3 rt PdF3,hR24,148 R-3 0.47933,0.47933,1.30231,90,90,120 - black 4.45 X 35596
F-Np NpF3 Na3As,hP8,194 P63 /mmc 0.4108,0.4108,0.7273,90,90,120 - - 9.19 X 321
F-Np NpF4 ZrF4,mS60,15 C12/c1 1.2676,1.0745,0.8306,90,126.41,90 - - 6.85 A 28925
F-Np NpF5 UF5,tI12,87 I4/m 0.65358,0.65358,0.44562,90,90,90 - - 5.79 A 27400
F-Np NpF6 UF6,oP28,62 Pnma 0.991,0.897,0.521,90,90,90 - - 5.03 A 321
F-Os OsF5 RuF5,mP48,14 P121/c1 0.553,0.991,1.259,90,99.5,90 - blue green 5.57 X 6054
F-Os OsF6 lt UF6,oP28,62 Pnma 0.9387,0.8543,0.4944,90,90,90 - - 5.10 X 46442
F-Os OsF6 rt SF6,cI14,229 Im-3m 0.625,0.625,0.625,90,90,90 - - 4.14 A 3077
F-P PF5 SbCl5,hP12,194 P63 /mmc 0.5563,0.5563,0.6176,90,90,120 - - 2.53 X 20785
F-Pa PaF4 ZrF4,mS60,15 C12/c1 1.286,1.088,0.854,90,126.35,90 - brown red 6.36 A 3538
F-Pa PaF5 *,tI*,* - 1.153,1.153,0.519,90,90,90 - white - N 2213
F-Pb PbF2 hp PbCl2,oP12,62 Pnma 0.64567,0.39071,0.7666,90,90,90 - - 8.42 X 41848
F-Pb PbF2 ht2 UO2,cF36,225 Fm-3m 0.5931,0.5931,0.5931,90,90,90 fluorite family - 7.81 A 35088
F-Pb PbF2 rt CaF2,cF12,225 Fm-3m 0.59292,0.59292,0.59292,90,90,90 fluorite family - 7.81 X 25137
F-Pb PbF3 PbF3,tP16,116 P-4c2 0.5201,0.5201,0.9046,90,90,90 - - 7.17 X 6616
F-Pb PbF4 SnF4,tI10,139 I4/mmm 0.42475,0.42475,0.7977,90,90,90 - colorless 6.54 X 32404
F-Pd PdF2 hp PdF2,cP12,198 P213 0.5329,0.5329,0.5329,90,90,90 - black 6.34 X 14485
F-Pd PdF2 TiO2,tP6,136 P42 /mnm 0.49544,0.49544,0.33848,90,90,90 - violet 5.77 X 28180
F-Pd PdF3 FeF3,hR24,167 R-3c 0.50087,0.50087,1.41177,90,90,120 - - 5.31 X 846
F-Pd PdF4 IrF4,oF40,43 Fdd2 0.924,0.9339,0.5828,90,90,90 - - 4.82 X 11520
F-Pr PrF3 HoH3,hP24,165 P-3c1 0.70795,0.70795,0.7238,90,90,120 - green faint 6.28 X 30869
F-Pt PtF4 IrF4,oF40,43 Fdd2 0.9284,0.959,0.5712,90,90,90 - orange red 7.08 X 25939
F-Pt PtF5 RuF5,mP48,14 P121/c1 0.5523,0.9942,1.243,90,99.98,90 - red ruby 5.73 X 25939
F-Pt PtF6 lt UF6,oP28,62 Pnma 0.92815,0.84613,0.48961,90,90,90 - - 5.34 X 31850
F-Pt PtF6 rt SF6,cI14,229 Im-3m 0.621,0.621,0.621,90,90,90 - - 4.29 A 3077
F-Pu PuF3 Na3As,hP8,194 P63 /mmc 0.4087,0.4087,0.724,90,90,120 - black 9.55 X 321
F-Pu PuF4 ZrF4,mS60,15 C12/c1 1.262,1.057,0.828,90,126.03,90 - - 7.14 A 309
F-Ra RaF2 CaF2,cF12,225 Fm-3m 0.6368,0.6368,0.6368,90,90,90 fluorite family - 6.79 X 124
F-Rb RbF hp CsCl,cP2,221 Pm-3m 0.329,0.329,0.329,90,90,90 b.c.c. family - 4.87 X 2267
F-Rb RbF rt NaCl,cF8,225 Fm-3m 0.5804,0.5804,0.5804,90,90,90 rocksalt family - 3.55 X 17591
F-Re ReF4 *,tP*,* - 1.012,1.012,1.595,90,90,90 - blue - N 3164
F-Re ReF6 lt1 SF6,cI14,229 Im-3m 0.626,0.626,0.626,90,90,90 - - 4.06 A 3077
F-Re ReF6 lt2 UF6,oP28,62 Pnma 0.9417,0.857,0.4965,90,90,90 - - 4.98 A 46442
F-Re ReF7 lt ReF7,aP16,2 P-1 0.50439,0.50845,0.90916,90.835,93.350,114.169 - yellow 5.00 X 29447
F-Re ReF7 rt *,c**,* - 0.626,0.626,0.626,90,90,90 - - - N 3077
F-Rh RhF3 FeF3,hR24,167 R-3c 0.4873,0.4873,1.355,90,90,120 - brown red 5.72 X 20830
F-Rh RhF5 RuF5,mP48,14 P121/c1 0.55173,0.99173,1.23376,90,100.42,90 - red ruby 3.96 X 7379
F-Rh RhF6 lt UF6,oP28,62 Pnma 0.9323,0.8474,0.491,90,90,90 - - 3.71 A 46442
F-Rh RhF6 rt SF6,cI14,229 Im-3m 0.613,0.613,0.613,90,90,90 - - 3.13 A 3077
F-Ru RuF3 FeF3,hR24,167 R-3c 0.49666,0.49666,1.37556,90,90,120 - - 5.36 X 846
F-Ru RuF4 VF4,mP10,14 P121/c1 0.5414,0.49508,0.53989,90,117.444,90 - pink 4.58 X 25974
F-Ru RuF5 RuF5,mP48,14 P121/c1 0.54967,0.99459,1.25278,90,99.958,90 - green lime 3.86 X 25974
F-Ru RuF6 lt UF6,oP28,62 Pnma 0.9313,0.8484,0.491,90,90,90 - - 3.68 A 46442
F-Ru RuF6 rt SF6,cI14,229 Im-3m 0.611,0.611,0.611,90,90,90 - - 3.13 A 3077
F-S SF4 lt SF4,cF100,225 Fm-3m 0.6761,0.6761,0.6761,90,90,90 - - 2.32 X 17709
F-S SF6 lt1 SF6,cI14,229 Im-3m 0.57951,0.57951,0.57951,90,90,90 - - 2.49 X 21993
F-S SF6 lt2 UCl6,hP21,164 P-3m1 0.801,0.801,0.483,90,90,120 - - 2.71 A 14900
F-S SF6 lt3 SF6,mS42,12 C12/m1 1.38028,0.81392,0.47494,90,95.586,90 - - 2.74 X 37129
F-Sb SbF3 SbF3,oS16,40 Ama2 0.726,0.746,0.495,90,90,90 - - 4.43 X 5357
F-Sb SbF4 SbF4,mP80,14 P121/c1 0.932,1.207,1.160,90,107.1,90 - colorless 4.21 X 10728
F-Sb Sb11F43 rt Sb11F43,mP108,14 P121/c1 1.1638,0.8995,1.6723,90,106.81,90 - white 4.27 X 18023
F-Sb Sb2F7 Sb2F7,mP36,11 P121/m1 0.4772,1.0941,1.0895,90,96.66,90 - colorless 4.43 X 16132
F-Sb Sb4F15 orth1 Sb4F15,oP304,62 Pnma 1.9187,1.5890,1.5713,90,90,90 - - 4.28 X 20140
F-Sb Sb4F15 orth2 Sb4F15,oP152,29 Pca21 1.1157,1.1002,1.9178,90,90,90 - colorless 4.36 X 25564
F-Sb Sb7F29 Sb7F29,mP144,14 P121/c1 0.8547,1.3521,1.9551,90,100.3,90 - colorless 4.19 X 22191
F-Sc ScF2.76 *,tP*,* - 0.397,0.397,0.674,90,90,90 - colorless - N 33285
F-Sc ScF3 cub ReO3,cP4,221 Pm-3m 0.401,0.401,0.401,90,90,90 - - 2.63 X 54183
F-Sc ScF3 hp1 ScF3,hR24,161 R3c 0.53087,0.53087,1.40705,90,90,120 - - 2.96 X 53265
Handbook of Inorganic Substances – Edition 2015 : Data 87

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

F-Sc ScF3 rt ScF3 ,hR12,155 R32 0.5685,0.5685,0.6968,90,90,120 - white 2.60 X 15662


F-Se SeF4 SeF4 ,oP20,19 P212121 0.5169,0.5548,1.1345,90,90,90 - - 3.16 X 16805
F-Si SiF4 SiF4 ,cI10,217 I-43m 0.5476,0.5476,0.5476,90,90,90 - - 2.11 X 17709
F-Sm SmF2 CaF2 ,cF12,225 Fm-3m 0.5871,0.5871,0.5871,90,90,90 fluorite family red 6.18 X 11701
F-Sm SmF2.35 rt *,t**,* - 0.4109,0.4109,0.5856,90,90,90 - red dark - N 55334
F-Sm SmF3 ht HoH3,hP24,165 P-3c1 0.699,0.699,0.7142,90,90,120 - - 6.84 X 34645
F-Sm SmF3 rt Fe3C-b,oP16,62 Pnma 0.6676,0.7062,0.4411,90,90,90 - - 6.62 X 10972
F-Sm Sm13 F32 *,hR132,148 R-3 1.4736,1.4736,1.01,90,90,120 - - - N 11701
F-Sm Sm14 F33 *,hR*,* - 1.08505,1.08505,2.02,90,90,120 - - - N 11701
F-Sm Sm27 F64 *,cP*,* - 1.7423,1.7423,1.7423,90,90,90 - - - N 11701
F-Sm Sm3 F7 *,tI*,* - 0.91806,0.91806,1.7488,90,90,90 - - - N 11701
F-Sn SnF2 ht TeO2,tP12,92 P41212 0.50733,0.50733,0.8491,90,90,90 - - 4.76 X 13455
F-Sn SnF2 m orth GeF2,oP12,19 P212121 0.51392,0.49889,0.84777,90,90,90 - - 4.79 X 13455
F-Sn SnF2 rt SnF2 ,mS48,15 C12/c1 1.3353,0.4909,1.3787,90,109.11,90 - colorless 4.88 X 9841
F-Sn SnF3 ht SnF3 ,cF32,225 Fm-3m 0.8321,0.8321,0.8321,90,90,90 - - 4.05 X 24216
F-Sn SnF4 SnF4 ,tI10,139 I4/mmm 0.40442,0.40442,0.79241,90,90,90 - colorless 4.99 X 32404
F-Sn Sn3F8 rt Sn3F8,mP22,14 P121/c1 0.5209,0.5320,1.3496,90,112.32,90 - - 4.88 X 12795
F-Sr SrF2 hp1 PbCl2,oP12,62 Pnma 0.6154,0.3645,0.7312,90,90,90 - - 5.09 X 58871
F-Sr SrF2 hp2 Co1.75 Ge,hP6,194 P63/mmc 0.3841,0.3841,0.4783,90,90,120 AlB2 family - 6.83 X 58871
F-Sr SrF2 CaF2 ,cF12,225 Fm-3m 0.5768,0.5768,0.5768,90,90,90 strontiofluorite - 4.35 X 58871
F-Ta TaF3 ReO3,cP4,221 Pm-3m 0.39012,0.39012,0.39012,90,90,90 - - 6.65 X 368
F-Ta TaF5 MoF5,mS48,12 C12/m1 0.964,1.445,0.512,90,96.3,90 - white 5.17 X 2252
F-Tb TbF3 ht HoH3,hP24,165 P-3c1 0.6865,0.6865,0.7026,90,90,120 - - 7.50 A 8548
F-Tb TbF3 rt Fe3C-b,oP16,62 Pnma 0.6513,0.6949,0.4384,90,90,90 - white 7.23 X 12659
F-Tb TbF4 ZrF4 ,mS60,15 C12/c1 1.211,1.015,0.792,90,126.1,90 - - 5.95 A 620
F-Tb Tb4F15 Tb4F15,hR114,167 R-3c 1.2747,1.2747,1.1539,90,90,120 - - 5.65 X 25351
F-Tc TcF6 lt UF6,oP28,62 Pnma 0.936,0.8517,0.4934,90,90,90 - - 3.58 A 46442
F-Tc TcF6 rt SF6,cI14,229 Im-3m 0.616,0.616,0.616,90,90,90 - - 3.01 A 3077
F-Te TeF4 TeF4 ,oP20,19 P212121 0.536,0.622,0.964,90,90,90 - colorless 4.21 X 4127
F-Te TeF6 lt1 SF6,cI14,229 Im-3m 0.6293,0.6293,0.6293,90,90,90 - - 3.22 A 26495
F-Te TeF6 lt2 UF6,oP28,62 Pnma 0.97903,0.87798,0.5114,90,90,90 - - 3.65 X 26495
F-Th ThF4 ZrF4 ,mS60,15 C12/c1 1.3049,1.112,0.8538,90,126.31,90 - colorless 6.15 X 24203
F-Th Th0.75 F3 hp HoH3,hP24,165 P-3c1 0.7041,0.7041,0.7296,90,90,120 - - 7.35 A 12671
F-Ti TiF2 hp-ht CaF2 ,cF12,225 Fm-3m 0.51555,0.51555,0.51555,90,90,90 fluorite family - 4.16 X 20300
F-Ti TiF3 rt FeF3 ,hR24,167 R-3c 0.54338,0.54338,1.36421,90,90,120 - blue 3.00 X 22949
F-Ti TiF4 TiF4 ,oP60,62 Pnma 2.2811,0.3848,0.9568,90,90,90 - colorless 2.94 X 31028
F-Tl TlF ht CuTi,tP4,129 P4/nmm 0.37828,0.37828,0.61231,90,90,90 b.c.c. family - 8.47 X 37595
F-Tl TlF rt TlF,oP8,28 Pma2 0.5175,0.5488,0.6092,90,90,90 - - 8.58 X 4351
F-Tl TlF2 *,o*24,* - 0.6262,0.8228,0.8348,90,90,90 - - 7.49 N 5863
F-Tl TlF3 Fe3C-b,oP16,62 Pnma 0.5825,0.7024,0.4851,90,90,90 - colorless 8.75 X 7063
F-Tl Tl2F3 BaBiO3,cF40,225 Fm-3m 0.9208,0.9208,0.9208,90,90,90 perovskite family - 7.92 A 5863
F-Tl Tl3F5 mon *,mS8,* - 0.46697,0.6336,0.411,90,123.631,90 - - - N 9214
F-Tl Tl3F5 orth *,oP*,* - 0.7961,0.8115,3.4584,90,90,90 - - - N 9311
F-Tl Tl3F7 mon *,mP*,3 P121 0.6523,0.4222,0.6574,90,117.59,90 - - - N 8437
F-Tl Tl3F7 orth *,oP*,* - 0.8454,0.8544,3.9193,90,90,90 - - - N 9311
F-Tm TmF3 ht HoH3,hP24,165 P-3c1 0.703,0.703,0.835,90,90,120 - brown 6.30 A 3073
F-Tm TmF3 rt Fe3C-b,oP16,62 Pnma 0.62655,0.67855,0.44091,90,90,90 - - 8.01 A 13708
F-Tm Tm13 F31 Na7Zr6F31,hR135,148 R-3 1.42648,1.42648,0.97067,90,90,120 - - 8.11 A 54737
F-U UF3 Cu3P,hP24,185 P63cm 0.7179,0.7179,0.7345,90,90,120 - violet 8.97 X 3470
F-U UF4 rt ZrF4 ,mS60,15 C12/c1 1.27941,1.07901,0.83687,90,126.25,90 - green 6.72 X 28925
F-U UF5 ht UF5,tI12,87 I4/m 0.6518,0.6518,0.447,90,90,90 - blue white 5.82 X 12324
F-U UF5 rt UF5-b,tI48,122 I-42d 1.1456,1.1456,0.5195,90,90,90 - green 6.49 X 9647
F-U UF6 UF6,oP28,62 Pnma 0.99,0.8962,0.5207,90,90,90 - - 5.06 X 9893
F-U U0.75 F3 hp Cu3P,hP24,185 P63cm 0.705,0.705,0.727,90,90,120 - - 7.50 A 13641
F-U U2F9 U2F9 ,cI44,217 I-43m 0.8462,0.8462,0.8462,90,90,90 - black 7.09 X 12324
F-V VF2 V+ *,oI*,* - 0.205,0.3,0.642,90,90,90 - black - N 14385
F-V VF2 rt TiO2 ,tP6,136 P42/mnm 0.47977,0.47977,0.32469,90,90,90 - blue 3.95 X 14973
F-V VF3 rt FeF3 ,hR24,167 R-3c 0.5168,0.5168,1.3438,90,90,120 - green 3.46 X 23862
F-V VF4 VF4,mP10,14 P121/c1 0.5340,0.5170,0.5340,90,119.49,90 - green light 3.29 X 23244
F-V VF5 VF5,oP48,62 Pnma 0.753,0.540,1.672,90,90,90 - colorless 2.85 X 4736
F-W WF6 lt2 UF6,oP28,62 Pnma 0.93774,0.85397,0.49567,90,90,90 - - 4.98 X 31850
F-W WF6 rt SF6,cI14,229 Im-3m 0.628,0.628,0.628,90,90,90 - - 3.99 A 3077
F-Xe XeF2 XeF2,tI6,139 I4/mmm 0.42188,0.42188,0.69912,90,90,90 - colorless 4.52 X 54390
F-Xe XeF3 XeF3,mP16,14 P121/c1 0.664,0.733,0.640,90,92.67,90 - - 4.02 X 2446
F-Xe XeF4 XeF4,mP10,14 P121/c1 0.5050,0.5922,0.7006,90,125.7,90 - - 4.05 X 1906
F-Xe XeF6 lt XeF6,cF1792,226 Fm-3c 2.4917,2.4917,2.4917,90,90,90 - colorless 3.79 X 46838
F-Xe XeF6 mon1 XeF6,mP224,14 P121/c1 1.434,1.28,1.8529,90,90.017,90 - colorless 3.83 X 46838
F-Xe XeF6 mon2 XeF6,mS224,15 C12/c1 2.2983,1.2994,1.4125,90,126.156,90 - yellow 3.83 X 46838
F-Xe XeF6 mon3 XeF6,mP112,14 P121/c1 1.452,0.8452,1.4636,90,110.996,90 - colorless 3.89 X 46838
F-Xe XeF6 mon4 *,mP56,4 P1211 0.8957,1.0989,0.9332,90,91.84,90 - - - N 46838
F-Xe XeF6 mon5 *,mS448,* - 1.68,2.393,1.695,90,90.67,90 - - - N 46838
F-Xe XeF6 orth XeF6,oP112,33 Pna21 1.723,0.8659,1.1979,90,90,90 - colorless 3.65 X 46838
F-Y YF3 ht HoH3,hP24,165 P-3c1 0.713,0.713,0.845,90,90,120 - - 3.91 A 3073
F-Y YF3 rt Fe3C-b,oP16,62 Pnma 0.63537,0.68545,0.43953,90,90,90 waimirite gray 5.06 X 7883
F-Y YF3 stab YF3,cP15,221 Pm-3m 0.5644,0.5644,0.5644,90,90,90 - - 4.04 X 156
F-Yb YbF1.91 CaF2 ,cF12,225 Fm-3m 0.56078,0.56078,0.56078,90,90,90 fluorite family green 7.88 X 55334
F-Yb YbF3 ht HoH3,hP24,165 P-3c1 0.699,0.699,0.832,90,90,120 - - 6.51 A 7775
F-Yb YbF3 rt Fe3C-b,oP16,62 Pnma 0.6218,0.6785,0.4431,90,90,90 - white 8.17 X 10972
88 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

F-Yb Yb13F31.33 *,hR135,148 R-3 1.41871,1.41871,0.9671,90,90,120 - - 8.41 N 11034


F-Yb Yb27F64 rt *,c**,* - 1.67367,1.67367,1.67367,90,90,90 - beige - N 55334
F-Yb Yb3F7 rt *,tI100,* - 0.8787,0.8787,1.676,90,90,90 - - 8.37 N 11034
F-Yb Yb7F17 Ba4Y3F17,hR159,148 R-3 1.03671,1.03671,1.94894,90,90,120 - - 8.43 A 54737
F-Zn ZnF2 hp-ht Fe2N0.94 ,oP12,60 Pbcn 0.4683,0.5658,0.5166,90,90,90 - - 5.02 X 1888
F-Zn ZnF2 TiO2,tP6,136 P42 /mnm 0.47038,0.47038,0.31336,90,90,90 - colorless 4.95 X 38481
F-Zr ZrF4 ht ZrF4,tP40,84 P42 /m 0.7896,0.7896,0.7724,90,90,90 - - 4.61 X 14923
F-Zr ZrF4 rt ZrF4,mS60,15 C12/c1 1.1824,0.993,0.773,90,126.205,90 - - 4.55 X 46405
Fe-Ga FeGa MnGa,hR78,166 R-3m 1.24368,1.24368,0.77642,90,90,120 - - 7.82 X 42973
Fe-Ga FeGa3 IrIn3,tP16,136 P42 /mnm 0.62628,0.62628,0.65546,90,90,90 - gray silver 6.85 X 40496
Fe-Ga Fe0.7 Ga0.3 ht Mg,hP2,194 P63 /mmc 0.2617,0.2617,0.4213,90,90,120 close-packed structure - 7.98 X 1283
Fe-Ga Fe0.748 Ga0.252 ht Cu,cF4,225 Fm-3m 0.3738,0.3738,0.3738,90,90,90 close-packed structure - 7.55 X 54782
Fe-Ga Fe0.8 Ga0.2 rt W,cI2,229 Im-3m 0.2907,0.2907,0.2907,90,90,90 b.c.c. family - 7.93 X 16223
Fe-Ga Fe0.81 Ga0.19 tf Pa,tI2,139 I4/mmm 0.2902,0.2902,0.294,90,90,90 b.c.c. family - 7.84 X 54610
Fe-Ga Fe1.4 Ga0.6 ht CsCl,cP2,221 Pm-3m 0.29375,0.29375,0.29375,90,90,90 b.c.c. family - 7.86 X 56001
Fe-Ga Fe3Ga ht Ga+ Mg3Cd,hP8,194 P63 /mmc 0.5163,0.5163,0.423,90,90,120 close-packed structure - 8.07 A 59406
Fe-Ga Fe3Ga ht BiF3,cF16,225 Fm-3m 0.58604,0.58604,0.58604,90,90,90 b.c.c. family - 7.83 X 56001
Fe-Ga Fe3Ga rt Cu3Au,cP4,221 Pm-3m 0.3675,0.3675,0.3675,90,90,90 close-packed structure - 7.94 X 6864
Fe-Ga Fe3Ga4 Fe3Ga4,mS42,12 C12/m1 1.0091,0.7666,0.7866,90,106.67,90 - - 7.63 X 8839
Fe-Ga Fe6Ga5 rt Fe6Ge5,mS44,12 C12/m1 1.0058,0.7946,0.7747,90,109.33,90 AlB2 family - 7.77 X 7945
Fe-Gd GdFe2 rt MgCu2,cF24,227 Fd-3m 0.7404,0.7404,0.7404,90,90,90 Friauf-Laves phase - 8.80 X 26187
Fe-Gd GdFe3 PuNi3,hR36,166 R-3m 0.5148,0.5148,2.462,90,90,120 Laves-CaCu5 - 8.59 X 2475
Fe-Gd GdFe4 lt *,hP10,* - 0.515,0.515,0.664,90,90,120 - - - N 1534
Fe-Gd GdFe5 CaCu5,hP6,191 P6/mmm 0.492,0.492,0.411,90,90,120 - - 8.41 X 1248
Fe-Gd Gd0.9 Fe5.2 Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4907,0.4907,0.4168,90,90,120 CaCu5-Zr4Al3 - 8.25 X 5325
Fe-Gd Gd2Fe17 ht Th2Ni17,hP38,194 P63 /mmc 0.8496,0.8496,0.8345,90,90,120 CaCu5-Zr4Al3 - 8.05 X 5325
Fe-Gd Gd2Fe17 rt Zn17Th2,hR57,166 R-3m 0.851,0.851,1.251,90,90,120 CaCu5-Zr4Al3 - 8.03 X 41692
Fe-Gd Gd2Fe3 *,c*30,* - 0.825,0.825,0.825,90,90,90 - - - N 1534
Fe-Gd Gd6Fe23 Th6Mn23,cF116,225 Fm-3m 1.2138,1.2138,1.2138,90,90,90 - - 8.28 A 40155
Fe-Ge FeGe ht1 CoSn,hP6,191 P6/mmm 0.5,0.5,0.405,90,90,120 AlB2 family - 7.30 X 3179
Fe-Ge FeGe ht2 CoGe,mS16,12 C12/m1 1.1841,0.39376,0.49354,90,103.508,90 - - 7.63 X 16243
Fe-Ge FeGe rt FeSi,cP8,198 P213 0.46995,0.46995,0.46995,90,90,90 - - 8.22 X 49522
Fe-Ge FeGe2 rt CuAl2,tI12,140 I4/mcm 0.5908,0.5908,0.4957,90,90,90 - - 7.72 X 6743
Fe-Ge Fe0.1 Ge0.9 C,cF8,227 Fd-3m 0.56576,0.56576,0.56576,90,90,90 - - 5.20 X 50165
Fe-Ge Fe0.75 Ge0.25 m2 W,cI2,229 Im-3m 0.2904,0.2904,0.2904,90,90,90 b.c.c. family - 8.14 X 48578
Fe-Ge Fe0.85 Ge0.15 rt W,cI2,229 Im-3m 0.29,0.29,0.29,90,90,90 b.c.c. family - 7.95 X 16223
Fe-Ge Fe13Ge3 rt Fe13Ge3,cP16,221 Pm-3m 0.5763,0.5763,0.5763,90,90,90 b.c.c. family - 8.19 X 1643
Fe-Ge Fe2Ge Co1.75 Ge,hP6,194 P63 /mmc 0.4058,0.4058,0.5038,90,90,120 AlB2 family - 8.52 X 22702
Fe-Ge Fe2Ge3 rt Ru2Sn3,tP20,116 P-4c2 0.559,0.559,0.892,90,90,90 chimney-ladder structure - 7.85 A 37145
Fe-Ge Fe3Ge ht1 Cu3Au,cP4,221 Pm-3m 0.359,0.359,0.359,90,90,90 close-packed structure - 8.62 X 24866
Fe-Ge Fe3Ge ht2 Mg3Cd,hP8,194 P63 /mmc 0.5169,0.5169,0.4222,90,90,120 close-packed structure - 8.16 X 4575
Fe-Ge Fe6Ge5 rt Fe6Ge5,mS44,12 C12/m1 0.9965,0.7826,0.7801,90,109.67,90 AlB2 family - 8.09 X 7945
Fe-Ge Fe6.5 Ge4 ht Fe6.5 Ge4,hP22,194 P63 /mmc 0.7976,0.7976,0.4993,90,90,120 AlB2 family - 7.89 X 13346
Fe-H FeH m FeH,hP14,194 P63 /mmc 0.2679,0.2679,0.877,90,90,120 - - 6.93 X 34404
Fe-Hf HfFe2 ht2 MgNi2,hP24,194 P63 /mmc 0.4968,0.4968,1.6167,90,90,120 Friauf-Laves phase - 11.16 X 1528
Fe-Hf HfFe2 rt MgCu2,cF24,227 Fd-3m 0.7021,0.7021,0.7021,90,90,90 Friauf-Laves phase - 11.14 X 59145
Fe-Hf Hf0.001 Fe0.999 rt W,cI2,229 Im-3m 0.28674,0.28674,0.28674,90,90,90 b.c.c. family - 7.88 X 3264
Fe-Hf Hf0.93 Fe2 ht1 MgZn2,hP12,194 P63 /mmc 0.4944,0.4944,0.8066,90,90,120 Friauf-Laves phase - 10.80 X 59145
Fe-Hf Hf2Fe rt Ti2Ni,cF96,227 Fd-3m 1.20246,1.20246,1.20246,90,90,90 - - 12.62 X 24880
Fe-Ho HoFe2 hp-ht MgZn2,hP12,194 P63 /mmc 0.53,0.53,0.854,90,90,120 Friauf-Laves phase - 8.84 A 18072
Fe-Ho HoFe2 MgCu2,cF24,227 Fd-3m 0.7333,0.7333,0.7333,90,90,90 Friauf-Laves phase - 9.32 X 28882
Fe-Ho HoFe3 PuNi3,hR36,166 R-3m 0.511,0.511,2.453,90,90,120 Laves-CaCu5 - 8.96 X 7475
Fe-Ho HoFe5 CaCu5,hP6,191 P6/mmm 0.4933,0.4933,0.4176,90,90,120 - - 8.38 X 24678
Fe-Ho Ho2Fe17 rt Th2Ni17,hP38,194 P63 /mmc 0.84553,0.84553,0.83353,90,90,120 CaCu5-Zr4Al3 - 8.23 X 34683
Fe-Ho Ho6Fe23 Th6Mn23,cF116,225 Fm-3m 1.2029,1.2029,1.2029,90,90,90 - - 8.68 X 16176
Fe-I FeI2 CdI2,hP3,164 P-3m1 0.405,0.405,0.675,90,90,120 CdI2 -PbI2 polytype brown dark 5.36 X 21402
Fe-Ir Fe0.4 Ir0.6 ht Cu,cF4,225 Fm-3m 0.3766,0.3766,0.3766,90,90,90 close-packed structure - 17.12 X 4281
Fe-Ir Fe0.64 Ir0.36 rt Mg,hP2,194 P63 /mmc 0.263,0.263,0.423,90,90,120 close-packed structure - 13.75 X 2424
Fe-Ir Fe0.94 Ir0.06 rt W,cI2,229 Im-3m 0.28908,0.28908,0.28908,90,90,90 b.c.c. family - 8.80 X 3264
Fe-Lu LuFe2 hp-ht MgZn2,hP12,194 P63 /mmc 0.527,0.527,0.851,90,90,120 Friauf-Laves phase - 9.30 A 18072
Fe-Lu LuFe2 MgCu2,cF24,227 Fd-3m 0.723,0.723,0.723,90,90,90 Friauf-Laves phase - 10.08 X 19465
Fe-Lu Lu1.85 Fe17.46 Y2Fe17,hP56,194 P63 /mmc 0.8418,0.8418,0.8295,90,90,120 CaCu5-Zr4Al3 - 8.47 X 38912
Fe-Lu Lu6Fe23 Th6Mn23,cF116,225 Fm-3m 1.195,1.195,1.195,90,90,90 - - 9.09 A 2809
Fe-Mg Mg0.10 Fe0.90 rt W,cI2,229 Im-3m 0.2895,0.2895,0.2895,90,90,90 b.c.c. family - 7.21 X 54619
Fe-Mg Mg0.20 Fe0.80 *,oI*,* - 0.28745,0.28735,0.28745,90,90,90 - - 6.93 N 54619
Fe-Mn Mn0.05 Fe0.95 rt W,cI2,229 Im-3m 0.28706,0.28706,0.28706,90,90,90 b.c.c. family - 7.83 X 3264
Fe-Mn Mn0.2 Fe0.8 m W,cI2,229 Im-3m 0.29,0.29,0.29,90,90,90 b.c.c. family - 7.58 X 19498
Fe-Mn Mn0.224 Fe0.776 rt Mg,hP2,194 P63 /mmc 0.2535,0.2535,0.409,90,90,120 close-packed structure - 8.12 X 39592
Fe-Mn Mn0.3 Fe0.7 m Mn,cI58,217 I-43m 0.8805,0.8805,0.8805,90,90,90 - - 7.84 A 19498
Fe-Mn Mn0.5 Fe0.5 ht Cu,cF4,225 Fm-3m 0.3629,0.3629,0.3629,90,90,90 close-packed structure - 7.70 X 21262
Fe-Mn Mn0.67 Fe0.33 ht1 Mn,cP20,213 P4132 0.6263,0.6263,0.6263,90,90,90 - - 7.47 A 98
Fe-Mn Mn0.69 Fe0.31 rt Mn,cI58,217 I-43m 0.8872,0.8872,0.8872,90,90,90 - - 7.62 A 52455
Fe-Mn Mn0.85 Fe0.15 stab In,tI2,139 I4/mmm 0.26361,0.26361,0.3615,90,90,90 close-packed structure - 7.28 X 6139
Fe-Mo MoFe2 rt MgZn2,hP12,194 P63 /mmc 0.473,0.473,0.776,90,90,120 Friauf-Laves phase - 9.17 A 50364
Fe-Mo Mo0.08 Fe0.92 rt W,cI2,229 Im-3m 0.29,0.29,0.29,90,90,90 b.c.c. family - 8.04 X 27498
Fe-Mo Mo0.368 Fe0.632 ht (Cr0.16Mo0.38 Co0.46 ),hR159,148 R-3 1.0927,1.0927,1.9354,90,90,120 Frank-Kasper phase - 9.31 A 57102
Fe-Mo Mo0.37 Fe0.63 Mn,cP20,213 P4132 0.6364,0.6364,0.6364,90,90,90 - - 9.11 A 54200
Fe-Mo Mo0.55 Fe0.45 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.92402,0.92402,0.48275,90,90,90 Frank-Kasper phase - 9.42 X 58187
Handbook of Inorganic Substances – Edition 2015 : Data 89

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Fe-Mo Mo0.73 Fe0.27 m1 Mg,hP2,194 P63/mmc 0.273,0.273,0.445,90,90,120 close-packed structure - 9.84 X 30358
Fe-Mo Mo0.73 Fe0.27 m2 Cu,cF4,225 Fm-3m 0.386,0.386,0.386,90,90,90 close-packed structure - 9.83 X 30358
Fe-Mo Mo0.8 Fe0.2 m W,cI2,229 Im-3m 0.312,0.312,0.312,90,90,90 b.c.c. family - 9.61 X 20312
Fe-Mo Mo6 Fe7 rt W6Fe7,hR39,166 R-3m 0.4749,0.4749,2.5716,90,90,120 Frank-Kasper phase - 9.59 A 54200
Fe-Mo Mo9 Fe13 prec Mo9 Fe13,mS88,12 C12/m1 2.04,0.47,1.17,90,112.4,90 Frank-Kasper phase - 10.18 X 22151
Fe-N FeN m NaCl,cF8,225 Fm-3m 0.4303,0.4303,0.4303,90,90,90 rocksalt family - 5.82 X 50305
Fe-N FeN rt ZnS,cF8,216 F-43m 0.4307,0.4307,0.4307,90,90,90 adamantane structure - 5.81 X 27452
Fe-N FeN0.112 Cu,cF4,225 Fm-3m 0.3659,0.3659,0.3659,90,90,90 close-packed structure - 7.79 F 7641
Fe-N FeNx rt W,cI2,229 Im-3m 0.2875,0.2875,0.2875,90,90,90 b.c.c. family - 7.81 X 59730
Fe-N Fe2N0.94 Fe2N0.94 ,oP12,60 Pbcn 0.44373,0.55413,0.48429,90,90,90 - - 6.96 X 31726
Fe-N Fe2N0.96 Fe2N,hP9,149 P312 0.4787,0.4787,0.4421,90,90,120 - - 7.11 A 38898
Fe-N Fe3N Fe3N,hP8,182 P6322 0.4708,0.4708,0.43885,90,90,120 - - 7.16 X 30276
Fe-N Fe3N1.15 Re1.16 O3,hP10,182 P6322 0.4775,0.4775,0.443,90,90,120 - - 6.97 X 59730
Fe-N Fe3N1.5 hp Re1.16 O3,hP10,182 P6322 0.48016,0.48016,0.44269,90,90,120 - - 7.08 X 52130
Fe-N Fe4N Fe4N,cP5,221 Pm-3m 0.379,0.379,0.379,90,90,90 - - 7.24 X 30276
Fe-N Fe8N Fe8N,tI18,139 I4/mmm 0.57142,0.57142,0.62885,90,90,90 - - 7.45 X 58977
Fe-Nb Nb0.002 Fe0.998 rt W,cI2,229 Im-3m 0.28676,0.28676,0.28676,90,90,90 b.c.c. family - 7.88 X 3264
Fe-Nb Nb0.8 Fe0.2 m1 Cu,cF4,225 Fm-3m 0.411,0.411,0.411,90,90,90 close-packed structure - 8.18 X 28846
Fe-Nb Nb0.8 Fe0.2 m2 Mg,hP2,194 P63/mmc 0.294,0.294,0.48,90,90,120 close-packed structure - 7.90 X 28846
Fe-Nb Nb0.8 Fe2.2 MgZn2,hP12,194 P63/mmc 0.482,0.482,0.7866,90,90,120 Friauf-Laves phase - 8.28 A 57362
Fe-Nb Nb6.5 Fe6.5 W6Fe7,hR39,166 R-3m 0.4928,0.4928,2.683,90,90,120 Frank-Kasper phase - 8.54 X 4250
Fe-Nd NdFe 2 hp MgCu2,cF24,227 Fd-3m 0.7462,0.7462,0.7462,90,90,90 Friauf-Laves phase - 8.18 X 23982
Fe-Nd NdFe 5 m CaCu5,hP6,191 P6/mmm 0.4946,0.4946,0.417,90,90,120 - - 7.96 X 19065
Fe-Nd Nd2 Fe17 ht Zn17 Th2,hR57,166 R-3m 0.8584,0.8584,1.2463,90,90,120 CaCu5-Zr4Al3 - 7.75 X 54685
Fe-Nd Nd5 Fe17 Nd5Fe17,hP264,193 P63/mcm 2.0214,2.0214,1.2329,90,90,120 - - 7.63 X 23579
Fe-Ni FeNi tae 1M FeNi,mP4,6 P1m1 0.3581,0.3582,0.3587,90,90.04,90 taenite 1M - 8.27 X 31115
Fe-Ni FeNi tet CuAu,tP2,123 P4/mmm 0.2531,0.2531,0.3579,90,90,90 tetrataenite white 8.30 X 13615
Fe-Ni FeNi3 rt Cu3Au,cP4,221 Pm-3m 0.35545,0.35545,0.35545,90,90,90 awarnite - 8.58 X 48901
Fe-Ni Fe0.17 Ni0.83 Mg,hP2,194 P63/mmc 0.245,0.245,0.396,90,90,120 close-packed structure - 9.39 X 54226
Fe-Ni Fe0.5Ni0.5 rt Cu,cF4,225 Fm-3m 0.3758,0.3758,0.3758,90,90,90 taenite - 7.17 X 30469
Fe-Ni Fe0.6 Ni0.4 tf W,cI2,229 Im-3m 0.2872,0.2872,0.2872,90,90,90 b.c.c. family - 7.99 X 23633
Fe-Ni Fe0.7113 Ni0.2887 tae cub *,cI32,* - 0.7168,0.7168,0.7168,90,90,90 taenite cP - - N 2991
Fe-Ni Fe0.8782 Ni0.1218 kam cub *,cP*,* - 0.8617,0.8617,0.8617,90,90,90 kamacite C - - N 2991
Fe-Ni Fe0.91 Ni0.09 hp Mg,hP2,194 P63/mmc 0.23211,0.23211,0.37492,90,90,120 close-packed structure - 10.65 X 59160
Fe-Ni Fe0.92 Ni0.08 rt W,cI2,229 Im-3m 0.28704,0.28704,0.28704,90,90,90 b.c.c. family - 7.87 X 3264
Fe-Ni Fe0.9381 Ni0.0619 kam tet *,tP*,* - 0.716,0.716,0.574,90,90,90 kamacite Q - - N 2991
Fe-Np NpFe 2 MgCu2,cF24,227 Fd-3m 0.7144,0.7144,0.7144,90,90,90 Friauf-Laves phase - 12.71 X 9263
Fe-Np Np6 Fe U6Mn,tI28,140 I4/mcm 1.0224,1.0224,0.5238,90,90,90 - - 17.93 A 10746
Fe-O Fe0.9 O hp2 NiO,hR6,166 R-3m 0.2599,0.2599,0.7307,90,90,120 rocksalt family - 7.72 X 48738
Fe-O Fe0.94 O hp1 NiO,hR6,166 R-3m 0.28278,0.28278,0.7311,90,90,120 rocksalt family - 6.74 X 59165
Fe-O Fe0.95 O ht-hp *,mP*,11 P121/m1 0.2925,0.2731,0.39749,90,97.211,90 - - - N 51593
Fe-O Fe0.952 O ht NaCl,cF8,225 Fm-3m 0.43109,0.43109,0.43109,90,90,90 wüstite black 5.73 X 26252
Fe-O Fe0.96 O hp-ht NiAs,hP4,194 P63/mmc 0.267,0.267,0.521,90,90,120 AlB2 family - 7.19 X 57203
Fe-O Fe0.97 O lt NiO,hR6,166 R-3m 0.30249,0.30249,0.75012,90,90,120 rocksalt family - 5.88 X 493
Fe-O Fe2O3 hp1 Rh2S3,oP20,60 Pbcn 0.66428,0.46003,0.49263,90,90,90 - - 7.05 X 40694
Fe-O Fe2O3 hp2 Fe2O3,oS20,63 Cmcm 0.26395,0.85441,0.63864,90,90,90 - - 7.36 X 45092
Fe-O Fe2O3 lt Al2O3,hR30,167 R-3c 0.50354,0.50354,1.37477,90,90,120 hematite black 5.27 X 55767
Fe-O Fe2O3 rt orth Fe2O3,oP40,33 Pna21 0.50715,0.87359,0.94178,90,90,90 - brown 5.08 X 45702
Fe-O Fe2O3 tet Fe2O3,tP160,92 P41212 0.8332,0.8332,2.5113,90,90,90 - - 4.87 X 48968
Fe-O Fe2O3 tf (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 0.9393,0.9393,0.9393,90,90,90 - - 5.12 A 9664
Fe-O Fe2O3 trig Fe2O3,hP30,143 P3 0.503,0.503,1.373,90,90,120 - - 5.29 X 898
Fe-O Fe3O4 hp Fe3O4,oS28,63 Cmcm 0.27555,0.9326,0.9288,90,90,90 - - 6.44 X 41764
Fe-O Fe3O4 ht Fe3O4,cF56,227 Fd-3m 0.83967,0.83967,0.83967,90,90,90 maghemite - 5.20 X 51826
Fe-O Fe3O4 lt rhom Fe3O4,hR42,166 R-3m 0.59277,0.59277,1.45699,90,90,120 - - 5.20 X 38095
Fe-O Fe3O4 rt Fe3O4,cF56,227 Fd-3m 0.83198,0.83198,0.83198,90,90,90 magnetite - 5.34 X 49249
Fe-O Fe4O5 hp Fe4O5,oS36,63 Cmcm 0.2843,0.97,1.229,90,90,90 - - 5.95 X 57104
Fe-Os Fe0.7 Os0.3 Mg,hP2,194 P63/mmc 0.2618,0.2618,0.4189,90,90,120 close-packed structure - 12.84 X 6146
Fe-Os Fe0.985 Os0.015 rt W,cI2,229 Im-3m 0.28715,0.28715,0.28715,90,90,90 b.c.c. family - 8.12 X 3264
Fe-P FeP FeAs,oP8,62 Pnma 0.5191,0.3099,0.5792,90,90,90 murashkoite - 6.19 X 1630
Fe-P FeP2 FeAs2,oP6,58 Pnnm 0.49729,0.56568,0.2723,90,90,90 zuktamrurite - 5.11 X 4462
Fe-P FeP4 hp FeP4 ,oS20,20 C222 1 0.5005,1.0212,0.5530,90,90,90 - black 4.22 X 11729
Fe-P FeP4 mon1 FeP4 ,mP30,14 P121/c1 0.4619,1.3670,0.7002,90,101.48,90 - black 4.13 X 11270
Fe-P FeP4 mon2 FeP4 ,mS40,15 C12/c1 0.50543,1.0407,1.1069,90,91.14,90 - - 4.10 X 20447
Fe-P Fe0.96P 0.04 rt W,cI2,229 Im-3m 0.2859,0.2859,0.2859,90,90,90 b.c.c. family - 7.80 X 57362
Fe-P Fe2P hp-ht Co2P,oP12,62 Pnma 0.5775,0.3571,0.6641,90,90,90 - - 6.92 A 10071
Fe-P Fe2P Fe2P,hP9,189 P-62m 0.58675,0.58675,0.34581,90,90,120 Fe2P family - 6.89 X 7623
Fe-P Fe3P Ni3P,tI32,82 I-4 0.9107,0.9107,0.446,90,90,90 - - 7.13 X 1626
Fe-P Fe4P prec Fe4P,oP5,47 Pmmm 0.359,0.401,0.432,90,90,90 - - 6.79 X 1530
Fe-Pb Fe0.97Pb0.03 rt W,cI2,229 Im-3m 0.2882,0.2882,0.2882,90,90,90 b.c.c. family - 8.38 X 50498
Fe-Pd FePd3 rt Cu3Au,cP4,221 Pm-3m 0.3852,0.3852,0.3852,90,90,90 close-packed structure - 10.90 X 14520
Fe-Pd Fe0.699Pd0.301 rt Cu,cF4,225 Fm-3m 0.3752,0.3752,0.3752,90,90,90 close-packed structure - 8.94 X 23816
Fe-Pd Fe0.7Pd0.3 lt In,tI2,139 I4/mmm 0.27047,0.27047,0.3542,90,90,90 close-packed structure - 9.10 X 55158
Fe-Pd Fe0.8Pd0.2 tf W,cI2,229 Im-3m 0.297,0.297,0.297,90,90,90 b.c.c. family - 8.36 X 21393
Fe-Pd Fe0.97Pd0.03 rt W,cI2,229 Im-3m 0.28811,0.28811,0.28811,90,90,90 b.c.c. family - 7.97 X 3264
Fe-Pd Fe1.396Pd0.604 lt CuAu,tP2,123 P4/mmm 0.2679,0.2679,0.3635,90,90,90 close-packed structure - 9.05 X 23816
Fe-Pd Fe3Pd Cu3Au,cP4,221 Pm-3m 0.3818,0.3818,0.3818,90,90,90 close-packed structure - 8.17 X 16223
Fe-Pr PrFe 2 hp-ht MgCu2,cF24,227 Fd-3m 0.7464,0.7464,0.7464,90,90,90 Friauf-Laves phase - 8.07 X 18150
Fe-Pr Pr2Fe 17 Zn17 Th2,hR57,166 R-3m 0.8588,0.8588,1.24699,90,90,120 CaCu5-Zr4Al3 - 7.70 X 54859
90 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Fe-Pt FePt rt CuAu,tP2,123 P4/mmm 0.2728,0.2728,0.3736,90,90,90 tetraferroplatinum - 14.99 X 58777


Fe-Pt FePt3 rt Cu3Au,cP4,221 Pm-3m 0.387,0.387,0.387,90,90,90 isoferroplatinum - 18.37 X 15467
Fe-Pt Fe0.5Pt0.5 ht Cu,cF4,225 Fm-3m 0.384,0.384,0.384,90,90,90 close-packed structure - 14.72 X 58777
Fe-Pt Fe0.97Pt0.03 rt W,cI2,229 Im-3m 0.28832,0.28832,0.28832,90,90,90 b.c.c. family - 8.32 X 3264
Fe-Pt Fe3Pt mart SrPb3,tP4,123 P4/mmm 0.3805,0.3805,0.3632,90,90,90 close-packed structure - 11.45 X 51155
Fe-Pt Fe3Pt rt Cu3Au,cP4,221 Pm-3m 0.3837,0.3837,0.3837,90,90,90 close-packed structure - 10.66 X 51155
Fe-Pu PuFe2 ht MgCu2,cF24,227 Fd-3m 0.7183,0.7183,0.7183,90,90,90 Friauf-Laves phase - 12.75 X 12480
Fe-Pu Pu6Fe U6Mn,tI28,140 I4/mcm 1.0405,1.0405,0.5349,90,90,90 - - 17.43 A 885
Fe-Re Re0.08 Fe0.92 rt W,cI2,229 Im-3m 0.28911,0.28911,0.28911,90,90,90 b.c.c. family - 9.11 X 3264
Fe-Re Re0.4 Fe0.6 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9,0.9,0.468,90,90,90 Frank-Kasper phase - 14.19 A 19167
Fe-Re Re0.6 Fe0.4 Mn,cP20,213 P4132 0.643,0.643,0.643,90,90,90 - - 16.75 X 3236
Fe-Rh FeRh ht1 CsCl,cP2,221 Pm-3m 0.2997,0.2997,0.2997,90,90,90 b.c.c. family - 9.79 X 3702
Fe-Rh FeRh rt CsCl,cP2,221 Pm-3m 0.2983,0.2983,0.2983,90,90,90 b.c.c. family - 9.93 X 52034
Fe-Rh Fe0.5 Rh0.5 ht Cu,cF4,225 Fm-3m 0.3724,0.3724,0.3724,90,90,90 close-packed structure - 10.21 X 27506
Fe-Rh Fe0.7 Rh0.3 tf W,cI2,229 Im-3m 0.2941,0.2941,0.2941,90,90,90 b.c.c. family - 9.13 X 27506
Fe-Rh Fe0.94Rh0.06 rt W,cI2,229 Im-3m 0.2888,0.2888,0.2888,90,90,90 b.c.c. family - 8.09 X 3264
Fe-Ru Fe0.4 Ru0.6 Mg,hP2,194 P63 /mmc 0.266,0.266,0.423,90,90,120 close-packed structure - 10.63 X 21719
Fe-Ru Fe0.9 Ru0.1 rt W,cI2,229 Im-3m 0.29,0.29,0.29,90,90,90 b.c.c. family - 8.22 X 21719
Fe-S FeS hp1 FeAs,oP8,62 Pnma 0.49371,0.30844,0.51576,90,90,90 AlB2 family - 7.43 X 50304
Fe-S FeS hp2 FeS,mP24,14 P121/c1 0.64832,0.56666,0.81103,90,93.05,90 - - 5.89 X 36468
Fe-S FeS ht1 Nb0.92 S,hP16,186 P63 mc 0.67175,0.67175,0.56542,90,90,120 AlB2 family - 5.29 X 34910
Fe-S FeS ht2 NiAs,hP4,194 P63 /mmc 0.35538,0.35538,0.581,90,90,120 AlB2 family - 4.59 X 45324
Fe-S FeS lt ble FeS,oF8,22 F222 0.5195,0.5487,0.554,90,90,90 - - 3.70 X 11920
Fe-S FeS mac PbO,tP4,129 P4/nmm 0.36735,0.36735,0.50328,90,90,90 mackinawite - 4.30 X 30764
Fe-S FeS rt ble ZnS,cF8,216 F-43m 0.542,0.542,0.542,90,90,90 adamantane structure - 3.67 X 11920
Fe-S FeS rt tro FeS,hP24,190 P-62c 0.5965,0.5965,1.1756,90,90,120 troilite - 4.84 X 23696
Fe-S FeS2 ht FeS2,cP12,205 Pa-3 0.54281,0.54281,0.54281,90,90,90 pyrite gray dark 4.98 X 9502
Fe-S FeS2 lt pyr FeS2,oP12,29 Pca21 0.5418,0.5418,0.5418,90,90,90 - - 5.01 X 22124
Fe-S FeS2 rt FeS2,oP6,58 Pnnm 0.4432,0.54246,0.33872,90,90,90 marcasite - 4.89 X 7220
Fe-S Fe0.91 S 5.5C Fe0.91 S,oS8,63 Cmcm 0.3446,0.5976,0.5744,90,90,90 pyrrhotite 5.5C - 4.65 X 14825
Fe-S Fe11S12 6C Fe11S12,mS96,9 C1c1 0.68973,1.1954,1.76015,90,101.296,90 pyrrhotite 6C - 4.66 X 53780
Fe-S Fe2S3 hp mon *,mS80,15 C12/c1 0.711,1.13,1.0697,90,104.19,90 - - - N 2993
Fe-S Fe2S3 hp tet *,tP80,94 P42212 1.083,1.083,1.001,90,90,90 - - - N 4783
Fe-S Fe3S tf Fe3C-b,oP16,62 Pnma 0.509,0.67,0.456,90,90,90 - - 8.53 A 10082
Fe-S Fe3S4 ht gre Fe3O4,cF56,227 Fd-3m 0.9876,0.9876,0.9876,90,90,90 greigite black 4.08 X 2135
Fe-S Fe3S4 smy Fe3S4,hR21,166 R-3m 0.347,0.347,3.45,90,90,120 smythite black jet 4.10 X 867
Fe-S Fe7S8 3C Fe7Se8,hP45,152 P3121 0.68652,0.68652,1.7046,90,90,120 pyrrhotite 3C - 4.64 X 12214
Fe-S Fe7S8 4C-h *,hP60,* - 0.688,0.688,2.29,90,90,120 pyrrhotite 4C-h - - N 4434
Fe-S Fe7S8 4C-m Fe7S8,mS60,15 C12/c1 1.1902,0.6859,1.2814,90,117.24,90 pyrrhotite 4C-m - 4.62 X 6525
Fe-S Fe9S10 5C Fe9S10,mP80,4 P1211 0.68915,2.8695,0.68984,90,119.956,90 pyrrhotite 5C-m black 4.63 X 57731
Fe-Sb FeSb2 hp CuAl2,tI12,140 I4/mcm 0.68441,0.68441,0.52563,90,90,90 - - 8.08 X 59185
Fe-Sb FeSb2 FeAs2,oP6,58 Pnnm 0.5823,0.6523,0.3194,90,90,90 seinäjokite - 8.19 X 37387
Fe-Sb FeSb3 tf CoAs3,cI32,204 Im-3 0.92383,0.92383,0.92383,90,90,90 - - 7.10 X 57185
Fe-Sb Fe0.95 Sb0.05 rt W,cI2,229 Im-3m 0.29,0.29,0.29,90,90,90 b.c.c. family - 8.05 X 8471
Fe-Sb Fe1.14 Sb Co1.75 Ge,hP6,194 P63 /mmc 0.407,0.407,0.513,90,90,120 AlB2 family - 8.37 X 18421
Fe-Sc ScFe1.8 ht2 Sc+ MgCu2,cF24,227 Fd-3m 0.706,0.706,0.706,90,90,90 Friauf-Laves phase - 5.49 X 17010
Fe-Sc ScFe2 rt MgZn2,hP12,194 P63 /mmc 0.492,0.492,0.79,90,90,120 Friauf-Laves phase - 6.28 X 3729
Fe-Sc Sc0.95 Fe2.05 ht1 MgNi2,hP24,194 P63 /mmc 0.4975,0.4975,1.6318,90,90,120 Friauf-Laves phase - 5.97 A 19444
Fe-Sc Sc29Fe6 rt Sc29Fe6,cP140,200 Pm-3 1.4361,1.4361,1.4361,90,90,90 - - 3.68 X 18927
Fe-Se FeSe hp1 NiAs,hP4,194 P63 /mmc 0.35839,0.35839,0.58302,90,90,120 AlB2 family - 6.90 X 54821
Fe-Se FeSe hp2 FeAs,oP8,62 Pnma 0.5281,0.3538,0.5346,90,90,90 AlB2 family - 8.96 X 54821
Fe-Se FeSe ht NiAs,hP4,194 P63 /mmc 0.36161,0.36161,0.58888,90,90,120 achavalite black 6.71 X 58136
Fe-Se FeSe rt PbO,tP4,129 P4/nmm 0.3779,0.3779,0.55111,90,90,90 - black 5.69 X 58363
Fe-Se FeSe tf cub *,c**,* - 0.537,0.537,0.537,90,90,90 - - - N 8693
Fe-Se FeSe tf hex NiAs,hP4,194 P63 /mmc 0.4,0.4,0.588,90,90,120 AlB2 family - 5.50 X 8693
Fe-Se FeSe tf tet CuAu,tP2,123 P4/mmm 0.296,0.296,0.473,90,90,90 close-packed structure - 5.40 X 8693
Fe-Se FeSe0.98 lt PbO,oS8,67 Cmme 0.53093,0.53343,0.54879,90,90,90 - - 5.69 X 55171
Fe-Se FeSe2 hp FeS2,cP12,205 Pa-3 0.57859,0.57859,0.57859,90,90,90 dzarkenite - 7.33 A 4031
Fe-Se FeSe2 rt FeS2,oP6,58 Pnnm 0.4804,0.5784,0.3586,90,90,90 ferroselite - 7.13 X 9183
Fe-Se FeSex rt W,cI2,229 Im-3m 0.28458,0.28458,0.28458,90,90,90 b.c.c. family - 8.05 X 54807
Fe-Se Fe3Se4 rt Cr3S4,mS14,12 C12/m1 1.26404,0.3534,0.6172,90,117.706,90 - - 6.58 X 3886
Fe-Se Fe7Se8 ht Fe7Se8,hP45,152 P3121 0.72613,0.72613,1.7675,90,90,120 - - 6.31 X 12070
Fe-Se Fe7Se8 rt *,aP120,* - 0.7236,1.253,2.354,90.6,90.2,90. - - - N 1469
Fe-Si FeSi ht CsCl,cP2,221 Pm-3m 0.26238,0.26238,0.26238,90,90,90 b.c.c. family - 7.72 X 48302
Fe-Si FeSi FeSi,cP8,198 P213 0.4495,0.4495,0.4495,90,90,90 naquite gray dark 6.14 X 33924
Fe-Si FeSi2 ht Fe0.92 Si2,tP3,123 P4/mmm 0.2696,0.2696,0.5147,90,90,90 linzhiite gray steel 4.97 X 58108
Fe-Si FeSi2 rt FeSi2,oS48,64 Cmce 0.98362,0.78301,0.78655,90,90,90 luobusaite - 4.91 X 49150
Fe-Si Fe0.75 Si0.25 m W,cI2,229 Im-3m 0.28527,0.28527,0.28527,90,90,90 b.c.c. family - 7.00 X 50838
Fe-Si Fe0.933 Si0.067 rt W,cI2,229 Im-3m 0.28618,0.28618,0.28618,90,90,90 suessite white 7.65 X 21712
Fe-Si Fe11Si5 Fe11Si5,cP16,221 Pm-3m 0.56264,0.56264,0.56264,90,90,90 - - 7.04 X 185
Fe-Si Fe2Si ht Ni2Al,hP6,164 P-3m1 0.4052,0.4052,0.50855,90,90,120 b.c.c. family - 6.42 X 11080
Fe-Si Fe3Si BiF3,cF16,225 Fm-3m 0.5665,0.5665,0.5665,90,90,90 gupeiite - 7.15 X 42337
Fe-Si Fe5Si3 ht Mn5Si3,hP16,193 P63 /mcm 0.67108,0.67108,0.4688,90,90,120 xifengite gray 6.60 X 43885
Fe-Sm SmFe12 ThMn12,tI26,139 I4/mmm 0.8589,0.8589,0.4807,90,90,90 CaCu5-Zr4Al3 - 7.69 A 27584
Fe-Sm SmFe2 MgCu2,cF24,227 Fd-3m 0.7436,0.7436,0.7436,90,90,90 Friauf-Laves phase - 8.47 X 28866
Fe-Sm SmFe3 PuNi3,hR36,166 R-3m 0.518,0.518,2.4789,90,90,120 Laves-CaCu5 - 8.25 A 27387
Fe-Sm SmFe5 tf CaCu5,hP6,191 P6/mmm 0.496,0.496,0.413,90,90,120 - - 8.11 X 21403
Fe-Sm Sm0.6 Fe5.8 ht Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4918,0.4918,0.419,90,90,120 CaCu5-Zr4Al3 - 7.84 A 24794
Handbook of Inorganic Substances – Edition 2015 : Data 91

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Fe-Sm Sm2 Fe17 Zn17 Th2,hR57,166 R-3m 0.8558,0.8558,1.2447,90,90,120 CaCu5-Zr4Al3 - 7.89 X 43655
Fe-Sm Sm2 Fe7 tf Gd2Co 7,hR54,166 R-3m 0.505,0.505,3.84,90,90,120 Laves-CaCu5 - 8.13 A 21403
Fe-Sm Sm5 Fe17 Nd5Fe17,hP264,193 P63/mcm 2.052,2.052,1.229,90,90,120 - - 7.57 A 52454
Fe-Sm Sm6 Fe23 stab Th6Mn23,cF116,225 Fm-3m 1.223,1.223,1.223,90,90,90 - - 7.94 X 13400
Fe-Sn FeSn CoSn,hP6,191 P6/mmm 0.53002,0.53002,0.44504,90,90,120 AlB2 family - 8.03 X 38622
Fe-Sn FeSn2 rt CuAl2,tI12,140 I4/mcm 0.6545,0.6545,0.5326,90,90,90 - gray silver 8.54 X 53903
Fe-Sn Fe0.92 Sn0.08 rt W,cI2,229 Im-3m 0.2924,0.2924,0.2924,90,90,90 b.c.c. family - 8.09 X 46680
Fe-Sn Fe1.5 Sn0.5 m CsCl,cP2,221 Pm-3m 0.2989,0.2989,0.2989,90,90,90 b.c.c. family - 8.90 X 15496
Fe-Sn Fe1.67 Sn ht Co1.75 Ge,hP6,194 P63/mmc 0.4225,0.4225,0.5241,90,90,120 AlB2 family - 8.69 X 46680
Fe-Sn Fe3Sn hp-ht Cu3Au,cP4,221 Pm-3m 0.3873,0.3873,0.3873,90,90,90 close-packed structure - 8.18 X 17351
Fe-Sn Fe3Sn ht Mg3 Cd,hP8,194 P63/mmc 0.5464,0.5464,0.4352,90,90,120 close-packed structure - 8.45 X 46680
Fe-Sn Fe3Sn2 ht Fe3Sn2,hR30,166 R-3m 0.5344,0.5344,1.9845,90,90,120 - - 8.22 X 9534
Fe-Ta Ta0.004 Fe0.996 rt W,cI2,229 Im-3m 0.28687,0.28687,0.28687,90,90,90 b.c.c. family - 7.93 X 3264
Fe-Ta Ta0.65 Fe0.35 m *,tP*,* - 0.83,0.83,0.485,90,90,90 - - - N 35885
Fe-Ta Ta0.9 Fe2.1 MgZn2,hP12,194 P63/mmc 0.48,0.48,0.784,90,90,120 Friauf-Laves phase - 11.89 A 6641
Fe-Ta Ta6.5 Fe6.5 W6Fe7,hR39,166 R-3m 0.4919,0.4919,2.7,90,90,120 Frank-Kasper phase - 13.55 X 4250
Fe-Tb TbFe 2 hp-ht MgZn2,hP12,194 P63/mmc 0.527,0.527,0.864,90,90,120 Friauf-Laves phase - 8.65 A 18072
Fe-Tb TbFe 2 lt TbFe 2,hR18,166 R-3m 0.5177,0.5177,1.279,90,90,120 Friauf-Laves phase - 9.08 X 7985
Fe-Tb TbFe 2 rt MgCu2,cF24,227 Fd-3m 0.7346,0.7346,0.7346,90,90,90 Friauf-Laves phase - 9.07 X 28885
Fe-Tb TbFe 3 PuNi3,hR36,166 R-3m 0.515,0.515,2.457,90,90,120 Laves-CaCu5 - 8.65 X 12401
Fe-Tb Tb2Fe 17 ht Th2Ni17,hP38,194 P63/mmc 0.848,0.848,0.8324,90,90,120 CaCu5-Zr4Al3 - 8.12 A 38848
Fe-Tb Tb2Fe 17 rt Zn17 Th2,hR57,166 R-3m 0.85152,0.85152,1.24079,90,90,120 CaCu5-Zr4Al3 - 8.10 X 46576
Fe-Tb Tb6Fe 23 Th6Mn23,cF116,225 Fm-3m 1.207,1.207,1.207,90,90,90 - - 8.45 A 2809
Fe-Tc Tc0.6 Fe0.4 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.913,0.913,0.4788,90,90,90 Frank-Kasper phase - 10.13 A 1682
Fe-Te FeTe 2 hp FeS2 ,cP12,205 Pa-3 0.62937,0.62937,0.62937,90,90,90 pyrite-marcasite family - 8.29 A 4031
Fe-Te FeTe 2 FeS2 ,oP6,58 Pnnm 0.5268,0.6273,0.3879,90,90,90 frohbergite - 8.06 X 19427
Fe-Te Fe0.67 Te ht NiAs,hP4,194 P63/mmc 0.3818,0.3818,0.5651,90,90,120 AlB2 family - 7.68 X 8422
Fe-Te Fe0.75 Te ht *,mS*,* - 0.386,0.666,0.564,90,90.2,90 - - - N 8422
Fe-Te Fe1.08 Te hp Cu1.43 Te,oP6,59 Pmmn 0.37506,0.37746,0.61757,90,90,90 - - 7.14 X 59273
Fe-Te Fe1.08 Te lt Fe1.068 Te,mP6,11 P121/m1 0.38337,0.37893,0.62594,90,90.661,90 - - 6.86 X 59273
Fe-Te Fe1.119 Te rt Cu2Sb,tP6,129 P4/nmm 0.38197,0.38197,0.62587,90,90,90 - black 6.91 X 54426
Fe-Te Fe2.2 Te2 ht (Fe0.5 Ni0.5)3Te2,hR24,166 R-3m 0.4013,0.4013,2.096,90,90,120 - - 6.44 A 7880
Fe-Th ThFe 3 PuNi3,hR36,166 R-3m 0.518,0.518,2.52,90,90,120 Laves-CaCu5 - 10.20 X 2475
Fe-Th ThFe 5 CaCu5,hP6,191 P6/mmm 0.51113,0.51113,0.40522,90,90,120 - - 9.26 X 8502
Fe-Th Th2Fe 17 Zn17 Th2,hR57,166 R-3m 0.8578,0.8578,1.2476,90,90,120 CaCu5-Zr4Al3 - 8.86 X 26139
Fe-Th Th2Fe 7 ht Gd2Co 7,hR54,166 R-3m 0.5195,0.5195,3.7133,90,90,120 Laves-CaCu5 - 9.82 A 22422
Fe-Th Th2Fe 7 rt Ce2Ni7,hP36,194 P63/mmc 0.5193,0.5193,2.4785,90,90,120 Laves-CaCu5 - 9.81 X 6006
Fe-Th Th7Fe 3 Th7Fe3,hP20,186 P63mc 0.985,0.985,0.615,90,90,120 - - 11.52 X 440
Fe-Ti TiFe rt CsCl,cP2,221 Pm-3m 0.29789,0.29789,0.29789,90,90,90 b.c.c. family - 6.52 X 22320
Fe-Ti TiFe 2 MgZn2,hP12,194 P63/mmc 0.47929,0.47929,0.78234,90,90,120 Friauf-Laves phase - 6.81 X 46393
Fe-Ti Ti0.2 Fe0.8 rt W,cI2,229 Im-3m 0.293,0.293,0.293,90,90,90 b.c.c. family - 7.16 X 19483
Fe-Ti Ti0.75 Fe0.25 ht W,cI2,229 Im-3m 0.314,0.314,0.314,90,90,90 b.c.c. family - 5.35 X 19483
Fe-Ti Ti2Fe stab Ti2Ni,cF96,227 Fd-3m 1.1328,1.1328,1.1328,90,90,90 - - 5.54 A 3544
Fe-Tm TmFe 2 hp MgZn2,hP12,194 P63/mmc 0.529,0.529,0.854,90,90,120 Friauf-Laves phase - 9.01 A 18072
Fe-Tm TmFe 2 rt MgCu2,cF24,227 Fd-3m 0.725,0.725,0.725,90,90,90 Friauf-Laves phase - 9.78 X 19465
Fe-Tm TmFe 3 PuNi3,hR36,166 R-3m 0.5063,0.5063,2.4621,90,90,120 Laves-CaCu5 - 9.20 A 16228
Fe-Tm Tm2 Fe17 Y2Fe17,hP56,194 P63/mmc 0.8423,0.8423,0.82776,90,90,120 CaCu5-Zr4Al3 - 8.41 X 59025
Fe-Tm Tm6 Fe23 Th6Mn23,cF116,225 Fm-3m 1.198,1.198,1.198,90,90,90 - - 8.88 A 2809
Fe-U UFe 2 rt MgCu2,cF24,227 Fd-3m 0.75055,0.75055,0.75055,90,90,90 Friauf-Laves phase - 10.99 X 22453
Fe-U U6Fe U6Mn,tI28,140 I4/mcm 1.03022,1.03022,0.52386,90,90,90 - - 17.73 X 18417
Fe-V VFe ht CsCl,cP2,221 Pm-3m 0.291,0.291,0.291,90,90,90 b.c.c. family - 7.20 X 12485
Fe-V V0.015 Fe0.985 ht Cu,cF4,225 Fm-3m 0.36543,0.36543,0.36543,90,90,90 close-packed structure - 7.59 X 2390
Fe-V V0.45 Fe0.55 ht W,cI2,229 Im-3m 0.2911,0.2911,0.2911,90,90,90 b.c.c. family - 7.22 X 18426
Fe-V V0.62 Fe0.38 rt (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.8996,0.8996,0.454,90,90,90 Frank-Kasper phase - 7.16 A 51446
Fe-W WFe 2 rt MgZn2,hP12,194 P63/mmc 0.4743,0.4743,0.7604,90,90,120 Friauf-Laves phase - 13.25 A 21373
Fe-W W0.2 Fe0.8 tf W,cI2,229 Im-3m 0.2948,0.2948,0.2948,90,90,90 b.c.c. family - 10.56 X 23467
Fe-W W0.7 Fe0.3 rt W,cI2,229 Im-3m 0.316,0.316,0.316,90,90,90 b.c.c. family - 15.31 X 23467
Fe-W W6Fe 7 rt W6Fe7,hR39,166 R-3m 0.47463,0.47463,2.5781,90,90,120 Frank-Kasper phase - 14.80 X 94
Fe-Y YFe 2 MgCu2,cF24,227 Fd-3m 0.7356,0.7356,0.7356,90,90,90 Friauf-Laves phase - 6.70 X 45018
Fe-Y YFe 3 hex CeNi3,hP24,194 P63/mmc 0.513,0.513,1.643,90,90,120 Laves-CaCu5 - 6.82 A 19099
Fe-Y YFe 3 rhom PuNi3,hR36,166 R-3m 0.5095,0.5095,2.439,90,90,120 Laves-CaCu5 - 6.99 A 59145
Fe-Y YFe 5 CaCu5,hP6,191 P6/mmm 0.487,0.487,0.406,90,90,120 - - 7.33 X 1291
Fe-Y YFe x rt Mg,hP2,194 P63/mmc 0.3659,0.3659,0.5791,90,90,120 close-packed structure - 4.40 X 38942
Fe-Y Y2Fe 17 ht Th2Ni17,hP38,194 P63/mmc 0.84688,0.84688,0.8305,90,90,120 CaCu5-Zr4Al3 - 7.26 X 30829
Fe-Y Y2Fe 17 rt Zn17 Th2,hR57,166 R-3m 0.85014,0.85014,1.23989,90,90,120 CaCu5-Zr4Al3 - 7.24 X 30829
Fe-Y Y6Fe 23 rt Th6Mn23,cF116,225 Fm-3m 1.2055,1.2055,1.2055,90,90,90 - - 6.89 X 16175
Fe-Yb YbFe 2 hp-ht MgCu2,cF24,227 Fd-3m 0.7231,0.7231,0.7231,90,90,90 Friauf-Laves phase - 10.00 X 18072
Fe-Yb Yb1.25 Fe1.75 hp-ht MgZn2,hP12,194 P63/mmc 0.5272,0.5272,0.8487,90,90,120 Friauf-Laves phase - 10.21 X 18072
Fe-Yb Yb1.79 Fe17.43 Y2Fe17,hP56,194 P63/mmc 0.85965,0.85965,0.83871,90,90,120 CaCu5-Zr4Al3 black 7.94 X 42766
Fe-Yb Yb6Fe 23 Th6Mn23,cF116,225 Fm-3m 1.2028,1.2028,1.2028,90,90,90 - - 8.87 A 44765
Fe-Zn Zn0.1 Fe0.9 rt W,cI2,229 Im-3m 0.2888,0.2888,0.2888,90,90,90 b.c.c. family - 7.83 X 30489
Fe-Zn Zn10 Fe Zn10 Fe,hP632,194 P63/mmc 1.2787,1.2787,5.7222,90,90,120 - white silver7.27 X 37639
Fe-Zn Zn13 Fe Zn13 Co,mS28,12 C12/m1 1.08557,0.7598,0.5066,90,100.769,90 - gray silver 7.33 X 36834
Fe-Zn Zn40 Fe11 rt Zn38 (Zn0.33 Fe0.67 )6Fe7,cF408,216 F-43m 1.7963,1.7963,1.7963,90,90,90 - - 7.40 X 13993
Fe-Zn Zn9.75 Fe3.25 Zn9(Zn0.5 Fe0.5)2Fe2,cI52,217 I-43m 0.8994,0.8994,0.8994,90,90,90 γ-brass blackish 7.48 X 37639
Fe-Zr ZrFe 2 Fe+ MgNi2,hP24,194 P63/mmc 0.4954,0.4954,1.6304,90,90,120 Friauf-Laves phase - 7.78 A 4168
Fe-Zr ZrFe 2 hex MgZn2,hP12,194 P63/mmc 0.5134,0.5134,0.8448,90,90,120 Friauf-Laves phase - 6.99 A 17564
Fe-Zr ZrFe 2 rt MgCu2,cF24,227 Fd-3m 0.7063,0.7063,0.7063,90,90,90 Friauf-Laves phase - 7.65 X 26217
92 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Fe-Zr Zr0.001 Fe0.999 rt W,cI2,229 Im-3m 0.28673,0.28673,0.28673,90,90,90 b.c.c. family - 7.87 X 3264
Fe-Zr Zr2Fe ht CuAl2,tI12,140 I4/mcm 0.6385,0.6385,0.5596,90,90,90 - - 6.94 X 6743
Fe-Zr Zr2Fe stab Ti2Ni,cF96,227 Fd-3m 1.214,1.214,1.214,90,90,90 - - 7.08 X 3112
Fe-Zr Zr3Fe rt Re3B,oS16,63 Cmcm 0.3321,1.0966,0.8825,90,90,90 - - 6.81 X 23829
Fe-Zr Zr4Fe m hex *,hP*,* - 0.5045,0.5045,0.3121,90,90,120 - - - N 14271
Fe-Zr Zr4Fe m orth *,o**,* - 0.3283,0.3553,0.6867,90,90,90 - - - N 14271
Fe-Zr Zr6Fe23 Th6Mn23,cF116,225 Fm-3m 1.169,1.169,1.169,90,90,90 - - 7.62 X 2773
Ga-Gd GdGa TlI,oS8,63 Cmcm 0.43388,1.10104,0.41058,90,90,90 CrB(TlI)-FeB - 7.69 X 52433
Ga-Gd GdGa2 hp Hg2U,hP3,191 P6/mmm 0.42105,0.42105,0.34044,90,90,120 AlB2 family - 9.43 X 39576
Ga-Gd GdGa2 AlB2,hP3,191 P6/mmm 0.42298,0.42298,0.41369,90,90,120 AlB2 family - 7.69 X 39576
Ga-Gd GdGa6 PuGa6,tP14,125 P4/nbm 0.595,0.595,0.757,90,90,90 - - 7.13 A 19105
Ga-Gd Gd3Ga2 Gd3Ga2,tI80,140 I4/mcm 1.1666,1.1666,1.5061,90,90,90 - - 7.92 X 19061
Ga-Gd Gd5Ga3 Ba5Si3,tP32,130 P4/ncc 0.7716,0.7716,1.4223,90,90,90 - black 7.81 X 28801
Ga-Ge Ga0.0125 Ge 0.9875 C,cF8,227 Fd-3m 0.5658,0.5658,0.5658,90,90,90 - - 5.32 X 706
Ga-Hf HfGa ThIn,oP24,57 Pbcm 0.9171,0.8503,0.5648,90,90,90 - - 11.23 X 18930
Ga-Hf HfGa2 rt HfGa2,tI24,141 I41/amd 0.4046,0.4046,2.5446,90,90,90 close-packed structure blue dark 10.14 X 1784
Ga-Hf HfGa3 TiAl3,tI8,139 I4/mmm 0.38779,0.38779,0.90166,90,90,90 close-packed structure - 9.50 X 55913
Ga-Hf Hf11Ga10 Ho11Ge10,tI84,139 I4/mmm 1.0282,1.0282,1.473,90,90,90 - - 11.35 X 22844
Ga-Hf Hf2Ga rt CuAl2,tI12,140 I4/mcm 0.66815,0.66815,0.5363,90,90,90 - - 11.84 A 55913
Ga-Hf Hf2Ga3 Zr2Al3,oF40,43 Fdd2 0.9402,1.363,0.5472,90,90,90 - - 10.73 X 1784
Ga-Hf Hf5Ga3 Mn5Si3,hP16,193 P63 /mcm 0.7962,0.7962,0.5677,90,90,120 - - 11.74 X 1962
Ga-Ho HoGa TlI,oS8,63 Cmcm 0.42779,1.07595,0.40353,90,90,90 CrB(TlI)-FeB - 8.39 X 58822
Ga-Ho HoGa2 hp Cd2Ce,hP3,164 P-3m1 0.42496,0.42496,0.34547,90,90,120 AlB2 family gray silver 9.35 X 34473
Ga-Ho HoGa2 AlB2,hP3,191 P6/mmm 0.4192,0.4192,0.4044,90,90,120 AlB2 family - 8.21 X 18364
Ga-Ho HoGa3 ht2 HoAl3,hR60,166 R-3m 0.6078,0.6078,3.5295,90,90,120 close-packed structure - 8.25 X 14252
Ga-Ho HoGa3 ht3 PuAl3,hP24,194 P63 /mmc 0.6084,0.6084,1.4061,90,90,120 close-packed structure - 8.27 X 14281
Ga-Ho HoGa3 ht4 Cu3Au,cP4,221 Pm-3m 0.4226,0.4226,0.4226,90,90,90 close-packed structure - 8.23 X 15455
Ga-Ho HoGa3 rt TiNi3,hP16,194 P63 /mmc 0.6082,0.6082,0.9417,90,90,120 close-packed structure - 8.24 A 14252
Ga-Ho HoGa6 PuGa6,tP14,125 P4/nbm 0.592,0.592,0.755,90,90,90 - - 7.32 A 19105
Ga-Ho Ho3Ga2 Gd3Ga2,tI80,140 I4/mcm 1.15,1.15,1.4766,90,90,90 - - 8.63 A 56487
Ga-Ho Ho3Ga5 Tm3Ga5,oP32,62 Pnma 1.13755,0.96227,0.6061,90,90,90 - - 8.44 X 57369
Ga-Ho Ho5Ga3 ht Mn5Si3,hP16,193 P63 /mcm 0.8506,0.8506,0.6385,90,90,120 - - 8.58 X 4602
Ga-Ho Ho5Ga3 rt Ba5Si3,tP32,130 P4/ncc 0.75856,0.75856,1.4001,90,90,90 - - 8.52 A 28801
Ga-I GaI2 GaI2,hR108,161 R3c 2.5215,2.5215,0.7839,90,90,120 - yellow 4.48 X 15634
Ga-I GaI3 InI3,mP16,14 P121/c1 0.9584,0.6084,1.1839,90,107.78,90 - - 4.55 X 44054
Ga-I Ga2I3 Ga2I3,mP20,14 P121/c1 0.7603,0.8715,1.3453,90,122.94,90 - yellow 4.62 X 15634
Ga-In Ga0.0182 In0.9818 In,tI2,139 I4/mmm 0.3244,0.3244,0.4936,90,90,90 close-packed structure - 7.29 X 9052
Ga-In Ga0.90 In0.10 m (Ga0.90 In0.10),oS4,63 Cmcm 0.2770,0.8183,0.3306,90,90,90 - - 6.58 X 12552
Ga-Ir IrGa CsCl,cP2,221 Pm-3m 0.3004,0.3004,0.3004,90,90,90 b.c.c. family - 16.05 X 1971
Ga-Ir IrGa2 IrGa2,oS36,63 Cmcm 0.39021,1.29925,1.08808,90,90,90 - - 11.98 X 43876
Ga-Ir IrGa3 ht IrIn3,tP16,136 P42 /mnm 0.641,0.641,0.66,90,90,90 - - 9.83 A 1167
Ga-Ir Ir2Ga9 Rh2Ga9,mP22,7 P1c1 0.64329,0.64099,0.88068,90,93.464,90 - gray 9.27 X 45740
Ga-Ir Ir3Ga5 Ir3Ga5,tP32,118 P-4n2 0.5823,0.5823,1.42,90,90,90 chimney-ladder structure - 12.76 X 3658
Ga-K KGa3 RbGa3,tI24,119 I-4m2 0.6268,0.6268,1.4782,90,90,90 - - 4.26 X 16579
Ga-K K2Ga3 Rb2In3,tI20,139 I4/mmm 0.61382,0.61382,1.4815,90,90,90 - - 3.42 X 35756
Ga-K K3Ga13 K3Ga13,oS128,63 Cmcm 0.6441,1.6143,2.8404,90,90,90 - - 4.60 X 12955
Ga-La LaGa TlI,oS8,63 Cmcm 0.45134,1.156,0.42476,90,90,90 CrB(TlI)-FeB gray silver 6.25 X 57496
Ga-La LaGa2 hp *,o**,* - 0.509,0.528,1.279,90,90,90 - - - N 57101
Ga-La LaGa2 AlB2,hP3,191 P6/mmm 0.43092,0.43092,0.44251,90,90,120 AlB2 family gray 6.50 X 39645
Ga-La LaGa4 rt LaGa4,oP20,47 Pmmm 0.4403,0.7542,1.3015,90,90,90 - - 6.42 X 31699
Ga-La LaGa6 rt PuGa6,tP14,125 P4/nbm 0.61041,0.61041,0.77052,90,90,90 - - 6.45 X 16633
Ga-La La3Ga Cu3Au,cP4,221 Pm-3m 0.561,0.561,0.561,90,90,90 close-packed structure - 4.58 X 27429
Ga-La La5Ga3 Ba5Si3,tP32,130 P4/ncc 0.8068,0.8068,1.4756,90,90,90 - black 6.25 X 28801
Ga-Li Li0.892 Ga1.108 lt *,t*16,* - 0.6132,0.6132,0.6146,90,90,90 - - 2.40 N 44057
Ga-Li Li0.892 Ga1.108 rt NaTl,cF16,227 Fd-3m 0.6168,0.6168,0.6168,90,90,90 b.c.c. family - 4.72 X 44057
Ga-Li Li1.5 Ga7 rt Li2Ga7,hR60,166 R-3m 0.8461,0.8461,1.6845,90,90,120 - - 4.76 X 15547
Ga-Li Li2Ga Li2Ga,oS12,63 Cmcm 0.4562,0.9542,0.4364,90,90,90 b.c.c. family gray 2.92 X 11117
Ga-Li Li3Ga2 rt Li3Al2,hR15,166 R-3m 0.4367,0.4367,1.3896,90,90,120 b.c.c. family gray 3.48 X 11117
Ga-Li Li4Ga13.67 Li4Ga13.67 ,oS304,63 Cmcm 1.3860,3.0519,1.3729,90,90,90 - - 4.49 X 17469
Ga-Li Li5Ga4 rt Li5Ga4,hP9,164 P-3m1 0.4375,0.4375,0.8257,90,90,120 b.c.c. family - 3.80 X 14686
Ga-Lu LuGa TlI,oS8,63 Cmcm 0.4209,1.05817,0.40001,90,90,90 CrB(TlI)-FeB - 9.12 A 3391
Ga-Lu LuGa2 KHg2,oI12,74 Imma 0.4185,0.685,0.8044,90,90,90 AlB2 family - 9.06 A 16518
Ga-Lu LuGa3 Cu3Au,cP4,221 Pm-3m 0.419,0.419,0.419,90,90,90 close-packed structure - 8.67 X 59239
Ga-Lu Lu3Ga2 Gd3Ga2,tI80,140 I4/mcm 1.1211,1.1211,1.438,90,90,90 - - 9.77 A 19061
Ga-Lu Lu3Ga5 Tm3Ga5,oP32,62 Pnma 1.124,0.9515,0.596,90,90,90 - - 9.10 A 16150
Ga-Lu Lu5Ga3 Y5Ga3,mS32,12 C12/m1 0.84021,1.4553,0.62811,90,91.11,90 - - 9.38 A 38645
Ga-Mg MgGa MgGa,tI32,88 I41/a 1.053,1.053,0.553,90,90,90 - - 4.07 X 2041
Ga-Mg MgGa2 m CaIn2,hP6,194 P63 /mmc 0.4343,0.4343,0.6982,90,90,120 AlB2 family - 4.77 X 13780
Ga-Mg MgGa2 MgGa2,oP24,55 Pbam 0.6802,1.6346,0.4111,90,90,90 - - 4.76 X 4425
Ga-Mg Mg0.72 Ga0.28 m *,oP128,28 Pma2 1.1406,1.4057,1.6214,90,90,90 - - - N 12428
Ga-Mg Mg0.81 Ga0.19 Mg,hP2,194 P63 /mmc 0.3191,0.3191,0.51827,90,90,120 close-packed structure - 2.40 X 12428
Ga-Mg Mg2Ga Mg2Ga,hP18,190 P-62c 0.7794,0.7794,0.6893,90,90,120 Fe2P family - 3.25 X 5313
Ga-Mg Mg2Ga5 Mg2Ga5,tI28,139 I4/mmm 0.8627,0.8627,0.7111,90,90,90 - - 4.99 X 4426
Ga-Mg Mg5Ga2 Mg5Ga2,oI28,72 Ibam 0.7017,1.3708,0.6020,90,90,90 - - 2.99 X 2041
Ga-Mn MnGa rt MnGa,hR78,166 R-3m 1.2605,1.2605,0.80424,90,90,120 - - 7.30 X 41919
Ga-Mn MnGa4 Hg4Pt,cI10,229 Im-3m 0.55941,0.55941,0.55941,90,90,90 - - 6.33 X 58185
Ga-Mn MnGa4.96 ht MnGa4.96 ,tP40,128 P4/mnc 0.63395,0.63395,1.00275,90,90,90 - - 6.61 X 58185
Ga-Mn MnGa6 lt *,oS*,66 Cccm 0.8814,0.8949,0.9944,90,90,90 - - - N 2767
Handbook of Inorganic Substances – Edition 2015 : Data 93

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ga-Mn Mn0.72 Ga0.28 ht Mg,hP2,194 P63/mmc 0.2707,0.2707,0.4333,90,90,120 close-packed structure - 7.14 X 16223
Ga-Mn Mn0.8 Ga0.2 ht3 Cu,cF4,225 Fm-3m 0.377,0.377,0.377,90,90,90 close-packed structure - 7.18 X 6144
Ga-Mn Mn0.85 Ga0.15 ht1 Mn,cP20,213 P4132 0.6375,0.6375,0.6375,90,90,90 - - 7.33 A 2767
Ga-Mn Mn1.34 Ga0.66 rt CuAu,tP2,123 P4/mmm 0.2756,0.2756,0.3624,90,90,90 close-packed structure - 7.22 X 4829
Ga-Mn Mn1.6 Ga0.4 ht CuAu,tP2,123 P4/mmm 0.2687,0.2687,0.368,90,90,90 close-packed structure - 7.24 X 6144
Ga-Mn Mn12.7 Ga20.3 Mn8 (Mn0.59 Ga0.41)8Ga17,tP264,137 P42/nmc 1.2659,1.2659,2.4616,90,90,90 - - 7.12 X 37685
Ga-Mn Mn2 Ga5 rt Hg5Mn2,tP14,127 P4/mbm 0.8859,0.8859,0.27094,90,90,90 - - 7.16 X 50512
Ga-Mn Mn3 Ga ht Mg3 Cd,hP8,194 P63/mmc 0.54,0.54,0.4356,90,90,120 close-packed structure - 7.08 A 21438
Ga-Mn Mn3 Ga lt *,oS16,* - 0.5353,0.9403,0.4346,90,90,90 - - - N 16334
Ga-Mn Mn3 Ga rt TiAl3,tI8,139 I4/mmm 0.39042,0.39042,0.70882,90,90,90 close-packed structure - 7.21 X 48061
Ga-Mn Mn30.75 Ga34.25 Mn30.75 Ga34.25 ,mS276,15 C12/c1 2.0239,1.479,1.4908,90,120.93,90 - - 7.08 X 38759
Ga-Mn Mn6 Ga29 rt Mn6 Ga29,aP70,2 P-1 0.63047,0.99441,1.89013,90.382,90.766,90.356 - - 6.59 X 58185
Ga-Mn Mn9 Ga5 ht Cu9Al4,cP52,215 P-43m 0.9,0.9,0.9,90,90,90 γ-brass - 7.68 A 2860
Ga-Mo Mo3 Ga Cr3Si,cP8,223 Pm-3n 0.4944,0.4944,0.4944,90,90,90 Frank-Kasper phase - 9.83 X 7466
Ga-Mo Mo6 Ga31 rt Mo6 Ga31,mP148,14 P121/c1 0.9517,1.6067,1.6995,90,95.09,90 - - 7.02 X 8017
Ga-Mo Mo8 Ga41 (O) V8Ga41,hR147,148 R-3 1.404,1.404,1.505,90,90,120 - - 7.03 X 8727
Ga-N GaN hp NaCl,cF8,225 Fm-3m 0.4006,0.4006,0.4006,90,90,90 rocksalt family - 8.65 X 27959
Ga-N GaN rt ZnO,hP4,186 P63mc 0.31972,0.31972,0.5207,90,90,120 adamantane structure - 6.03 X 48775
Ga-Na NaGa4 BaAl4,tI10,139 I4/mmm 0.423,0.423,1.1272,90,90,90 - gray light 4.97 X 15748
Ga-Na Na22 Ga39 Na22 Ga39,oP244,62 Pnma 1.5585,1.4948,2.1632,90,90,90 - gray light 4.25 X 14846
Ga-Na Na7Ga13 Na7Ga13,hR360,166 R-3m 1.4965,1.4965,3.893,90,90,120 - gray light 4.23 X 15748
Ga-Nb NbGa2 (O) *,oP*,33 Pna21 0.5539,0.9054,0.3865,90,90,90 - - - N 13322
Ga-Nb NbGa3 rt TiAl3,tI8,139 I4/mmm 0.375,0.375,0.871,90,90,90 close-packed structure - 8.19 X 47352
Ga-Nb Nb0.82 Ga0.18 W,cI2,229 Im-3m 0.32905,0.32905,0.32905,90,90,90 b.c.c. family - 8.27 X 10754
Ga-Nb Nb3 Ga Cr3Si,cP8,223 Pm-3n 0.5165,0.5165,0.5165,90,90,90 Frank-Kasper phase - 8.40 X 11076
Ga-Nb Nb3 Ga2 U3Si2,tP10,127 P4/mbm 0.6922,0.6922,0.35,90,90,90 - - 8.28 X 2314
Ga-Nb Nb4 Ga5 *,tP*,* - 0.8381,0.8381,1.7081,90,90,90 - - - N 11602
Ga-Nb Nb5 Ga13 Nb5Ga13,oS36,65 Cmmm 0.3778,4.0335,0.3778,90,90,90 close-packed structure - 7.91 X 2858
Ga-Nb Nb5 Ga3 (O) Mn5 Si3,hP16,193 P63/mcm 0.7786,0.7786,0.533,90,90,120 - - 8.00 A 2748
Ga-Nb Nb5 Ga3 rt W5Si3,tI32,140 I4/mcm 1.0301,1.0301,0.506,90,90,90 - - 8.33 X 7254
Ga-Nb Nb5 Ga4 rt Ti5Ga4,hP18,193 P63/mcm 0.7962,0.7962,0.5447,90,90,120 AlB2 family - 8.26 X 7253
Ga-Nd NdGa TlI,oS8,63 Cmcm 0.44164,1.12758,0.41835,90,90,90 CrB(TlI)-FeB - 6.82 X 3391
Ga-Nd NdGa2 AlB2 ,hP3,191 P6/mmm 0.4247,0.4247,0.4247,90,90,120 AlB2 family - 7.10 X 28988
Ga-Nd NdGa6 rt PuGa6,tP14,125 P4/nbm 0.599,0.599,0.764,90,90,90 - - 6.82 A 19105
Ga-Nd Nd3 Ga Cu3Au,cP4,221 Pm-3m 0.543,0.543,0.543,90,90,90 close-packed structure - 5.21 X 10955
Ga-Nd Nd3 Ga2 Gd3Ga2,tI80,140 I4/mcm 1.1915,1.1915,1.534,90,90,90 - - 6.98 A 19061
Ga-Nd Nd5 Ga3 Cr5B3,tI32,140 I4/mcm 0.7881,0.7881,1.4395,90,90,90 - - 6.91 X 4089
Ga-Nd Nd9 Ga4 Sm9 Ga4,tI26,87 I4/m 1.2001,1.2001,0.5121,90,90,90 - - 7.10 A 18054
Ga-Ni NiGa CsCl,cP2,221 Pm-3m 0.2886,0.2886,0.2886,90,90,90 b.c.c. family - 8.87 X 22333
Ga-Ni NiGa5 PdGa5,tI24,140 I4/mcm 0.63128,0.63128,0.97217,90,90,90 - - 6.98 X 54243
Ga-Ni Ni0.92 Ga0.08 Cu,cF4,225 Fm-3m 0.3543,0.3543,0.3543,90,90,90 close-packed structure - 8.90 X 17833
Ga-Ni Ni0.97 Ga3.62 Ni0.97 Ga3.62 ,cI40,197 I23 0.84295,0.84295,0.84295,90,90,90 - - 6.86 X 16599
Ga-Ni Ni1.84 Ga ht Co1.75 Ge,hP6,194 P63/mmc 0.4002,0.4002,0.4988,90,90,120 AlB2 family - 8.53 X 9917
Ga-Ni Ni13 Ga9 rt Ni13 Ga9,mS44,12 C12/m1 0.9938,0.7894,0.8478,90,125.40,90 AlB2 family - 8.52 X 4715
Ga-Ni Ni2Ga3 Ni2Al3,hP5,164 P-3m1 0.405,0.405,0.489,90,90,120 - - 7.81 X 280
Ga-Ni Ni3Ga Cu3Au,cP4,221 Pm-3m 0.3585,0.3585,0.3585,90,90,90 close-packed structure - 8.86 X 22333
Ga-Ni Ni3Ga4 rt Ni3Ga4,cI112,230 Ia-3d 1.1411,1.1411,1.1411,90,90,90 - - 8.14 X 4718
Ga-Ni Ni3Ga7 Ru3Sn7,cI40,229 Im-3m 0.84285,0.84285,0.84285,90,90,90 - - 7.37 X 34195
Ga-Ni Ni5Ga3 rt Pt5Ga3,oS16,65 Cmmm 0.672,0.753,0.377,90,90,90 close-packed structure - 8.75 X 4696
Ga-Ni NixGa Ga,oS8,64 Cmce 0.4515,0.7635,0.4525,90,90,90 - - 5.94 A 54243
Ga-Np NpGa2 m AlB2 ,hP3,191 P6/mmm 0.4412,0.4412,0.3642,90,90,120 AlB2 family - 10.18 X 10080
Ga-Np NpGa2 AlB2 ,hP3,191 P6/mmm 0.4259,0.4259,0.4077,90,90,120 AlB2 family - 9.76 X 26601
Ga-Np NpGa3 Cu3Au,cP4,221 Pm-3m 0.42545,0.42545,0.42545,90,90,90 close-packed structure - 9.62 X 9880
Ga-O Ga2O3 hp1 Al2O3,hR30,167 R-3c 0.49825,0.49825,1.3433,90,90,120 - - 6.47 X 3601
Ga-O Ga2O3 hp2 Rh2S3,oP20,60 Pbcn 0.6942,0.4732,0.4855,90,90,90 - - 7.81 X 51229
Ga-O Ga2O3 hp3 *,oS20,63 Cmcm 0.252,0.8257,0.6223,90,90,90 - - 9.62 N 49371
Ga-O Ga2O3 ht Ga2O3,mS20,12 C12/m1 1.2214,0.30371,0.57981,90,103.83,90 - colorless 5.96 X 31325
Ga-O Ga2.67 O4 m Ga2.67 O4,cF104,227 Fd-3m 0.8238,0.8238,0.8238,90,90,90 spinel family - 5.94 X 44060
Ga-Os OsGa2 hp TiSi2,oF24,70 Fddd 0.474,0.8242,0.8747,90,90,90 - - 12.82 X 15173
Ga-Os OsGa3 hp *,o**,* - 0.5627,0.5662,1.536,90,90,90 - - - N 15173
Ga-Os OsGa3 IrIn3 ,tP16,136 P42/mnm 0.6488,0.6488,0.6748,90,90,90 - - 9.34 A 1167
Ga-P GaP orth hp ZnTe,oS8,63 Cmcm 0.4679,0.4933,0.4728,90,90,90 - - 6.13 X 49359
Ga-P GaP rt ZnS,cF8,216 F-43m 0.5448,0.5448,0.5448,90,90,90 adamantane structure - 4.14 X 32947
Ga-P GaP tf *,h**,* - 0.376,0.376,1.57,90,90,120 - - - N 3900
Ga-P Ga0.5 P0.5 hp Sn,tI4,141 I41/amd 0.472,0.472,0.2468,90,90,90 - - 6.08 X 15207
Ga-Pd PdGa rt FeSi,cP8,198 P213 0.48969,0.48969,0.48969,90,90,90 - gray 9.96 X 55570
Ga-Pd PdGa5 PdGa5,tI24,140 I4/mcm 0.6436,0.6436,0.999,90,90,90 - - 7.30 X 33930
Ga-Pd Pd0.85 Ga0.15 Cu,cF4,225 Fm-3m 0.3877,0.3877,0.3877,90,90,90 close-packed structure - 11.50 X 11627
Ga-Pd Pd1.12 Ga0.88 ht CsCl,cP2,221 Pm-3m 0.31283,0.31283,0.31283,90,90,90 b.c.c. family - 9.79 X 12000
Ga-Pd Pd13 Ga5 rt Pd13 Ga5,mS36,12 C12/m1 2.42599,0.40506,0.54437,90,102.69,90 - gray 11.02 X 38149
Ga-Pd Pd2Ga Co2Si-b,oP12,62 Pnma 0.54829,0.4056,0.77863,90,90,90 - gray 10.84 X 51624
Ga-Pd Pd5Ga2 rt Pd5Ga2,oP28,62 Pnma 0.5485,0.4083,1.8396,90,90,90 - - 10.83 X 8289
Ga-Pd Pd5Ga3 Rh5Ge3,oP16,55 Pbam 0.542,1.056,0.403,90,90,90 - - 10.67 X 996
Ga-Pd Pd7Ga3 rt Pd7Ga3,mS20,12 C12/m1 1.35946,0.40551,0.54434,90,105.222,90 - gray 10.94 X 38797
Ga-Pr PrGa TlI,oS8,63 Cmcm 0.446,1.1338,0.4199,90,90,90 CrB(TlI)-FeB - 6.59 X 5083
Ga-Pr PrGa2 AlB2 ,hP3,191 P6/mmm 0.4292,0.4292,0.4293,90,90,120 AlB2 family - 6.80 X 27577
Ga-Pr PrGa6 PuGa6,tP14,125 P4/nbm 0.6014,0.6014,0.7654,90,90,90 - - 6.71 A 18033
Ga-Pr Pr2Ga Co2Si-b,oP12,62 Pnma 0.669,0.5188,0.9714,90,90,90 - - 6.93 X 12452
94 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ga-Pr Pr3Ga Cu3Au,cP4,221 Pm-3m 0.551,0.551,0.551,90,90,90 close-packed structure - 4.89 X 12438


Ga-Pr Pr5Ga3 tet1 W5Si3,tI32,140 I4/mcm 1.248,1.248,0.5488,90,90,90 - - 7.10 A 4014
Ga-Pr Pr5Ga3 tet2 Ba5Si3,tP32,130 P4/ncc 0.7939,0.7939,1.45,90,90,90 - - 6.64 X 12452
Ga-Pr Pr9Ga4 Sm9Ga4,tI26,87 I4/m 1.2008,1.2008,0.5182,90,90,90 - - 6.88 A 18054
Ga-Pt PtGa FeSi,cP8,198 P213 0.491,0.491,0.491,90,90,90 - - 14.86 A 9104
Ga-Pt PtGa2 ht CaF2,cF12,225 Fm-3m 0.5911,0.5911,0.5911,90,90,90 fluorite family brass 10.76 X 144
Ga-Pt PtGa2 rt PtGa2,tI96,142 I41/acd 0.85544,0.85544,2.1574,90,90,90 fluorite family gray silver 11.26 X 31792
Ga-Pt PtGa5 PtGa5,mP48,11 P121/m1 0.63977,1.58823,0.88326,90,110.198,90 - - 8.58 X 56229
Ga-Pt PtGa6 *,oP*,* - 0.8866,1.2034,1.5946,90,90,90 - - - N 1335
Ga-Pt Pt0.94 Ga0.06 Cu,cF4,225 Fm-3m 0.3916,0.3916,0.3916,90,90,90 close-packed structure - 20.75 X 11627
Ga-Pt Pt2Ga rt Pt2Ga,oP24,51 Pmma 1.6440,0.3922,0.5488,90,90,90 - - 17.27 X 8473
Ga-Pt Pt2Ga3 Ni2Al3,hP5,164 P-3m1 0.422,0.422,0.517,90,90,120 - - 12.48 X 280
Ga-Pt Pt2.67 Ga1.33 ht SrPb3,tP4,123 P4/mmm 0.393,0.393,0.379,90,90,90 close-packed structure - 17.41 X 4213
Ga-Pt Pt3Ga ht Cu3Au,cP4,221 Pm-3m 0.3896,0.3896,0.3896,90,90,90 close-packed structure - 18.39 X 20896
Ga-Pt Pt3Ga rt Ga+ Ir3Si,tI16,140 I4/mcm 0.5492,0.5492,0.78102,90,90,90 close-packed structure - 18.47 A 20896
Ga-Pt Pt3Ga rt Pt+ Pt3Ga,tP16,127 P4/mbm 0.54723,0.54723,0.7886,90,90,90 close-packed structure - 18.42 X 9096
Ga-Pt Pt3Ga7 Ru3Sn7,cI40,229 Im-3m 0.8786,0.8786,0.8786,90,90,90 - - 10.51 X 56229
Ga-Pt Pt5Ga3 Pt5Ga3,oS16,65 Cmmm 0.744,0.8031,0.3948,90,90,90 close-packed structure - 16.68 X 1283
Ga-Pt Pt5.33 Ga2.67 ht Rh5Ge3,oP16,55 Pbam 0.5484,1.086,0.395,90,90,90 - - 17.31 X 8473
Ga-Pu PuGa ht PuGa,tI16,139 I4/mmm 0.6641,0.6641,0.8069,90,90,90 b.c.c. family - 11.71 X 9494
Ga-Pu PuGa rt PuGa,tI16,107 I4mm 0.66408,0.66408,0.80833,90,90,90 b.c.c. family - 11.69 X 12393
Ga-Pu PuGa2 AlB2,hP3,191 P6/mmm 0.4258,0.4258,0.412,90,90,120 AlB2 family - 9.84 X 2703
Ga-Pu PuGa3 ht1 Mg3Cd,hP8,194 P63 /mmc 0.63148,0.63148,0.45239,90,90,120 close-packed structure - 9.63 X 45483
Ga-Pu PuGa3 rt Mg3In,hR48,166 R-3m 0.618,0.618,2.8035,90,90,120 close-packed structure - 9.74 X 45483
Ga-Pu PuGa4 ht UAl4,oI20,74 Imma 0.438,0.629,1.3673,90,90,90 - - 9.22 X 2486
Ga-Pu PuGa6 ht PuGa6,tP14,125 P4/nbm 0.5942,0.5942,0.7617,90,90,90 - - 8.18 X 2486
Ga-Pu Pu0.88 Ga0.12 ht3 Cu,cF4,225 Fm-3m 0.4552,0.4552,0.4552,90,90,90 close-packed structure - 15.71 X 2703
Ga-Pu Pu0.977 Ga0.023 ht2 Pu,oF8,70 Fddd 0.3145,0.5691,0.9986,90,90,90 - - 17.84 X 54808
Ga-Pu Pu0.977 Ga0.023 rt Pu,mP16,11 P121/m1 0.6145,0.4805,1.0906,90,101.99,90 - - 20.24 A 54808
Ga-Pu Pu0.9988 Ga0.0012 ht5 W,cI2,229 Im-3m 0.363,0.363,0.363,90,90,90 b.c.c. family - 16.93 X 2703
Ga-Pu Pu1.16 Ga0.84 ht UCo,cI16,199 I213 0.7167,0.7167,0.7167,90,90,90 b.c.c. family - 12.33 X 9494
Ga-Pu Pu2Ga15 *,t*17,* - 0.6206,0.6206,0.8332,90,90,90 - - - N 9494
Ga-Pu Pu2Ga3 rt *,hP*,* - 0.4378,0.4378,0.3792,90,90,120 - - - N 9494
Ga-Pu Pu2Ga7 rt *,t*9,* - 0.4253,0.4253,0.9695,90,90,90 - - - N 9494
Ga-Pu Pu3Ga ht Cu3Au,cP4,221 Pm-3m 0.45,0.45,0.45,90,90,90 close-packed structure - 14.61 X 2703
Ga-Pu Pu3Ga rt SrPb3,tP4,123 P4/mmm 0.4506,0.4506,0.4555,90,90,90 close-packed structure - 14.40 X 2703
Ga-Pu Pu5Ga3 rt W5Si3,tI32,140 I4/mcm 1.1736,1.1736,0.5559,90,90,90 - - 12.40 A 9494
Ga-Rb RbGa2 *,o**,* - 0.61,0.616,1.113,90,90,90 - - - N 7750
Ga-Rb RbGa3 RbGa3,tI24,119 I-4m2 0.6315,0.6315,1.5000,90,90,90 - - 4.91 X 14718
Ga-Rb RbGa7 RbGa7,hR48,166 R-3m 0.6600,0.6600,2.8563,90,90,120 - - 5.30 X 18073
Ga-Re ReGa3 hp *,o**,* - 0.5728,0.5747,1.559,90,90,90 - - - N 15173
Ga-Re ReGa3 hp-ht IrIn3,tP16,136 P42 /mnm 0.6511,0.6511,0.679,90,90,90 - - 9.12 A 15173
Ga-Re Re0.6 Ga0.4 hp Mg,hP2,194 P63 /mmc 0.2823,0.2823,0.4238,90,90,120 close-packed structure - 15.85 X 15173
Ga-Rh RhGa CsCl,cP2,221 Pm-3m 0.30063,0.30063,0.30063,90,90,90 b.c.c. family - 10.55 X 16441
Ga-Rh RhGa3 IrIn3,tP16,136 P42 /mnm 0.6488,0.6488,0.6552,90,90,90 - - 7.52 A 1167
Ga-Rh Rh10Ga17 Rh10Ga17,tP108,116 P-4c2 0.5813,0.5813,4.746,90,90,90 chimney-ladder structure - 9.17 X 3658
Ga-Rh Rh2Ga9 Rh2Ga9,mP22,7 P1c1 0.64164,0.64119,0.87847,90,93.39,90 - gray 7.67 X 45740
Ga-Rh Rh3Ga5 Rh3Ga5,aP16,2 P-1 0.4961,0.6655,0.787,100.76,104.67,101.5 - black 9.15 X 41703
Ga-Ru RuGa CsCl,cP2,221 Pm-3m 0.301,0.301,0.301,90,90,90 b.c.c. family - 10.40 X 1970
Ga-Ru RuGa2 TiSi2,oF24,70 Fddd 0.474,0.818,0.87,90,90,90 - - 9.47 A 17316
Ga-Ru RuGa3 IrIn3,tP16,136 P42 /mnm 0.64729,0.64729,0.67062,90,90,90 - gray silver 7.33 X 40496
Ga-S GaS hp GaS-b,hP8,194 P63 /mmc 0.3547,0.3547,1.474,90,90,120 - - 4.21 X 15604
Ga-S GaS m GaSe,hR12,160 R3m 0.3605,0.3605,2.345,90,90,120 - - 3.84 X 20534
Ga-S GaS rt GaS-a,hP8,194 P63 /mmc 0.3592,0.3592,1.5465,90,90,120 - yellow 3.91 X 15475
Ga-S Ga0.67 S ht Ga+ ZnS,cF8,216 F-43m 0.5215,0.5215,0.5215,90,90,90 adamantane structure - 3.69 X 14506
Ga-S Ga0.67 S ht2 ZnO,hP4,186 P63 mc 0.3682,0.3682,0.6031,90,90,120 adamantane structure - 3.69 X 20527
Ga-S Ga2S3 ht Ga2S3,hP36,169 P61 0.6385,0.6385,1.8040,90,90,120 - - 3.69 X 20527
Ga-S Ga2S3 rt Ga2S3,mS20,9 C1c1 1.1107,0.6395,0.7021,90,121.17,90 - yellow pale 3.67 X 39622
Ga-Sb GaSb hp3 *,oS*,* - 0.22479,0.26122,0.42727,90,90,90 - - - N 20592
Ga-Sb GaSb rt ZnS,cF8,216 F-43m 0.6095,0.6095,0.6095,90,90,90 adamantane structure - 5.62 X 19471
Ga-Sb Ga0.5 Sb0.5 hp1 Si,oI4,74 Imma 0.5151,0.5276,0.2386,90,90,90 - - 9.81 X 29357
Ga-Sb Ga0.5 Sb0.5 hp2 (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.26981,0.26981,0.2479,90,90,120 - - 10.17 X 21795
Ga-Sb Ga0.5 Sb0.5 m C,cF8,227 Fd-3m 0.60976,0.60976,0.60976,90,90,90 - - 5.61 X 10665
Ga-Sc ScGa TlI,oS8,63 Cmcm 0.4022,1.0205,0.3895,90,90,90 CrB(TlI)-FeB - 4.76 X 2482
Ga-Sc ScGa2 hp ZrGa2,oS12,65 Cmmm 0.4098,1.331,0.4242,90,90,90 close-packed structure - 5.29 X 13248
Ga-Sc ScGa2 KHg2,oI12,74 Imma 0.414,0.6614,0.7914,90,90,90 AlB2 family - 5.65 X 13207
Ga-Sc ScGa3 Cu3Au,cP4,221 Pm-3m 0.409,0.409,0.409,90,90,90 close-packed structure - 6.17 X 59239
Ga-Sc Sc11Ga10 Ho11Ge10,tI84,139 I4/mmm 1.0366,1.0366,1.5305,90,90,90 - - 4.81 X 22844
Ga-Sc Sc3Ga2 Gd3Ga2,tI80,140 I4/mcm 1.0767,1.0767,1.4045,90,90,90 - - 4.48 A 20021
Ga-Sc Sc3Ga5 Tm3Ga5,oP32,62 Pnma 1.091,0.9231,0.5695,90,90,90 - - 5.60 A 14141
Ga-Sc Sc5Ga3 Y5Ga3,mS32,12 C12/m1 0.8092,1.4015,0.5933,90,91.022,90 - - 4.28 X 38645
Ga-Se GaSe 12R *,hR48,160 R3m 0.375,0.375,9.564,90,90,120 - - - N 9233
Ga-Se GaSe 15R *,hR60,160 R3m 0.375,0.375,11.955,90,90,120 - - - N 9233
Ga-Se GaSe 2Hα GaSe,hP8,187 P-6m2 0.37425,0.37425,1.59191,90,90,120 - red ruby 5.11 X 720
Ga-Se GaSe 2Hβ GaS-a,hP8,194 P63 /mmc 0.375,0.375,1.5995,90,90,120 - brown 5.07 X 20992
Ga-Se GaSe 3R GaSe,hR12,160 R3m 0.3747,0.3747,2.3910,90,90,120 - red ruby 5.10 X 720
Ga-Se GaSe 4H GaSe,hP16,186 P63 mc 0.3755,0.3755,3.1990,90,90,120 - - 5.06 X 8827
Ga-Se GaSe 9R *,hR36,160 R3m 0.375,0.375,7.173,90,90,120 - - - N 9233
Handbook of Inorganic Substances – Edition 2015 : Data 95

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ga-Se Ga0.67 Se ht ZnS,cF8,216 F-43m 0.5422,0.5422,0.5422,90,90,90 adamantane structure red 5.24 X 14309
Ga-Se Ga2Se 3 hp Bi2Te3,hR15,160 R3m 0.399,0.399,2.78,90,90,120 - - 4.89 A 4325
Ga-Se Ga2Se 3 rt Ga2Se3,mS20,9 C1c1 0.666,1.165,0.666,90,108.12,90 - brown 5.09 X 15904
Ga-Sm SmGa TlI,oS8,63 Cmcm 0.433,1.134,0.4196,90,90,90 CrB(TlI)-FeB - 7.10 X 5083
Ga-Sm SmGa2 AlB2 ,hP3,191 P6/mmm 0.4238,0.4238,0.4187,90,90,120 AlB2 family - 7.39 X 18364
Ga-Sm SmGa3.64 SmGa3.64 ,oF140,69 Fmmm 0.8493,1.4912,1.708,90,90,90 - black 7.45 X 52272
Ga-Sm SmGa6 rt PuGa6,tP14,125 P4/nbm 0.597,0.597,0.761,90,90,90 - - 6.96 A 19105
Ga-Sm Sm0.86 Ga2.41 Sm0.86 Ga2.41 ,hP15,149 P312 0.7424,0.7424,0.42176,90,90,120 - black 7.36 X 52272
Ga-Sm Sm0.92 Ga2 Sm0.92 Ga2,oS6,65 Cmmm 0.42484,0.73648,0.41856,90,90,90 - - 7.05 X 26686
Ga-Sm Sm1.06 Ga2.83 Sm1.06 Ga2.83 ,hP66,190 P-62c 1.2861,1.2861,0.84402,90,90,120 - black 7.35 X 52272
Ga-Sm Sm3 Ga Cu3Au,cP4,221 Pm-3m 0.539,0.539,0.539,90,90,90 close-packed structure - 5.52 X 10955
Ga-Sm Sm3 Ga2 Gd3Ga2,tI80,140 I4/mcm 1.1713,1.1713,1.517,90,90,90 - - 7.54 A 19061
Ga-Sm Sm5 Ga3 Ba5Si3,tP32,130 P4/ncc 0.78026,0.78026,1.4188,90,90,90 - black 7.39 X 44213
Ga-Sm Sm9 Ga4 Sm9 Ga4,tI26,87 I4/m 1.1940,1.1940,0.5081,90,90,90 - - 7.48 X 18054
Ga-Sn Ga0.07 Sn0.93 rt Sn,tI4,141 I41/amd 0.5785,0.5785,0.317,90,90,90 - - 7.22 X 2243
Ga-Sn Ga0.2 Sn0.8 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3143,0.3143,0.2922,90,90,120 - - 7.23 X 2985
Ga-Sr SrGa2 AlB2 ,hP3,191 P6/mmm 0.43484,0.43484,0.4736,90,90,120 AlB2 family gray silver 4.86 X 51936
Ga-Sr SrGa4 BaAl4,tI10,139 I4/mmm 0.44474,0.44474,1.073,90,90,90 - gray silver 5.74 X 44253
Ga-Sr Sr2.85 Ga8.45 Sr2.85 Ga8.45 ,oI34,71 Immm 0.43958,0.45298,2.6002,90,90,90 - gray 5.38 X 47745
Ga-Sr Sr8Ga7 Ba8Ga7,cP60,198 P213 1.2484,1.2484,1.2484,90,90,90 - - 4.06 X 15896
Ga-Ta TaGa2 *,tP*,* - 1.1778,1.1778,1.6927,90,90,90 - - - N 10742
Ga-Ta TaGa3 TiAl3,tI8,139 I4/mmm 0.3798,0.3798,0.8704,90,90,90 close-packed structure - 10.32 X 12384
Ga-Ta Ta0.88 Ga0.12 W,cI2,229 Im-3m 0.332,0.332,0.332,90,90,90 b.c.c. family - 15.21 X 12384
Ga-Ta Ta3Ga2 U3Si2,tP10,127 P4/mbm 0.6868,0.6868,0.3503,90,90,90 - - 13.71 A 12384
Ga-Ta Ta5Ga3 ht W5Si3,tI32,140 I4/mcm 1.0208,1.0208,0.5116,90,90,90 - - 13.88 X 2366
Ga-Ta Ta5Ga3 rt Cr5B3,tI32,140 I4/mcm 0.6588,0.6588,1.192,90,90,90 - - 14.30 A 2314
Ga-Ta Ta5Ga3 stab Mn5 Si3,hP16,193 P63/mcm 0.7681,0.7681,0.528,90,90,120 - - 13.71 X 12384
Ga-Ta Ta6Ga5 hp Ti6Sn5,hP22,194 P63/mmc 0.877,0.877,0.535,90,90,120 AlB2 family - 13.37 A 12384
Ga-Tb TbGa TlI,oS8,63 Cmcm 0.433,1.09,0.409,90,90,90 CrB(TlI)-FeB - 7.87 X 2329
Ga-Tb TbGa2 AlB2 ,hP3,191 P6/mmm 0.4211,0.4211,0.4096,90,90,120 AlB2 family - 7.88 X 46637
Ga-Tb TbGa3 ht Cu3Au,cP4,221 Pm-3m 0.4285,0.4285,0.4285,90,90,90 close-packed structure - 7.77 X 58999
Ga-Tb TbGa3 rt Mg3 Cd,hP8,194 P63/mmc 0.6278,0.6278,0.4507,90,90,120 close-packed structure - 7.95 X 14252
Ga-Tb TbGa6 PuGa6,tP14,125 P4/nbm 0.594,0.594,0.756,90,90,90 - - 7.19 A 19105
Ga-Tb Tb3Ga2 Gd3Ga2,tI80,140 I4/mcm 1.16275,1.16275,1.49191,90,90,90 - - 8.12 A 52224
Ga-Tb Tb3Ga5 Tm3 Ga5,oP32,62 Pnma 1.1472,0.9688,0.61114,90,90,90 - - 8.07 A 52224
Ga-Tb Tb5Ga3 Cr5B3,tI32,140 I4/mcm 0.7654,0.7654,1.398,90,90,90 - - 8.14 X 4602
Ga-Te GaTe hp NaCl,cF8,225 Fm-3m 0.556,0.556,0.556,90,90,90 rocksalt family - 7.63 X 30237
Ga-Te GaTe tf hex GaS-a,hP8,194 P63/mmc 0.406,0.406,1.696,90,90,120 - - 5.41 X 2365
Ga-Te GaTe tf mon *,mP24,4 P1211 1.195,0.404,1.482,90,104.,90 - - - N 2365
Ga-Te GaTe SiAs,mS24,12 C12/m1 1.7404,0.4077,1.0456,90,104.44,90 - black 5.47 X 12174
Ga-Te GaTe 3 *,hP*,* - 0.643,0.643,1.42,90,90,120 - - - N 1505
Ga-Te Ga0.67 Te ht ZnS,cF8,216 F-43m 0.5896,0.5896,0.5896,90,90,90 adamantane structure - 5.65 X 26587
Ga-Te Ga0.67 Te tf Ga0.67 Te,oS16,38 Amm2 0.3946,0.7891,1.1160,90,90,90 - - 6.66 X 27511
Ga-Te Ga0.9 Te1.1 tf *,cP*,* - 1.032,1.032,1.032,90,90,90 - - - N 2365
Ga-Te Ga2Te 3 hp Bi2Te3,hR15,160 R3m 0.3987,0.3987,2.645,90,90,120 - - 7.15 A 26591
Ga-Te Ga2Te 3 orth *,o**,* - 0.417,1.252,2.36,90,90,90 - - - N 1978
Ga-Te Ga2Te 5 ht Ga2Te5,tI14,87 I4/m 0.7913,0.7913,0.6848,90,90,90 - black 6.02 X 10396
Ga-Te Ga3Te 4 *,hP*,* - 0.8278,0.8278,0.6906,90,90,120 - - - N 18132
Ga-Te Ga7Te 10 Al7Te10,hR102,155 R32 1.4323,1.4323,1.7855,90,90,120 - black 5.54 X 31156
Ga-Th ThGa SrAg,oP16,62 Pnma 1.6346,0.4136,0.6053,90,90,90 CrB(TlI)-FeB - 9.80 X 17114
Ga-Th ThGa2 ThSi2,tI12,141 I41/amd 0.4247,0.4247,1.4701,90,90,90 - - 9.31 X 17114
Ga-Th Th2Ga CuAl2,tI12,140 I4/mcm 0.7481,0.7481,0.595,90,90,90 - - 10.65 X 6743
Ga-Th Th3Ga2 U3Si2,tP10,127 P4/mbm 0.8,0.8,0.4224,90,90,90 - - 10.27 X 17114
Ga-Ti TiGa CuAu,tP2,123 P4/mmm 0.28089,0.28089,0.39736,90,90,90 close-packed structure - 6.23 X 38816
Ga-Ti TiGa2 HfGa2,tI24,141 I41/amd 0.39405,0.39405,2.4406,90,90,90 close-packed structure - 6.57 A 38816
Ga-Ti TiGa3 TiAl3,tI8,139 I4/mmm 0.3795,0.3795,0.8748,90,90,90 close-packed structure - 6.78 X 41427
Ga-Ti Ti0.91 Ga0.09 rt Mg,hP2,194 P63/mmc 0.293,0.293,0.467,90,90,120 close-packed structure white silver4.77 X 17867
Ga-Ti Ti2Ga Co1.75 Ge,hP6,194 P63/mmc 0.45262,0.45262,0.55208,90,90,120 AlB2 family - 5.61 X 56215
Ga-Ti Ti2Ga3 rt Ti2Ga3,tP10,83 P4/m 0.6284,0.6284,0.4010,90,90,90 close-packed structure - 6.40 X 1784
Ga-Ti Ti3Ga rt Mg3 Cd,hP8,194 P63/mmc 0.57528,0.57528,0.46568,90,90,120 close-packed structure white silver5.31 X 56215
Ga-Ti Ti5Ga3 stab Mn5 Si3,hP16,193 P63/mcm 0.7604,0.7604,0.5288,90,90,120 - - 5.63 X 1962
Ga-Ti Ti5Ga3 W5Si3,tI32,140 I4/mcm 1.01906,1.01906,0.5042,90,90,90 - - 5.69 A 38816
Ga-Ti Ti5Ga4 Ti5Ga4,hP18,193 P63/mcm 0.7861,0.7861,0.5452,90,90,120 AlB2 family green 5.90 X 1721
Ga-Tm TmGa TlI,oS8,63 Cmcm 0.4245,1.0633,0.4017,90,90,90 CrB(TlI)-FeB - 8.74 A 12438
Ga-Tm TmGa2 hp AlB2 ,hP3,191 P6/mmm 0.407,0.407,0.315,90,90,120 AlB2 family - 11.33 X 31809
Ga-Tm TmGa2 KHg2,oI12,74 Imma 0.42,0.6879,0.8067,90,90,90 AlB2 family - 8.79 X 15244
Ga-Tm TmGa3 Cu3Au,cP4,221 Pm-3m 0.4202,0.4202,0.4202,90,90,90 close-packed structure - 8.46 X 20268
Ga-Tm TmGa6 PuGa6,tP14,125 P4/nbm 0.585,0.585,0.751,90,90,90 - - 7.59 A 14286
Ga-Tm Tm3 Ga2 Gd3Ga2,tI80,140 I4/mcm 1.124,1.124,1.447,90,90,90 - - 9.39 A 19061
Ga-Tm Tm3 Ga5 Tm3 Ga5,oP32,62 Pnma 1.1293,0.9561,0.6001,90,90,90 - - 8.77 X 16150
Ga-Tm Tm5 Ga3 Y5Ga3,mS32,12 C12/m1 0.8467,1.4647,0.63489,90,91.28,90 - - 8.89 A 38645
Ga-U UGa2 lt *,oS6,65 Cmmm 0.4202,0.7185,0.4012,90,90,90 - - - N 11912
Ga-U UGa2 rt AlB2 ,hP3,191 P6/mmm 0.4213,0.4213,0.40171,90,90,120 AlB2 family - 10.15 X 11912
Ga-U UGa3 Cu3Au,cP4,221 Pm-3m 0.4255,0.4255,0.4255,90,90,90 close-packed structure - 9.64 X 27985
Ga-U U0.918 Ga0.082 m U,tP30,136 P42/mnm 1.0662,1.0662,0.5703,90,90,90 Frank-Kasper phase - 17.23 A 48687
Ga-U U0.985 Ga0.015 rt U,oS4,63 Cmcm 0.2851,0.5852,0.4948,90,90,90 close-packed structure - 18.95 A 18183
Ga-U U2.67 Ga5.33 Pu3Pd5,oS32,63 Cmcm 0.9257,0.7439,0.9359,90,90,90 - - 10.38 X 44865
Ga-V V0.6 Ga0.4 stab Mn,cP20,213 P4132 0.662,0.662,0.662,90,90,90 - - 6.69 A 2858
96 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ga-V V0.67 Ga0.33 stab Mg,hP2,194 P63 /mmc 0.275,0.275,0.445,90,90,120 close-packed structure - 6.51 X 2858
Ga-V V0.9 Ga0.1 m W,cI2,229 Im-3m 0.30354,0.30354,0.30354,90,90,90 b.c.c. family - 6.27 X 2333
Ga-V V1.5 Ga0.5 ht CsCl,cP2,221 Pm-3m 0.3048,0.3048,0.3048,90,90,90 b.c.c. family - 6.53 X 3556
Ga-V V2Ga5 Hg5Mn2,tP14,127 P4/mbm 0.8936,0.8936,0.2683,90,90,90 - - 6.98 X 40287
Ga-V V3Ga rt Cr3Si,cP8,223 Pm-3n 0.48196,0.48196,0.48196,90,90,90 Frank-Kasper phase - 6.60 X 19477
Ga-V V5Ga3 stab Mn5Si3,hP16,193 P63 /mcm 0.7356,0.7356,0.4971,90,90,120 - - 6.61 A 3556
Ga-V V6Ga5 rt Ti6Sn5,hP22,194 P63 /mmc 0.8496,0.8496,0.5174,90,90,120 AlB2 family - 6.72 A 4266
Ga-V V6Ga7 ht Cu5Zn8,cI52,217 I-43m 0.917,0.917,0.917,90,90,90 γ-brass - 6.84 A 4266
Ga-V V8Ga41 V8Ga41,hR147,148 R-3 1.39351,1.39351,1.48828,90,90,120 - gray silver 6.50 X 38520
Ga-W W0.4 Ga0.6 hp Mg,hP2,194 P63 /mmc 0.3006,0.3006,0.4738,90,90,120 close-packed structure - 10.33 X 14248
Ga-W W0.97 Ga0.03 W,cI2,229 Im-3m 0.3146,0.3146,0.3146,90,90,90 b.c.c. family - 19.25 X 14248
Ga-W W2Ga5 hp Hg5Mn2,tP14,127 P4/mbm 0.8984,0.8984,0.2674,90,90,90 - - 11.02 A 14248
Ga-Y YGa TlI,oS8,63 Cmcm 0.4302,1.086,0.4073,90,90,90 CrB(TlI)-FeB - 5.54 X 2482
Ga-Y YGa2 AlB2,hP3,191 P6/mmm 0.4217,0.4217,0.4111,90,90,120 AlB2 family - 5.99 X 12438
Ga-Y YGa6 PuGa6,tP14,125 P4/nbm 0.5947,0.5947,0.7549,90,90,90 - - 6.31 X 17915
Ga-Y Y3Ga2 Gd3Ga2,tI80,140 I4/mcm 1.162,1.162,1.486,90,90,90 - - 5.38 A 19061
Ga-Y Y3Ga5 rt Tm3Ga5,oP32,62 Pnma 1.145,0.9674,0.6098,90,90,90 - - 6.05 A 16150
Ga-Y Y5Ga3 ht Y5Ga3,mS32,12 C12/m1 0.8635,1.4894,0.651,90,91.19,90 - - 5.19 X 25958
Ga-Y Y5Ga3 rt Ba5Si3,tP32,130 P4/ncc 0.76474,0.76474,1.4147,90,90,90 - black 5.25 X 28801
Ga-Yb YbGa CuTi,tP2,123 P4/mmm 0.342,0.342,0.394,90,90,90 b.c.c. family - 8.75 X 12424
Ga-Yb YbGa2 hp Hg2U,hP3,191 P6/mmm 0.41477,0.41477,0.31492,90,90,120 AlB2 family - 11.06 X 39499
Ga-Yb YbGa2 CaIn2,hP6,194 P63 /mmc 0.44527,0.44527,0.71969,90,90,120 AlB2 family - 8.40 X 52341
Ga-Yb YbGa2.64 rt YbGa2.64 ,hP63,191 P6/mmm 1.3025,1.3025,0.836,90,90,120 - - 7.24 X 23582
Ga-Yb YbGa4 CaGa4,mS10,12 C12/m1 0.6129,0.6109,0.6097,90,119.05,90 - - 7.52 X 52341
Ga-Yb YbGa5 YbGa5,tI24,139 I4/mmm 0.43059,0.43059,2.5871,90,90,90 - - 7.22 X 40879
Ga-Yb YbGa6 PuGa6,tP14,125 P4/nbm 0.608,0.608,0.761,90,90,90 - - 6.98 A 19105
Ga-Yb Yb0.89 Ga2.97 Yb0.89 Ga2.97 ,oI34,71 Immm 0.42049,0.4332,2.5691,90,90,90 - - 7.69 X 52341
Ga-Yb Yb2Ga Co2Si-b,oP12,62 Pnma 0.7063,0.505,0.9427,90,90,90 - - 8.21 A 12424
Ga-Yb Yb3Ga8 ht Eu3Ga8,oI22,71 Immm 0.4225,0.434,2.5665,90,90,90 - - 7.60 A 23582
Ga-Zn Zn0.98 Ga0.02 Mg,hP2,194 P63 /mmc 0.26591,0.26591,0.49923,90,90,120 close-packed structure - 7.11 X 2146
Ga-Zr ZrGa rt MoB,tI16,141 I41/amd 0.3865,0.3865,2.056,90,90,90 - - 6.96 X 1721
Ga-Zr ZrGa2 ZrGa2,oS12,65 Cmmm 0.3994,1.2894,0.4123,90,90,90 close-packed structure gray dark 7.22 X 1784
Ga-Zr ZrGa3 ZrAl3,tI16,139 I4/mmm 0.3964,0.3964,1.7465,90,90,90 close-packed structure - 7.27 A 31545
Ga-Zr Zr2Ga rt CuAl2,tI12,140 I4/mcm 0.6708,0.6708,0.5437,90,90,90 - - 6.85 X 6743
Ga-Zr Zr2Ga3 Zr2Al3,oF40,43 Fdd2 0.9444,1.3755,0.5497,90,90,90 - - 7.29 X 1784
Ga-Zr Zr3Ga2 U3Si2,tP10,127 P4/mbm 0.7349,0.7349,0.3692,90,90,90 - - 6.88 X 1784
Ga-Zr Zr3Ga5 rt Pu3Pd5,oS32,63 Cmcm 0.8839,0.7104,0.9069,90,90,90 - - 7.26 A 31545
Ga-Zr Zr5Ga3 ht W5Si3,tI32,140 I4/mcm 1.0891,1.0891,0.5389,90,90,90 - - 6.91 X 31545
Ga-Zr Zr5Ga3 rt Mn5Si3,hP16,193 P63 /mcm 0.8041,0.8041,0.56766,90,90,120 - - 6.95 X 31545
Ga-Zr Zr5Ga4 ht Ti5Ga4,hP18,193 P63 /mcm 0.8313,0.8313,0.5746,90,90,120 AlB2 family - 7.10 A 31545
Gd-Ge GdGe TlI,oS8,63 Cmcm 0.4339,1.0788,0.3973,90,90,90 CrB(TlI)-FeB - 8.21 X 2905
Gd-Ge GdGe1.5 rt AlB2,hP3,191 P6/mmm 0.3972,0.3972,0.4203,90,90,120 AlB2 family - 7.70 X 57363
Gd-Ge GdGe1.66 ht ThSi2,tI12,141 I41/amd 0.4122,0.4122,1.3738,90,90,90 - - 7.90 X 35870
Gd-Ge GdGe2 TbGe2,oS24,65 Cmmm 0.4138,3.0038,0.403,90,90,90 - - 8.02 A 35707
Gd-Ge GdGe3 ht DyGe3,oS16,63 Cmcm 0.4092,2.0897,0.3951,90,90,90 - - 7.37 A 35707
Gd-Ge GdGe5 hp LaGe5,oI12,71 Immm 0.39686,0.613,0.9847,90,90,90 - black 7.21 X 53569
Gd-Ge Gd11Ge10 Ho11Ge10,tI84,139 I4/mmm 1.095,1.095,1.667,90,90,90 - - 8.16 A 57363
Gd-Ge Gd17Ge29 Gd17Ge29,oF368,43 Fdd2 0.58331,9.928,1.3749,90,90,90 - - 7.97 X 35846
Gd-Ge Gd3Ge4 Er3Ge4,oS28,63 Cmcm 0.41025,1.07444,1.43121,90,90,90 - - 8.02 X 48325
Gd-Ge Gd3Ge5 rt Y3Ge5,oF64,43 Fdd2 0.5784,1.7355,1.3785,90,90,90 - - 8.01 X 46486
Gd-Ge Gd5Ge3 lt Mn5Si3,oS32,63 Cmcm 1.48806,0.85604,0.64388,90,90,90 - - 8.13 X 59209
Gd-Ge Gd5Ge3 rt Mn5Si3,hP16,193 P63 /mcm 0.857,0.857,0.643,90,90,120 - - 8.15 X 4619
Gd-Ge Gd5Ge4 Sm5Ge4,oP36,62 Pnma 0.7676,1.47819,0.77738,90,90,90 - - 8.11 X 57952
Gd-Ge Gd7Ge11 *,oF152,43 Fdd2 1.3759,4.092,0.5833,90,90,90 - - - N 30046
Gd-Ge Gd75Ge124 *,o**,* - 0.5789,0.5796,1.382,90,90,90 - - - N 35846
Gd-H GdH1.93 CaF2,cF12,225 Fm-3m 0.5303,0.5303,0.5303,90,90,90 fluorite family - 7.09 X 34589
Gd-H GdH3 hp BiF3,cF16,225 Fm-3m 0.536,0.536,0.536,90,90,90 b.c.c. family - 6.91 X 48695
Gd-H GdH3 trig HoH3,hP24,165 P-3c1 0.64662,0.64662,0.6717,90,90,120 - - 6.57 X 37399
Gd-Hg HgGd CsCl,cP2,221 Pm-3m 0.37,0.37,0.37,90,90,90 b.c.c. family - 11.73 X 20291
Gd-Hg Hg2Gd Cd2Ce,hP3,164 P-3m1 0.4854,0.4854,0.3496,90,90,120 AlB2 family - 13.00 A 4094
Gd-Hg Hg3Gd Mg3Cd,hP8,194 P63 /mmc 0.6591,0.6591,0.4889,90,90,120 close-packed structure - 13.71 A 3135
Gd-Hg Hg45Gd11 Cd45Sm11,cF448,216 F-43m 2.1551,2.1551,2.1551,90,90,90 Nasicon family - 14.28 A 12439
Gd-I GdI2 2H MoS2,hP6,194 P63 /mmc 0.4075,0.4075,1.5049,90,90,120 - - 6.31 A 45176
Gd-I GdI2 rt *,hP*,* - 0.867,0.867,0.575,90,90,120 - brass - N 2623
Gd-I GdI3 hp PuBr3,oS16,63 Cmcm 0.4202,1.3993,0.9999,90,90,90 - - 6.08 A 12808
Gd-I GdI3 *,hP168,* - 2.0034,2.0034,2.0921,90,90,120 - - - N 29400
Gd-In GdIn Gd+ CsCl,cP2,221 Pm-3m 0.3795,0.3795,0.3795,90,90,90 b.c.c. family - 8.27 X 16745
Gd-In GdIn rt CuTi,tP2,123 P4/mmm 0.383,0.383,0.364,90,90,90 b.c.c. family - 8.46 X 15311
Gd-In GdIn3 Cu3Au,cP4,221 Pm-3m 0.46066,0.46066,0.46066,90,90,90 close-packed structure - 8.52 X 2680
Gd-In Gd0.98 In0.02 rt Mg,hP2,194 P63 /mmc 0.3636,0.3636,0.5764,90,90,120 close-packed structure - 7.87 X 50679
Gd-In Gd2In Co1.75 Ge,hP6,194 P63 /mmc 0.541,0.541,0.6751,90,90,120 AlB2 family - 8.33 X 21318
Gd-In Gd3In5 Pu3Pd5,oS32,63 Cmcm 0.993,0.806,1.0345,90,90,90 - - 8.39 A 16745
Gd-In Gd5In3 W5Si3,tI32,140 I4/mcm 1.2345,1.2345,0.6065,90,90,90 - - 8.13 A 16745
Gd-Ir GdIr2 MgCu2,cF24,227 Fd-3m 0.7555,0.7555,0.7555,90,90,90 Friauf-Laves phase - 16.69 X 23067
Gd-Ir GdIr3 cub Cu3Au,cP4,221 Pm-3m 0.3839,0.3839,0.3839,90,90,90 close-packed structure - 21.54 X 19989
Gd-Ir GdIr3 rhom PuNi3,hR36,166 R-3m 0.5295,0.5295,2.6028,90,90,120 Laves-CaCu5 - 17.36 A 23067
Gd-Ir Gd3Ir Fe3C-b,oP16,62 Pnma 0.7251,0.9572,0.6375,90,90,90 - - 9.97 A 23067
Gd-Ir Gd3Ir2 Y3Rh2,tI140,140 I4/mcm 1.1298,1.1298,2.5265,90,90,90 - - 12.34 A 23067
Handbook of Inorganic Substances – Edition 2015 : Data 97

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Gd-Ir Gd5 Ir2 Mn5 C2,mS28,15 C12/c1 1.5913,0.6488,0.7248,90,96.82,90 - - 10.47 X 37245


Gd-Ir Gd5 Ir3 Pu5Rh3,tP32,130 P4/ncc 1.0969,1.0969,0.6352,90,90,90 - - 11.85 A 23067
Gd-La La0.22 Gd0.78 ht Mg,hP2,194 P63/mmc 0.36557,0.36557,0.58552,90,90,120 close-packed structure - 7.51 X 5196
Gd-La La0.32 Gd0.68 rt Sm,hR9,166 R-3m 0.36638,0.36638,2.6518,90,90,120 close-packed structure - 7.34 A 5196
Gd-La La0.33 Gd0.67 hp Nd,hP4,194 P63/mmc 0.363,0.363,1.179,90,90,120 close-packed structure - 7.46 X 3218
Gd-Lu Gd0.20 Lu0.80 Mg,hP2,194 P63/mmc 0.3539,0.3539,0.5604,90,90,120 close-packed structure - 9.37 X 1948
Gd-Mg MgGd CsCl,cP2,221 Pm-3m 0.3811,0.3811,0.3811,90,90,90 b.c.c. family gray silver 5.45 X 9386
Gd-Mg Mg0.3 Gd0.7 ht W,cI2,229 Im-3m 0.3928,0.3928,0.3928,90,90,90 b.c.c. family - 6.43 X 22687
Gd-Mg Mg0.9831 Gd0.0169 Mg,hP2,194 P63/mmc 0.32208,0.32208,0.52164,90,90,120 close-packed structure - 1.88 X 46358
Gd-Mg Mg2 Gd MgCu2,cF24,227 Fd-3m 0.85762,0.85762,0.85762,90,90,90 Friauf-Laves phase - 4.34 X 11575
Gd-Mg Mg3 Gd BiF3 ,cF16,225 Fm-3m 0.7326,0.7326,0.7326,90,90,90 b.c.c. family - 3.89 X 11558
Gd-Mg Mg46 Gd9 Mg43 (Mg0.32Gd0.68 )6Gd5,cF448,216 F-43m 2.2344,2.2344,2.2344,90,90,90 - - 3.02 X 18788
Gd-Mn GdMn12 ThMn12,tI26,139 I4/mmm 0.8624,0.8624,0.4782,90,90,90 CaCu5-Zr4Al3 - 7.62 X 3779
Gd-Mn GdMn2 hp-ht MgZn2,hP12,194 P63/mmc 0.5476,0.5476,0.8933,90,90,120 Friauf-Laves phase - 7.65 A 30745
Gd-Mn GdMn2 lt URe2,oS24,63 Cmcm 0.5436,0.9453,0.886,90,90,90 Friauf-Laves phase - 7.79 A 30745
Gd-Mn GdMn2 rt MgCu2,cF24,227 Fd-3m 0.77382,0.77382,0.77382,90,90,90 Friauf-Laves phase - 7.66 X 11594
Gd-Mn GdMn5 *,o**,* - 0.313,0.441,0.723,90,90,90 - - - N 1291
Gd-Mn Gd6 Mn23 Th6Mn23,cF116,225 Fm-3m 1.2578,1.2578,1.2578,90,90,90 - - 7.37 X 2117
Gd-N GdN NaCl,cF8,225 Fm-3m 0.4739,0.4739,0.4739,90,90,90 rocksalt family - 10.69 X 52487
Gd-Nb Gd0.01 Nb0.99 W,cI2,229 Im-3m 0.33017,0.33017,0.33017,90,90,90 b.c.c. family - 8.63 X 9090
Gd-Nd Nd0.2 Gd0.8 ht Mg,hP2,194 P63/mmc 0.365,0.365,0.5798,90,90,120 close-packed structure - 7.68 X 8995
Gd-Nd Nd0.5 Gd0.5 rt Sm,hR9,166 R-3m 0.3644,0.3644,2.632,90,90,120 close-packed structure - 7.44 A 5315
Gd-Nd Nd0.6 Gd0.4 hp Nd,hP4,194 P63/mmc 0.364,0.364,1.1786,90,90,120 close-packed structure - 7.34 X 8995
Gd-Ni GdNi TlI,oS8,63 Cmcm 0.37713,1.03272,0.42488,90,90,90 CrB(TlI)-FeB - 8.67 X 51294
Gd-Ni GdNi2 MgCu2,cF24,227 Fd-3m 0.7212,0.7212,0.7212,90,90,90 Friauf-Laves phase - 9.73 X 21672
Gd-Ni GdNi2 TmNi2,cF192,216 F-43m 1.4408,1.4408,1.4408,90,90,90 Friauf-Laves phase - 9.76 X 46379
Gd-Ni GdNi3 PuNi3,hR36,166 R-3m 0.4993,0.4993,2.4536,90,90,120 Laves-CaCu5 - 9.40 X 58192
Gd-Ni GdNi4 *,hP10,* - 0.535,0.535,0.583,90,90,120 - - - N 1535
Gd-Ni GdNi5 CaCu5,hP6,191 P6/mmm 0.4915,0.4915,0.3967,90,90,120 - - 9.02 X 35985
Gd-Ni Gd2 Ni17 Th2Ni17,hP38,194 P63/mmc 0.843,0.843,0.804,90,90,120 CaCu5-Zr4Al3 - 8.81 X 4512
Gd-Ni Gd2 Ni7 ht Gd2Co 7,hR54,166 R-3m 0.496,0.496,3.614,90,90,120 Laves-CaCu5 - 9.39 X 4512
Gd-Ni Gd2 Ni7 rt Ce2Ni7,hP36,194 P63/mmc 0.496,0.496,2.409,90,90,120 Laves-CaCu5 - 9.39 X 4512
Gd-Ni Gd3 Ni Fe3C-b,oP16,62 Pnma 0.6942,0.968,0.6348,90,90,90 - - 8.26 X 37245
Gd-Ni Gd3 Ni2 *,t*20,* - 0.728,0.728,0.861,90,90,90 - - - N 1535
Gd-Ni Gd5 Ni19 2H Sm5 Co19,hP48,194 P63/mmc 0.495,0.495,3.2161,90,90,120 Laves-CaCu5 - 9.25 X 56281
Gd-O GdO tf CaF2 ,cF12,225 Fm-3m 0.54,0.54,0.54,90,90,90 fluorite family - 7.31 X 8570
Gd-O GdO tf ZnS,cF8,216 F-43m 0.54,0.54,0.54,90,90,90 adamantane structure - 7.31 X 8570
Gd-O GdO0.656 tf *,hR192,160 R3m 1.482,1.482,1.815,90,90,120 - - - N 6953
Gd-O GdO1.5 ht4 NdO1.5 ,cI26,229 Im-3m 0.431,0.431,0.431,90,90,90 - - 7.52 A 3998
Gd-O GdO2 tf Cu2Sb,tP6,129 P4/nmm 0.394,0.394,0.676,90,90,90 - - 5.99 X 9324
Gd-O Gd2 O3 ht1 Sm2 O3,mS30,12 C12/m1 1.4032,0.3583,0.8742,90,100.13,90 - - 8.35 X 51278
Gd-O Gd2 O3 ht2 La2O3,hP5,164 P-3m1 0.368,0.368,0.5597,90,90,120 - - 9.17 X 51278
Gd-O Gd2 O3 ht3 La2O3,hP10,194 P63/mmc 0.3858,0.3858,0.616,90,90,120 - - 7.58 A 2579
Gd-O Gd2 O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.08077,1.08077,1.08077,90,90,90 - - 7.63 X 57914
Gd-Os GdOs2 MgZn2,hP12,194 P63/mmc 0.5319,0.5319,0.8838,90,90,120 Friauf-Laves phase - 16.49 X 1059
Gd-Os Gd3 Os Fe3C-b,oP16,62 Pnma 0.7406,0.921,0.6337,90,90,90 - - 10.17 A 13334
Gd-P GdP rt NaCl,cF8,225 Fm-3m 0.573,0.573,0.573,90,90,90 rocksalt family black 6.65 X 5266
Gd-P GdP 5 NdP 5,mP12,11 P121/m1 0.4928,0.9446,0.537,90,102.58,90 - - 4.25 X 10236
Gd-Pb GdPb3 Cu3Au,cP4,221 Pm-3m 0.48261,0.48261,0.48261,90,90,90 close-packed structure - 11.51 X 4758
Gd-Pb Gd5 Pb3 Mn5 Si3,hP16,193 P63/mcm 0.9077,0.9077,0.6637,90,90,120 - - 9.87 X 2882
Gd-Pb Gd5 Pb4 rt Sm5 Ge4,oP36,62 Pnma 0.82,1.562,0.82,90,90,90 - - 10.21 A 4758
Gd-Pd GdPd rt TlI,oS8,63 Cmcm 0.3736,1.055,0.4548,90,90,90 CrB(TlI)-FeB - 9.77 X 3949
Gd-Pd GdPd3 Cu3Au,cP4,221 Pm-3m 0.4089,0.4089,0.4089,90,90,90 close-packed structure - 11.57 X 52719
Gd-Pd Gd0.11Pd0.89 Cu,cF4,225 Fm-3m 0.399,0.399,0.399,90,90,90 close-packed structure - 11.71 X 6843
Gd-Pd Gd3 Pd Fe3C-b,oP16,62 Pnma 0.771,0.9188,0.6635,90,90,90 - - 8.17 A 30224
Gd-Pd Gd3 Pd2 U3Si2,tP10,127 P4/mbm 0.7864,0.7864,0.3901,90,90,90 - - 9.42 A 17401
Gd-Pd Gd3 Pd4 rt Pu3Pd4,hR42,148 R-3 1.3249,1.3249,0.5726,90,90,120 b.c.c. family - 10.27 A 20553
Gd-Pd Gd7 Pd3 Th7Fe3,hP20,186 P63mc 0.998,0.998,0.6276,90,90,120 - - 8.71 X 7492
Gd-Pr Pr0.07 Gd0.93 ht Mg,hP2,194 P63/mmc 0.364,0.364,0.5775,90,90,120 close-packed structure - 7.82 X 5302
Gd-Pr Pr0.4 Gd0.6 rt Sm,hR9,166 R-3m 0.36402,0.36402,2.6301,90,90,120 close-packed structure - 7.46 A 3146
Gd-Pr Pr0.54 Gd0.46 rt Nd,hP4,194 P63/mmc 0.364,0.364,1.171,90,90,120 close-packed structure - 7.34 X 5302
Gd-Pt GdPt FeB-b,oP8,62 Pnma 0.7164,0.4458,0.5574,90,90,90 CrB(TlI)-FeB - 13.15 X 1397
Gd-Pt GdPt2 MgCu2,cF24,227 Fd-3m 0.7606,0.7606,0.7606,90,90,90 Friauf-Laves phase - 16.53 X 19443
Gd-Pt GdPt5 *,o*72,* - 0.5289,0.9071,2.643,90,90,90 - - - N 7793
Gd-Pt Gd1.12Pt2.88 Cu3Au,cP4,221 Pm-3m 0.4091,0.4091,0.4091,90,90,90 close-packed structure - 17.90 X 19443
Gd-Pt Gd2 Pt Co2Si-b,oP12,62 Pnma 0.7186,0.4813,0.8854,90,90,90 - - 11.05 X 11341
Gd-Pt Gd3 Pt Fe3C-b,oP16,62 Pnma 0.7139,0.9651,0.6464,90,90,90 - - 9.95 A 20553
Gd-Pt Gd3 Pt4 Pu3Pd4,hR42,148 R-3 1.3245,1.3245,0.5702,90,90,120 b.c.c. family - 14.40 A 20553
Gd-Pt Gd5 Pt3 Mn5 Si3,hP16,193 P63/mcm 0.8479,0.8479,0.6275,90,90,120 - - 11.66 A 11341
Gd-Pt Gd7 Pt3 Th7Fe3,hP20,186 P63mc 0.9923,0.9923,0.6215,90,90,120 - - 10.57 A 20553
Gd-Re GdRe2 MgZn2,hP12,194 P63/mmc 0.5419,0.5419,0.8836,90,90,120 Friauf-Laves phase - 15.66 A 5527
Gd-Rh GdRh CsCl,cP2,221 Pm-3m 0.3427,0.3427,0.3427,90,90,90 b.c.c. family - 10.73 X 29415
Gd-Rh GdRh2 MgCu2,cF24,227 Fd-3m 0.7514,0.7514,0.7514,90,90,90 Friauf-Laves phase - 11.37 X 7828
Gd-Rh GdRh3 CeNi3,hP24,194 P63/mmc 0.5235,0.5235,1.74,90,90,120 Laves-CaCu5 - 11.24 A 7828
Gd-Rh GdRh5 ht CaCu5,hP6,191 P6/mmm 0.5168,0.5168,0.4306,90,90,120 - - 11.20 X 7828
Gd-Rh Gd3 Rh Fe3C-b,oP16,62 Pnma 0.7186,0.9594,0.6338,90,90,90 - - 8.74 A 37245
Gd-Rh Gd3 Rh2 ht Y3Rh2,tI140,140 I4/mcm 1.127,1.127,2.532,90,90,90 - - 9.80 A 9564
Gd-Rh Gd5 Rh3 ht Mn5 Si3,hP16,193 P63/mcm 0.8244,0.8244,0.6455,90,90,120 - - 9.57 A 7828
98 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Gd-Rh Gd5Rh4 Sm5Ge4,oP36,62 Pnma 0.7343,1.457,0.7527,90,90,90 - - 9.88 A 9915


Gd-Rh Gd7Rh3 Th7Fe3,hP20,186 P63 mc 0.98611,0.98611,0.62113,90,90,120 - - 8.95 A 48547
Gd-Ru GdRu2 ht MgCu2,cF24,227 Fd-3m 0.756,0.756,0.756,90,90,90 Friauf-Laves phase - 11.05 X 2010
Gd-Ru GdRu2 rt MgZn2,hP12,194 P63 /mmc 0.5271,0.5271,0.8904,90,90,120 Friauf-Laves phase - 11.14 X 1059
Gd-Ru Gd0.05 Ru0.95 Mg,hP2,194 P63 /mmc 0.2726,0.2726,0.4311,90,90,120 close-packed structure - 12.44 X 17698
Gd-Ru Gd3Ru Fe3C-b,oP16,62 Pnma 0.7347,0.9441,0.6354,90,90,90 - - 8.63 A 17698
Gd-Ru Gd44Ru25 Y44Ru25,oP276,52 Pnna 2.8201,1.5314,1.5314,90,90,90 - - 9.49 A 23566
Gd-Ru Gd5Ru2 Mn5C2,mS28,15 C12/c1 1.594,0.639,0.733,90,97.06,90 - - 8.86 A 17698
Gd-S GdS NaCl,cF8,225 Fm-3m 0.55516,0.55516,0.55516,90,90,90 rocksalt family golden 7.35 X 9140
Gd-S GdS1.82 ht UAs2,tP6,129 P4/nmm 0.38951,0.38951,0.79343,90,90,90 - orange 5.95 X 41287
Gd-S GdS2 hp-ht *,c*24,* - 0.7882,0.7882,0.7882,90,90,90 - black gray - N 5227
Gd-S GdS2 rt CeSe2,mP12,14 P121/c1 0.7926,0.3936,0.7879,90,89.92,90 - - 5.98 X 55526
Gd-S Gd10S19 Ce10Se19,tP58,86 P42 /n 0.8714,0.8714,1.5791,90,90,90 - - 6.04 X 49625
Gd-S Gd2S3 ht Cr3C2-b,oP20,62 Pnma 0.7339,0.39318,1.5273,90,90,90 - brown red 6.19 X 4021
Gd-S Gd2S3 m Th2S3,oP20,62 Pnma 1.07447,0.38985,1.05462,90,90,90 - black 6.18 X 24215
Gd-S Gd2.67 S4 ht Th3P 4,cI28,220 I-43d 0.83847,0.83847,0.83847,90,90,90 - yellow 6.18 X 35207
Gd-S Gd3S4 rt *,hP*,* - 1.566,1.566,1.444,90,90,120 - yellow - N 3649
Gd-Sb GdSb rt NaCl,cF8,225 Fm-3m 0.6219,0.6219,0.6219,90,90,90 rocksalt family gray 7.70 X 30408
Gd-Sb GdSb2 hp1-ht SmSb2,oS24,64 Cmce 0.6157,0.5986,1.783,90,90,90 - - 8.10 A 4623
Gd-Sb GdSb2 hp2-ht HoSb2,oS6,21 C222 0.3296,0.593,0.803,90,90,90 - - 8.48 A 4623
Gd-Sb Gd16Sb39 Gd16Sb39,mS124,12 C12/m1 5.7395,0.4151,1.3209,90,99.21,90 - - 7.77 X 37139
Gd-Sb Gd2Sb5 Dy2Sb5,mP28,11 P121/m1 1.31747,0.41864,1.47521,90,102.485,90 - - 7.72 A 39470
Gd-Sb Gd4Sb3 Th3P 4,cI28,220 I-43d 0.92149,0.92149,0.92149,90,90,90 - gray 8.44 X 58208
Gd-Sb Gd5Sb3 Mn5Si3,hP16,193 P63 /mcm 0.8975,0.8975,0.6343,90,90,120 - - 8.64 X 3842
Gd-Sc Sc0.5 Gd0.5 rt Mg,hP2,194 P63 /mmc 0.3492,0.3492,0.5528,90,90,120 close-packed structure - 5.75 X 2230
Gd-Se GdSe rt NaCl,cF8,225 Fm-3m 0.5781,0.5781,0.5781,90,90,90 rocksalt family orange 8.12 X 12410
Gd-Se GdSe2 mon CeSe2,mP12,14 P121/c1 0.82955,0.40912,0.82547,90,90.107,90 - - 7.47 A 57465
Gd-Se GdSe2 orth *,oS144,* - 1.608,1.647,1.206,90,90,90 - - - N 3531
Gd-Se GdSe2 tet *,tI24,* - 0.8089,0.8089,0.8287,90,90,90 - - - N 3163
Gd-Se Gd0.88 Se Mo0.75 N0.50 ,cP8,221 Pm-3m 0.57669,0.57669,0.57669,90,90,90 rocksalt family blue 7.53 X 20369
Gd-Se Gd10Se19 Ce10Se19,tP58,86 P42 /n 0.90762,0.90762,1.66113,90,90,90 - - 7.46 A 59478
Gd-Se Gd2Se3 Th2S3,oP20,62 Pnma 1.1182,0.40348,1.0971,90,90,90 - black red 7.40 X 43934
Gd-Se Gd2.67 Se4 cub Th3P 4,cI28,220 I-43d 0.87256,0.87256,0.87256,90,90,90 - red ruby 7.36 X 39449
Gd-Se Gd3Se4 hex *,hP*,* - 0.8175,0.8175,1.512,90,90,120 - brown - N 3649
Gd-Se Gd8Se15 Gd8Se15,oS146,38 Amm2 1.2136,1.6167,1.658,90,90,90 - gray silver 7.48 X 49617
Gd-Si GdSi FeB-b,oP8,62 Pnma 0.7973,0.3858,0.5753,90,90,90 CrB(TlI)-FeB gray 6.96 X 23126
Gd-Si GdSi1.5 ht hex AlB2,hP3,191 P6/mmm 0.39,0.39,0.42,90,90,120 AlB2 family - 5.98 X 16056
Gd-Si GdSi1.85 rt GdSi1.4 ,oI12,74 Imma 0.40171,0.40684,1.3499,90,90,90 - - 6.30 X 40015
Gd-Si GdSi2 ht tet ThSi2,tI12,141 I41/amd 0.408,0.408,1.344,90,90,90 - gray silver 6.34 A 3182
Gd-Si GdSi5 LaGe5,oI12,71 Immm 0.3775,0.6032,0.9233,90,90,90 - - 4.70 X 53640
Gd-Si Gd2Si2.67 Ho2Si2.67 ,oS24,63 Cmcm 0.4251,2.405,0.3833,90,90,90 - - 6.60 A 46581
Gd-Si Gd5Si3 Mn5Si3,hP16,193 P63 /mcm 0.85133,0.85133,0.64206,90,90,120 - - 7.17 X 43498
Gd-Si Gd5Si4 Gd5Si4,oP36,62 Pnma 0.74743,1.47529,0.77424,90,90,90 - gray silver 6.99 X 52390
Gd-Sn GdSn2 ZrSi2,oS12,63 Cmcm 0.4428,1.641,0.4322,90,90,90 close-packed structure - 8.35 X 2883
Gd-Sn GdSn2.75 rt GdSn2.75 ,oS16,38 Amm2 0.43552,0.44039,2.2044,90,90,90 - - 7.60 X 18928
Gd-Sn GdSn3 ht Cu3Au,cP4,221 Pm-3m 0.467,0.467,0.467,90,90,90 close-packed structure - 8.37 X 28969
Gd-Sn Gd11Sn10 Ho11Ge10,tI84,139 I4/mmm 1.1668,1.1668,1.7147,90,90,90 - - 8.30 A 56546
Gd-Sn Gd3Sn7 Gd3Sn7,oS20,65 Cmmm 0.44597,2.6523,0.43823,90,90,90 close-packed structure - 8.35 X 18928
Gd-Sn Gd5Sn3 Mn5Si3,hP16,193 P63 /mcm 0.9021,0.9021,0.6521,90,90,120 - - 8.26 A 56546
Gd-Sn Gd5Sn4 rt Sm5Ge4,oP36,62 Pnma 0.80446,1.55404,0.82025,90,90,90 - - 8.17 X 43235
Gd-Tb Gd0.60 Tb0.40 rt Mg,hP2,194 P63 /mmc 0.3623,0.3623,0.5747,90,90,120 close-packed structure - 8.03 X 46886
Gd-Tc GdTc2 MgZn2,hP12,194 P63 /mmc 0.5397,0.5397,0.8883,90,90,120 Friauf-Laves phase - 10.47 A 2225
Gd-Te GdTe NaCl,cF8,225 Fm-3m 0.6165,0.6165,0.6165,90,90,90 rocksalt family blue 8.07 X 31930
Gd-Te GdTe2 UAs2,tP6,129 P4/nmm 0.4317,0.4317,0.8951,90,90,90 - violet 8.21 A 6542
Gd-Te GdTe3 NdTe3,oS16,63 Cmcm 0.4326,2.528,0.4326,90,90,90 - - 7.58 A 3452
Gd-Te Gd2Te Sc2Te,oP36,62 Pnma 2.2492,0.405,1.2064,90,90,90 - - 8.02 A 38651
Gd-Te Gd2Te3 Th2S3,oP20,62 Pnma 1.2009,0.43012,1.1818,90,90,90 - - 7.59 X 20108
Gd-Te Gd2Te5 ht Nd2Te5,oS28,63 Cmcm 0.4336,4.36,0.4336,90,90,90 - brown 7.72 A 3452
Gd-Th Th0.1 Gd0.9 rt Mg,hP2,194 P63 /mmc 0.3628,0.3628,0.5774,90,90,120 close-packed structure - 8.31 X 6931
Gd-Th Th0.4 Gd0.6 rt Cu,cF4,225 Fm-3m 0.5075,0.5075,0.5075,90,90,90 close-packed structure - 9.51 X 4836
Gd-Tl TlGd ht CsCl,cP2,221 Pm-3m 0.3781,0.3781,0.3781,90,90,90 b.c.c. family - 11.11 X 16204
Gd-Tl TlGd rt CuTi,tP2,123 P4/mmm 0.354,0.354,0.426,90,90,90 b.c.c. family - 11.25 X 16204
Gd-Tl TlGd2 Co1.75 Ge,hP6,194 P63 /mmc 0.536,0.536,0.67,90,90,120 AlB2 family - 10.34 X 16745
Gd-Tl Tl3Gd Cu3Au,cP4,221 Pm-3m 0.4694,0.4694,0.4694,90,90,90 close-packed structure - 12.37 X 16745
Gd-Tl Tl3Gd5 Tl- Mn5Si3,hP16,193 P63 /mcm 0.9042,0.9042,0.6664,90,90,120 - - 9.85 A 16745
Gd-Tl Tl5Gd3 Tl- Pu3Pd5,oS32,63 Cmcm 1.0035,0.8105,1.039,90,90,90 - - 11.74 A 16745
Gd-Y Y0.5 Gd0.5 rt Mg,hP2,194 P63 /mmc 0.36415,0.36415,0.5761,90,90,120 close-packed structure - 6.18 X 1641
Gd-Yb Gd0.022 Yb0.978 rt Cu,cF4,225 Fm-3m 0.547,0.547,0.547,90,90,90 close-packed structure - 7.01 X 8472
Gd-Zn ZnGd CsCl,cP2,221 Pm-3m 0.36,0.36,0.36,90,90,90 b.c.c. family - 7.92 X 20291
Gd-Zn Zn11Gd3 La3Al11,oI28,71 Immm 0.4423,0.8842,1.3063,90,90,90 - - 7.74 X 5331
Gd-Zn Zn12Gd ThMn12,tI26,139 I4/mmm 0.8915,0.8915,0.5214,90,90,90 CaCu5-Zr4Al3 - 7.55 A 3117
Gd-Zn Zn17Gd2 hex Th2Ni17,hP38,194 P63 /mmc 0.898,0.898,0.877,90,90,120 CaCu5-Zr4Al3 - 7.73 A 39593
Gd-Zn Zn17Gd2 rhom Zn17Th2,hR57,166 R-3m 0.89963,0.89963,1.31691,90,90,120 CaCu5-Zr4Al3 gray 7.70 X 20156
Gd-Zn Zn2Gd KHg2,oI12,74 Imma 0.4446,0.7174,0.7585,90,90,90 AlB2 family - 7.91 A 39593
Gd-Zn Zn22Gd3 Zn22Ce3,tI100,141 I41/amd 0.89,0.89,2.1359,90,90,90 - - 7.50 A 39593
Gd-Zn Zn23Gd6 Th6Mn23,cF116,225 Fm-3m 1.275,1.275,1.275,90,90,90 - - 7.84 A 3117
Gd-Zn Zn3Gd Zn3Y,oP16,62 Pnma 0.6694,0.4418,1.0161,90,90,90 - - 7.81 A 39593
Gd-Zn Zn5Gd CaCu5,hP6,191 P6/mmm 0.5383,0.5383,0.4215,90,90,120 - - 7.60 X 7490
Handbook of Inorganic Substances – Edition 2015 : Data 99

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Gd-Zn Zn58 Gd13 Zn58 Gd13,hP142,194 P63/mmc 1.431,1.431,1.405,90,90,120 - - 7.78 X 6373


Gd-Zr Gd0.11 Zr0.89 rt Mg,hP2,194 P63/mmc 0.3265,0.3265,0.519,90,90,120 close-packed structure - 6.83 X 6916
Gd-Zr Gd0.985 Zr0.015 rt Mg,hP2,194 P63/mmc 0.3623,0.3623,0.5763,90,90,120 close-packed structure - 7.92 X 54843
Ge-Hf HfGe 2 ZrSi2,oS12,63 Cmcm 0.38154,1.5004,0.37798,90,90,90 close-packed structure - 9.94 X 838
Ge-Hf Hf2Ge CuAl2,tI12,140 I4/mcm 0.6596,0.6596,0.5291,90,90,90 - - 12.40 X 6743
Ge-Hf Hf3Ge Ti3P,tP32,86 P42/n 1.0901,1.0901,0.541,90,90,90 - - 12.57 A 25378
Ge-Hf Hf3Ge2 U3Si2,tP10,127 P4/mbm 0.706,0.706,0.372,90,90,90 - - 12.19 A 2863
Ge-Hf Hf5Ge3 Mn5 Si3,hP16,193 P63/mcm 0.7883,0.7883,0.5537,90,90,120 - - 12.37 X 1055
Ge-Hf Hf5Ge4 stab Sm5 Ge4,oP36,62 Pnma 0.7017,1.3434,0.7105,90,90,90 - - 11.73 X 23576
Ge-Ho HoGe TlI,oS8,63 Cmcm 0.4234,1.0577,0.3896,90,90,90 CrB(TlI)-FeB - 9.04 X 17169
Ge-Ho HoGe1.5 ht AlB2 ,hP3,191 P6/mmm 0.38952,0.38952,0.4092,90,90,120 AlB2 family - 8.46 X 34655
Ge-Ho HoGe1.56 ht ThSi2,tI12,141 I41/amd 0.4051,0.4051,1.3651,90,90,90 - - 8.25 A 24823
Ge-Ho HoGe1.8 *,o*48,* - 0.781,0.798,1.478,90,90,90 - - - N 13212
Ge-Ho HoGe1.85 YGe1.82 ,oS28,63 Cmcm 0.40809,2.965,0.39093,90,90,90 - - 8.40 X 34610
Ge-Ho HoGe3 DyGe3,oS16,63 Cmcm 0.39915,2.06976,0.38809,90,90,90 - - 7.93 X 50722
Ge-Ho Ho11 Ge10 Ho11 Ge10,tI84,139 I4/mmm 1.079,1.079,1.623,90,90,90 - - 8.93 X 3380
Ge-Ho Ho14 Ge23 Ho14 Ge23,oS148,20 C222 1 0.54021,1.3648,4.0000,90,90,90 - - 8.96 X 35846
Ge-Ho Ho2 Ge3 rt *,o*20,* - 0.6792,0.7862,0.8233,90,90,90 - - - N 24823
Ge-Ho Ho3 Ge4 rt Er3Ge4,oS28,63 Cmcm 0.40085,1.055,1.4132,90,90,90 - - 8.73 X 34655
Ge-Ho Ho3 Ge5 Y3Ge5,oF64,43 Fdd2 0.57158,1.71475,1.36332,90,90,90 - - 8.53 X 34610
Ge-Ho Ho5 Ge3 Mn5 Si3,hP16,193 P63/mcm 0.8368,0.8368,0.6283,90,90,120 - - 9.09 X 50660
Ge-Ho Ho5 Ge4 lt Ho5Ge4,mP36,11 P121/m1 0.7559,1.4544,0.7614,90,90.55,90 - - 8.85 X 53238
Ge-Ho Ho5 Ge4 rt Sm5 Ge4,oP36,62 Pnma 0.75841,1.45968,0.76541,90,90,90 - - 8.74 X 53238
Ge-I GeI2 4L tf CdI2 ,hP6,186 P63mc 0.417,0.417,1.333,90,90,120 CdI2-PbI2 polytype - 5.40 A 4263
Ge-I GeI2 tf CdI2 ,hP3,164 P-3m1 0.413,0.413,0.679,90,90,120 CdI2-PbI2 polytype - 5.40 X 148
Ge-I GeI2 GeI2 ,hP9,164 P-3m1 0.417,0.417,2.016,90,90,120 - - 5.36 X 4263
Ge-I GeI4 rt SnI4 ,cP40,205 Pa-3 1.20303,1.20303,1.20303,90,90,90 - - 4.43 X 28305
Ge-I Ge21.7 I5.3 Na4Si23,cP54,223 Pm-3n 1.0814,1.0814,1.0814,90,90,90 clathrate - 5.90 X 18876
Ge-Ir IrGe FeAs,oP8,62 Pnma 0.5611,0.349,0.6281,90,90,90 AlB2 family - 14.30 X 357
Ge-Ir IrGe 4 IrGe 4,hP15,152 P3121 0.6215,0.6215,0.7784,90,90,120 - - 9.23 X 4699
Ge-Ir Ir3Ge 7 Ru3Sn7,cI40,229 Im-3m 0.8753,0.8753,0.8753,90,90,90 - - 10.74 X 350
Ge-Ir Ir4Ge 5 Ir4Ge5,tP36,116 P-4c2 0.5615,0.5615,1.8308,90,90,90 chimney-ladder structure - 13.02 X 4190
Ge-K KGe hp NaPb,tI64,142 I41/acd 1.069,1.069,1.737,90,90,90 - - 2.99 A 16888
Ge-K KGe KGe,cP64,218 P-43n 1.2784,1.2784,1.2784,90,90,90 - black 2.84 X 45823
Ge-K KGe 4 *,cP*,* - 0.644,0.644,0.644,90,90,90 - - - N 22843
Ge-K K1.075 Ge17 Na1.5 Si17,cF160,227 Fd-3m 1.5302,1.5302,1.5302,90,90,90 clathrate - 4.73 X 52132
Ge-K K12Ge17 *,mP232,4 P1211 2.2655,1.3831,2.3966,90,90.76,90 - black 3.01 N 33729
Ge-K K4Ge 22 Cs4Sn22,cP78,223 Pm-3n 1.0686,1.0686,1.0686,90,90,90 - gray 4.77 X 57485
Ge-K K4Ge 22 Na4Si23,cP54,223 Pm-3n 1.06677,1.06677,1.06677,90,90,90 clathrate - 4.80 X 37725
Ge-K K4Ge 9 K4Ge9,hR372,161 R3c 2.1208,2.1208,2.5096,90,90,120 - red deep 3.30 X 49629
Ge-La LaGe ht FeB-b,oP8,62 Pnma 0.84271,0.41228,0.61215,90,90,90 CrB(TlI)-FeB gray silver 6.61 X 57496
Ge-La LaGe rt LaSi,oS16,63 Cmcm 0.4559,1.3766,0.6745,90,90,90 - gray silver 6.64 X 44110
Ge-La LaGe 1.6 rt GdSi1.4 ,oI12,74 Imma 0.4268,0.42735,1.4404,90,90,90 - black 6.45 X 24656
Ge-La LaGe 1.78 mon2 *,m**,* - 0.4411,0.4296,1.4188,90,90.06,90 - - - N 35901
Ge-La LaGe 1.78 mon3 *,m**,* - 0.4409,0.4301,1.4192,90,90.12,90 - - - N 35901
Ge-La LaGe 1.86 mon1 *,m**,* - 0.4416,0.4323,1.4179,90,90.11,90 - - - N 35901
Ge-La LaGe 2 ht ThSi2,tI12,141 I41/amd 0.433,0.433,1.423,90,90,90 - - 7.07 X 2286
Ge-La LaGe 3 BaPb3,hR36,166 R-3m 0.6376,0.6376,2.2272,90,90,120 close-packed structure - 6.80 X 56330
Ge-La LaGe 5 hp LaGe5,oI12,71 Immm 0.4029,0.6307,0.9978,90,90,90 - - 6.57 X 42175
Ge-La La3Ge ht Ti3P,tP32,86 P42/n 1.27391,1.27391,0.6294,90,90,90 - - 6.36 X 20721
Ge-La La3Ge rt Fe3C-b,oP16,62 Pnma 0.7416,0.9954,0.6497,90,90,90 - - 6.78 A 27429
Ge-La La3Ge 5 rt Y3Ge5,oF64,43 Fdd2 0.6056,1.8156,1.4328,90,90,90 - - 6.57 A 35901
Ge-La La4Ge 3 rt Th3P 4,cI28,220 I-43d 0.93563,0.93563,0.93563,90,90,90 - - 6.27 X 2926
Ge-La La4Ge 7 Nd4Ge7,oS44,20 C222 1 0.6042,1.438,1.208,90,90,90 - - 6.73 A 35901
Ge-La La5Ge 3 Mn5 Si3,hP16,193 P63/mcm 0.89409,0.89409,0.68784,90,90,120 - - 6.36 X 27301
Ge-La La5Ge 4 rt Sm5 Ge4,oP36,62 Pnma 0.80761,1.55209,0.81725,90,90,90 - - 6.39 X 41728
Ge-Li LiGe hp LiGe,tI24,141 I41/amd 0.40529,0.40529,2.3282,90,90,90 - - 4.14 X 19955
Ge-Li LiGe LiGe,tI32,88 I41/a 0.9764,0.9764,0.5784,90,90,90 - black 3.83 X 33000
Ge-Li Li11 Ge6 Li11Ge6,oS68,63 Cmcm 0.438,2.455,1.064,90,90,90 - gray silver 2.97 X 9480
Ge-Li Li12 Ge7 Li12Si7,oP152,62 Pnma 0.8763,2.0115,1.4642,90,90,90 - - 3.04 A 39402
Ge-Li Li15 Ge4 Cu15 Si4,cI76,220 I-43d 1.072,1.072,1.072,90,90,90 - - 2.13 X 2448
Ge-Li Li17 Ge4 Li17Ge4,cF436,216 F-43m 1.8756,1.8756,1.8756,90,90,90 - red dark 2.06 X 38919
Ge-Li Li7Ge12 Na7Sn12,mP78,13 P12/c1 1.1527,0.8031,1.91994,90,126.897,90 - gray silver 4.30 X 57341
Ge-Li Li7Ge2 Li7Ge2,oS36,65 Cmmm 0.924,1.321,0.463,90,90,90 - gray 2.28 X 7072
Ge-Li Li9Ge4 Li9Ge4,oS52,63 Cmcm 0.449,0.787,2.444,90,90,90 - purple dark 2.71 X 5614
Ge-Lu LuGe1.5 ht AlB2 ,hP3,191 P6/mmm 0.383,0.383,0.405,90,90,120 AlB2 family - 9.16 X 2286
Ge-Lu LuGe2 ZrSi2,oS12,63 Cmcm 0.3984,1.556,0.3854,90,90,90 close-packed structure - 8.90 A 23535
Ge-Lu Lu11 Ge10 Ho11 Ge10,tI84,139 I4/mmm 1.0668,1.0668,1.598,90,90,90 - - 9.68 A 20023
Ge-Lu Lu2Ge 3 rt *,o*20,* - 0.6629,0.7585,0.8069,90,90,90 - - - N 20023
Ge-Lu Lu3Ge 4 rt Er3Ge4,oS28,63 Cmcm 0.3968,1.0438,1.404,90,90,90 - - 9.31 A 28808
Ge-Lu Lu5Ge 3 Mn5 Si3,hP16,193 P63/mcm 0.823,0.823,0.616,90,90,120 - - 10.04 X 4619
Ge-Lu Lu5Ge 4 ht Sm5 Ge4,oP36,62 Pnma 0.746,1.429,0.746,90,90,90 - - 9.73 A 20023
Ge-Mg Mg2 Ge hp *,hP45,* - 1.254,1.254,0.649,90,90,120 - - - N 10195
Ge-Mg Mg2 Ge hp-ht *,hP*,* - 0.72,0.72,0.824,90,90,120 - - - N 2356
Ge-Mg Mg2 Ge CaF2 ,cF12,225 Fm-3m 0.63849,0.63849,0.63849,90,90,90 fluorite family gray silver 3.10 X 31729
Ge-Mn MnGe hp FeSi,cP8,198 P213 0.47925,0.47925,0.47925,90,90,90 - - 7.70 X 59243
Ge-Mn MnGe lt MnGe,oP8,19 P212121 0.47807,0.47808,0.47938,90,90,90 - - 7.73 X 59243
Ge-Mn MnGe4 hp *,tI*,* - 1.103,1.103,0.5598,90,90,90 - - - N 23775
100 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ge-Mn Mn0.03 Ge0.97 C,cF8,227 Fd-3m 0.56587,0.56587,0.56587,90,90,90 - - 5.28 X 52646


Ge-Mn Mn0.1 Ge0.9 m C,cF8,227 Fd-3m 0.56576,0.56576,0.56576,90,90,90 - - 5.20 X 50165
Ge-Mn Mn0.77 Ge0.23 rt In,tI2,139 I4/mmm 0.2689,0.2689,0.3618,90,90,90 close-packed structure - 7.49 X 25379
Ge-Mn Mn0.86 Ge0.14 ht3 Cu,cF4,225 Fm-3m 0.3721,0.3721,0.3721,90,90,90 close-packed structure - 7.40 X 327
Ge-Mn Mn0.9225 Ge 0.0775 ht1 Mn,cP20,213 P4132 0.6344,0.6344,0.6344,90,90,90 - - 7.32 A 327
Ge-Mn Mn0.9225 Ge 0.0775 rt Mn,cI58,217 I-43m 0.8946,0.8946,0.8946,90,90,90 - - 7.57 A 327
Ge-Mn Mn11Ge8 Cr11Ge8,oP76,62 Pnma 1.3214,0.50905,1.588,90,90,90 - gray 7.37 X 16906
Ge-Mn Mn2Ge ht Co1.75 Ge,hP6,194 P63 /mmc 0.4171,0.4171,0.5278,90,90,120 AlB2 family - 7.62 X 25379
Ge-Mn Mn23Ge9 ht Mn23Ge9,hP128,158 P3c1 0.7198,0.7198,3.9227,90,90,120 - - 7.23 X 19914
Ge-Mn Mn3Ge ht Mg3Cd,hP8,194 P63 /mmc 0.5346,0.5346,0.4316,90,90,120 close-packed structure - 7.38 A 21671
Ge-Mn Mn3Ge rt Cu3Au,cP4,221 Pm-3m 0.38019,0.38019,0.38019,90,90,90 close-packed structure - 7.17 X 40296
Ge-Mn Mn3Ge5 hp Ir3Ga5,tP32,118 P-4n2 0.5745,0.5745,1.389,90,90,90 chimney-ladder structure - 7.65 A 20372
Ge-Mn Mn5Ge2 ht Mn5Ge2,hP42,158 P3c1 0.7198,0.7198,1.3076,90,90,120 - - 7.13 X 19972
Ge-Mn Mn5Ge2 rt Mg5Ga2,oI28,72 Ibam 0.6156,1.1807,0.5374,90,90,90 - - 7.14 X 20470
Ge-Mn Mn5Ge3 rt Mn5Si3,hP16,193 P63 /mcm 0.7184,0.7184,0.5059,90,90,120 - - 7.23 X 23610
Ge-Mo MoGe1.7 *,tI*,98 I4122 0.5944,0.5944,4.3995,90,90,90 - - - N 2754
Ge-Mo MoGe2 hp MoSi2,tI6,139 I4/mmm 0.3313,0.3313,0.8195,90,90,90 b.c.c. family - 8.90 X 514
Ge-Mo MoGe2 rt tf PbCl2,oP12,62 Pnma 0.6343,0.3451,0.8582,90,90,90 - - 8.53 X 2754
Ge-Mo Mo13Ge23 Mo13Ge23,tP144,118 P-4n2 0.5987,0.5987,6.354,90,90,90 chimney-ladder structure - 8.51 X 3785
Ge-Mo Mo3Ge Cr3Si,cP8,223 Pm-3n 0.493,0.493,0.493,90,90,90 Frank-Kasper phase - 9.99 X 8581
Ge-Mo Mo5Ge3 rt W5Si3,tI32,140 I4/mcm 0.9845,0.9845,0.4965,90,90,90 - gray silver 9.63 X 25630
Ge-Mo Mo5Ge3 stab Mn5Si3,hP16,193 P63 /mcm 0.7369,0.7369,0.5047,90,90,120 - - 9.76 A 2299
Ge-N Ge3N4 hp Fe3O4,cF56,227 Fd-3m 0.82125,0.82125,0.82125,90,90,90 spinel family - 6.57 X 35611
Ge-N Ge3N4 ht Si3N4,hP14,176 P63 /m 0.80276,0.80276,0.30774,90,90,120 - - 5.29 X 6975
Ge-N Ge3N4 rt Si3N4,hP28,159 P31c 0.8196,0.8196,0.59301,90,90,120 - - 5.27 X 6975
Ge-Na NaGe NaGe,mP32,14 P121/c1 1.192,0.670,1.142,90,116.3,90 - - 3.11 X 2397
Ge-Na NaGe4 *,cP*,* - 0.64,0.64,0.64,90,90,90 - - - N 22843
Ge-Na Na0.07 Ge17 Na0.375 Si17 ,cF144,227 Fd-3m 1.52115,1.52115,1.52115,90,90,90 clathrate - 4.66 X 47227
Ge-Na Na12Ge17 Na12Ge17,mP528,14 P121/c1 2.21117,1.2803,4.1557,90,91.31,90 - black 3.41 X 42395
Ge-Na Na4Ge13 Na4Ge13,hP44,175 P6/m 1.50052,1.50052,0.39546,90,90,120 - - 4.46 X 48168
Ge-Na Na5.70 Ge24.62 Na5.70 Ge24.62 ,hP33,175 P6/m 1.5054,1.5054,0.39685,90,90,120 - - 4.09 X 54904
Ge-Nb NbGe2 CrSi2,hP9,180 P6222 0.4967,0.4967,0.6783,90,90,120 - - 8.18 X 6541
Ge-Nb Nb0.7 Ge0.3 m *,cP*,* - 0.746,0.746,0.746,90,90,90 - - - N 16074
Ge-Nb Nb0.9 Ge0.1 W,cI2,229 Im-3m 0.32942,0.32942,0.32942,90,90,90 b.c.c. family - 8.44 X 11637
Ge-Nb Nb10Ge7 rt Nb10Ge7,hP51,164 P-3m1 1.337,1.337,0.537,90,90,120 - - 8.61 X 23704
Ge-Nb Nb3Ge m cub Cu3Au,cP4,221 Pm-3m 0.458,0.458,0.458,90,90,90 close-packed structure - 6.07 X 13311
Ge-Nb Nb3Ge m tet Ti3P,tP32,86 P42 /n 1.097,1.097,0.558,90,90,90 - - 6.95 A 13311
Ge-Nb Nb3.2 Ge0.8 Cr3Si,cP8,223 Pm-3n 0.51692,0.51692,0.51692,90,90,90 Frank-Kasper phase - 8.54 X 12114
Ge-Nb Nb5Ge3 ht W5Si3,tI32,140 I4/mcm 1.0146,1.0146,0.5136,90,90,90 - - 8.57 X 8828
Ge-Nb Nb5Ge3 m Cr5B3,tI32,140 I4/mcm 0.6678,0.6678,1.205,90,90,90 - - 8.43 A 16074
Ge-Nb Nb5Ge3 stab Mn5Si3,hP16,193 P63 /mcm 0.7718,0.7718,0.537,90,90,120 - - 8.18 X 786
Ge-Nb Nb5Ge3.5 ht Ti5Ga4,hP18,193 P63 /mcm 0.7783,0.7783,0.5388,90,90,120 AlB2 family - 8.44 X 38854
Ge-Nb Nb6Ge *,hP*,* - 0.5346,0.5346,0.5021,90,90,120 - - - N 10338
Ge-Nd NdGe TlI,oS8,63 Cmcm 0.4482,1.1102,0.4065,90,90,90 CrB(TlI)-FeB - 7.12 X 18118
Ge-Nd NdGe1.6 rt GdSi1.4 ,oI12,74 Imma 0.417,0.422,1.403,90,90,90 - - 7.01 A 8217
Ge-Nd NdGe1.642 rt *,o**,* - 0.5894,0.5898,1.4065,90,90,90 - - - N 35901
Ge-Nd NdGe1.66 ht ThSi2,tI12,141 I41/amd 0.418,0.418,1.398,90,90,90 - - 7.20 X 38780
Ge-Nd NdGe1.67 YGe1.67 ,hP24,190 P-62c 0.7008,0.7008,0.8604,90,90,120 - - 7.23 A 35830
Ge-Nd NdGe1.760 rt *,o**,* - 0.5984,0.5987,1.3914,90,90,90 - - - N 35901
Ge-Nd NdGe3.25 hp Y(Ga0.13 Ge0.87 )3.34 ,oS20,65 Cmmm 0.4073,2.0961,0.4254,90,90,90 - - 6.95 X 53861
Ge-Nd NdGe5 rt LaGe5,oI12,71 Immm 0.3993,0.62,0.9865,90,90,90 - black 6.90 X 52886
Ge-Nd Nd2Ge9 Nd2Ge9,oP22,59 Pmmn 0.39634,0.95405,1.2384,90,90,90 - - 6.68 X 59433
Ge-Nd Nd3Ge5 Y3Ge5,oF64,43 Fdd2 0.5899,1.7696,1.4008,90,90,90 - - 7.23 X 22500
Ge-Nd Nd4Ge7 Nd4Ge7,oS44,20 C222 1 0.5958,1.3857,1.1919,90,90,90 - - 7.32 X 35901
Ge-Nd Nd5Ge3 Mn5Si3,hP16,193 P63 /mcm 0.8743,0.8743,0.6625,90,90,120 - - 7.11 X 37433
Ge-Nd Nd5Ge4 Sm5Ge4,oP36,62 Pnma 0.7841,1.5071,0.7937,90,90,90 - - 7.16 X 14352
Ge-Ni NiGe FeAs,oP8,62 Pnma 0.5381,0.3428,0.5811,90,90,90 AlB2 family - 8.14 X 357
Ge-Ni NiGe2 hp CoGe2,oS24,64 Cmce 1.083,0.5763,0.5762,90,90,90 - gray 7.53 X 37357
Ge-Ni Ni0.92 Ge0.08 Cu,cF4,225 Fm-3m 0.354,0.354,0.354,90,90,90 close-packed structure - 8.96 X 17833
Ge-Ni Ni1.38 Ge ht Co1.75 Ge,hP6,194 P63 /mmc 0.382,0.382,0.498,90,90,120 AlB2 family - 8.11 X 30117
Ge-Ni Ni1.48 Ge0.52 ht NaTl,cF16,227 Fd-3m 0.57436,0.57436,0.57436,90,90,90 b.c.c. family - 8.74 X 12000
Ge-Ni Ni19Ge12 ht Ni19Ge12,mS62,5 C121 1.1631,0.6715,1.0048,90,90,90 - - 8.41 X 6016
Ge-Ni Ni2Ge ht Co1.75 Ge,hP6,194 P63 /mmc 0.3948,0.3948,0.5036,90,90,120 AlB2 family - 9.28 X 1854
Ge-Ni Ni2Ge rt Co2Si-b,oP12,62 Pnma 0.5113,0.383,0.7264,90,90,90 - - 8.87 X 6016
Ge-Ni Ni3Ge Cu3Au,cP4,221 Pm-3m 0.3572,0.3572,0.3572,90,90,90 close-packed structure - 9.06 X 17354
Ge-Ni Ni5Ge2 ht Pd5Sb2,hP42,185 P63 cm 0.6827,0.6827,1.2395,90,90,120 - - 8.74 A 6016
Ge-Ni Ni5Ge3 rt Ni5Ge3,mS32,5 C121 1.0763,0.6737,0.6364,90,121.06,90 - - 8.59 X 6016
Ge-Ni Ni7Ge4 rt *,mS44,12 C12/m1 1.013,0.78,0.683,90,90.4,90 - - - N 3761
Ge-Np NpGe1.59 AlB2,hP3,191 P6/mmm 0.39686,0.39686,0.41705,90,90,120 AlB2 family - 10.29 X 39085
Ge-Np NpGe1.72 ThSi2,tI12,141 I41/amd 0.408,0.408,1.3909,90,90,90 - - 10.38 X 39085
Ge-Np NpGe3 Cu3Au,cP4,221 Pm-3m 0.42114,0.42114,0.42114,90,90,90 close-packed structure - 10.11 X 39085
Ge-Np Np34Ge33.7 U34Si34.5,tI138,139 I4/mmm 1.09117,1.09117,2.5358,90,90,90 - - 11.56 X 39085
Ge-Np Np5Ge3 W5Si3,tI32,140 I4/mcm 1.1434,1.1434,0.55197,90,90,90 - - 12.91 X 39085
Ge-Np Np5Ge4 Ti5Ga4,hP18,193 P63 /mcm 0.88004,0.88004,0.59274,90,90,120 AlB2 family - 12.33 X 39085
Ge-O GeO m *,c**,* - 0.56447,0.56447,0.56447,90,90,90 - - - N 622
Ge-O GeO2 cri SiO2,tP12,92 P41212 0.499,0.499,0.706,90,90,90 - - 3.95 X 6155
Ge-O GeO2 hp cub FeS2,cP12,205 Pa-3 0.43365,0.43365,0.43365,90,90,90 pyrite-marcasite family - 8.52 X 41286
Ge-O GeO2 hp mon SiO2,mP20,14 P121/c1 0.72917,0.432,0.541,90,100.07,90 - - 6.21 X 37986
Handbook of Inorganic Substances – Edition 2015 : Data 101

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ge-O GeO2 hp1 CaCl2,oP6,58 Pnnm 0.42025,0.42499,0.28039,90,90,90 - - 6.94 X 41286


Ge-O GeO2 hp2 Fe2N0.94 ,oP12,60 Pbcn 0.40423,0.50396,0.45288,90,90,90 - - 7.53 X 42176
Ge-O GeO2 ht hex SiO2 ,hP9,180 P6222 0.4986,0.4986,0.5647,90,90,120 - - 4.29 A 1409
Ge-O GeO2 ht SiO2 ,hP9,152 P3121 0.4989,0.4989,0.56527,90,90,120 - colorless 4.28 X 58414
Ge-O GeO2 rt TiO2 ,tP6,136 P42/mnm 0.44019,0.44019,0.28651,90,90,90 - colorless 6.26 X 38278
Ge-Os OsGe 2 OsGe 2,mS12,12 C12/m1 0.8995,0.3094,0.7685,90,119.17,90 - - 11.93 X 1333
Ge-Os Os2Ge3 rt Ru2Ge3,oP40,60 Pbcn 1.1544,0.9281,0.5783,90,90,90 chimney-ladder structure - 12.83 A 7980
Ge-P GeP hp1 *,hP*,* - 1.002,1.002,1.392,90,90,120 - - - N 3723
Ge-P GeP hp2 *,hP*,* - 0.8603,0.8603,1.2622,90,90,120 - - - N 3723
Ge-P GeP hp3 *,hP*,* - 0.8192,0.8192,1.244,90,90,120 - - - N 3723
Ge-P GeP hp4 *,t**,* - 0.6809,0.6809,0.828,90,90,90 - - - N 3723
Ge-P GeP hp6 ZnS,cF8,216 F-43m 0.54861,0.54861,0.54861,90,90,90 adamantane structure - 4.17 X 48494
Ge-P GeP hp7 *,t**,* - 0.7101,0.7101,0.9129,90,90,90 - - - N 3723
Ge-P GeP hp8 *,c**,* - 0.6451,0.6451,0.6451,90,90,90 - - - N 3723
Ge-P GeP hp9 GeP,tI4,107 I4mm 0.3544,0.3544,0.5581,90,90,90 - black 4.91 X 5397
Ge-P GeP SiAs,mS24,12 C12/m1 1.514,0.3638,0.919,90,101.1,90 - - 4.15 A 3418
Ge-P GeP2 hp FeS2 ,cP12,205 Pa-3 0.5619,0.5619,0.5619,90,90,90 pyrite-marcasite family - 5.04 A 3723
Ge-P GeP3 hp SnP 3 ,hR24,166 R-3m 0.705,0.705,0.9932,90,90,120 - - 3.86 X 6846
Ge-P GeP5 hp *,hR*,* - 0.3467,0.3467,1.004,90,90,120 - - - N 5397
Ge-P Ge0.5 P0.5 hp5 C,cF8,227 Fd-3m 0.5581,0.5581,0.5581,90,90,90 - - 3.96 X 3723
Ge-Pb Pb0.87 Ge0.13 m Cu,cF4,225 Fm-3m 0.49225,0.49225,0.49225,90,90,90 close-packed structure - 10.56 X 13406
Ge-Pd PdGe FeAs,oP8,62 Pnma 0.5782,0.3481,0.6259,90,90,90 AlB2 family - 9.44 X 357
Ge-Pd Pd0.84 Ge0.16 ht W,cI2,229 Im-3m 0.3137,0.3137,0.3137,90,90,90 b.c.c. family - 10.87 X 1979
Ge-Pd Pd0.91 Ge0.09 Cu,cF4,225 Fm-3m 0.3883,0.3883,0.3883,90,90,90 close-packed structure - 11.73 X 14267
Ge-Pd Pd2Ge Fe2P,hP9,189 P-62m 0.6712,0.6712,0.3408,90,90,120 Fe2P family red wine 10.69 X 10735
Ge-Pd Pd21 Ge8 Pt8Al21,tI116,88 I41/a 1.3067,1.3067,1.0033,90,90,90 - - 10.92 X 10759
Ge-Pd Pd25 Ge9 ht Pd25 Ge9,hP34,147 P-3 0.7351,0.7351,1.0605,90,90,120 - - 11.09 X 9101
Ge-Pd Pd5Ge Pd5As,mS24,5 C121 0.5509,0.7725,0.8375,90,98.09,90 - - 11.38 A 11609
Ge-Pr PrGe ht FeB-b,oP8,62 Pnma 0.8294,0.4053,0.5982,90,90,90 CrB(TlI)-FeB - 7.05 X 18118
Ge-Pr PrGe rt TlI,oS8,63 Cmcm 0.44808,1.1087,0.405,90,90,90 CrB(TlI)-FeB - 7.05 X 58644
Ge-Pr PrGe 1.6 ht ThSi2,tI12,141 I41/amd 0.4228,0.4228,1.4,90,90,90 - - 6.82 X 28919
Ge-Pr PrGe 3.36 hp Y(Ga0.13 Ge0.87 )3.34 ,oS20,65 Cmmm 0.4062,2.143,0.4212,90,90,90 - - 6.97 X 53861
Ge-Pr PrGe 5 LaGe5,oI12,71 Immm 0.3998,0.6228,0.9887,90,90,90 - - 6.80 X 52886
Ge-Pr Pr3Ge Ti3P,tP32,86 P42/n 1.2422,1.2422,0.6118,90,90,90 - - 6.97 A 20721
Ge-Pr Pr3Ge5 rt Y3Ge5,oF64,43 Fdd2 0.5937,1.7817,1.4111,90,90,90 - - 6.99 A 35901
Ge-Pr Pr4Ge3 Th3P 4,cI28,220 I-43d 0.9146,0.9146,0.9146,90,90,90 - - 6.78 A 51964
Ge-Pr Pr4Ge7 rt Nd4Ge7,oS44,20 C222 1 0.6007,1.3987,1.2009,90,90,90 - gray steel 7.06 X 51964
Ge-Pr Pr5Ge3 rt Mn5 Si3,hP16,193 P63/mcm 0.8804,0.8804,0.6588,90,90,120 - - 6.93 X 53171
Ge-Pr Pr5Ge4 Sm5 Ge4,oP36,62 Pnma 0.79172,1.51916,0.80112,90,90,90 - - 6.86 X 43748
Ge-Pt PtGe FeAs,oP8,62 Pnma 0.5719,0.3697,0.6084,90,90,90 AlB2 family - 13.82 X 7137
Ge-Pt PtGe 2 CaCl2,oP6,58 Pnnm 0.5767,0.6185,0.2908,90,90,90 - - 10.90 X 1128
Ge-Pt Pt0.95 Ge0.05 Cu,cF4,225 Fm-3m 0.392,0.392,0.392,90,90,90 close-packed structure - 20.84 X 20897
Ge-Pt Pt2Ge Fe2P,hP9,189 P-62m 0.668,0.668,0.353,90,90,120 Fe2P family - 16.90 A 546
Ge-Pt Pt2Ge3 Pt2Ge3,oP20,62 Pnma 1.643,0.3378,0.6221,90,90,90 - - 11.70 X 1335
Ge-Pt Pt3Ge ht Ir3Si,tI16,140 I4/mcm 0.5499,0.5499,0.7933,90,90,90 close-packed structure - 18.22 X 13355
Ge-Pt Pt3Ge rt Pt3Ge,mS16,12 C12/m1 0.7769,0.7767,0.5520,90,134.09,90 close-packed structure - 18.27 X 1335
Ge-Pt Pt3Ge2 Pt3Ge2,oP40,62 Pnma 1.2240,0.7549,0.6854,90,90,90 - - 15.32 X 9903
Ge-Rb RbGe hp NaPb,tI64,142 I41/acd 1.104,1.104,1.787,90,90,90 - - 3.86 A 16888
Ge-Rb RbGe KGe,cP64,218 P-43n 1.3198,1.3198,1.3198,90,90,90 - black 3.65 X 45823
Ge-Rb RbGe4 *,cP*,* - 0.65,0.65,0.65,90,90,90 - - - N 22843
Ge-Rb Rb12 Ge17 *,h**,* - 2.9156,2.9156,14.2703,90,90,120 - gray dark - N 41732
Ge-Rb Rb4Ge 23 rt Na4Si23,cP54,223 Pm-3n 1.07,1.07,1.07,90,90,90 clathrate - 5.45 A 5445
Ge-Rb Rb4Ge 9 Cs4Ge9,tP208,76 P41 1.5154,1.5154,3.082,90,90,90 - red ruby 3.74 A 32846
Ge-Re Re3Ge 7 Re3Ge7,oS40,63 Cmcm 0.3227,0.9045,2.1956,90,90,90 - greenish 11.06 X 16138
Ge-Re Re4Ge 7 hp Mn4 Si7,tP44,116 P-4c2 0.5895,0.5895,1.886,90,90,90 chimney-ladder structure - 12.70 A 15256
Ge-Rh RhGe hp FeSi,cP8,198 P213 0.4862,0.4862,0.4862,90,90,90 - - 10.14 X 15284
Ge-Rh RhGe FeAs,oP8,62 Pnma 0.57,0.325,0.648,90,90,90 AlB2 family - 9.71 X 656
Ge-Rh RhGe4 hp IrGe 4,hP15,152 P3121 0.619,0.619,0.7802,90,90,120 - - 7.57 A 17144
Ge-Rh Rh17 Ge22 Rh17 Ge22,tI156,122 I-42d 0.5604,0.5604,7.845,90,90,90 chimney-ladder structure - 9.02 X 3329
Ge-Rh Rh2Ge Co2Si-b,oP12,62 Pnma 0.544,0.4,0.757,90,90,90 - - 11.23 X 656
Ge-Rh Rh5Ge 3 Rh5Ge3,oP16,55 Pbam 0.542,1.032,0.396,90,90,90 - - 10.98 X 656
Ge-Ru RuGe rt FeSi,cP8,198 P213 0.48468,0.48468,0.48468,90,90,90 - - 10.13 X 33624
Ge-Ru Ru17 Ge22 Ru17 Ge22,tP92,118 P-4n2 1.1428,1.1428,0.9237,90,90,90 - - 9.13 X 25961
Ge-Ru Ru2Ge 3 ht Ru2Sn3,tP20,116 P-4c2 0.5739,0.5739,0.9952,90,90,90 chimney-ladder structure - 8.51 X 9085
Ge-Ru Ru2Ge 3 rt Ru2Ge3,oP40,60 Pbcn 1.14477,0.92438,0.57182,90,90,90 chimney-ladder structure - 9.22 X 33624
Ge-S GeS ht *,hP*,182 P6322 0.8706,0.8706,0.8731,90,90,120 - - - N 5257
Ge-S GeS rt GeS,oP8,62 Pnma 1.0481,0.3646,0.4299,90,90,90 - gray steel 4.23 X 11994
Ge-S GeS2 hp1 ZnCl2,tI12,122 I-42d 0.4977,0.4977,0.95355,90,90,90 - - 3.84 X 52641
Ge-S GeS2 hp2 *,t*6,* - 0.3474,0.3474,1.0995,90,90,90 - - - N 15419
Ge-S GeS2 hp3 *,o*24,* - 0.627,0.678,1.196,90,90,90 - - - N 15419
Ge-S GeS2 ht GeS2,mP48,14 P121/c1 0.6720,1.6101,1.1436,90,90.88,90 - - 2.94 X 8777
Ge-S GeS2 rt GeS2,mP36,7 P1c1 0.6796,2.255,0.6809,90,119.29,90 - white 2.99 X 9523
Ge-S GeS2 tet ZnI2 ,tI96,142 I41/acd 1.1065,1.1065,1.87178,90,90,90 - white 3.17 X 34124
Ge-Sb GeSb m CoO,tI4,139 I4/mmm 0.4154,0.4154,0.6204,90,90,90 rocksalt family - 6.03 X 6824
Ge-Sb Ge0.35 Sb0.65 hp (Ge0.35 Sb0.65 ),tI4,139 I4/mmm 0.4084,0.4084,0.6228,90,90,90 - - 6.69 X 16598
Ge-Sc ScGe TlI,oS8,63 Cmcm 0.4007,1.006,0.3762,90,90,90 CrB(TlI)-FeB - 5.15 X 2482
Ge-Sc ScGe 2 ZrSi2,oS12,63 Cmcm 0.3888,1.4873,0.3793,90,90,90 close-packed structure - 5.76 X 2304
Ge-Sc Sc11 Ge10 Ho11 Ge10,tI84,139 I4/mmm 1.012,1.012,1.554,90,90,90 - - 5.09 A 25379
102 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ge-Sc Sc5Ge3 Mn5Si3,hP16,193 P63 /mcm 0.7939,0.7939,0.5883,90,90,120 - - 4.58 X 1578


Ge-Sc Sc5Ge4 Sm5Ge4,oP36,62 Pnma 0.7118,1.379,0.714,90,90,90 - - 4.88 A 25378
Ge-Se GeSe ht NaCl,cF8,225 Fm-3m 0.573,0.573,0.573,90,90,90 rocksalt family - 5.35 X 9405
Ge-Se GeSe rt GeS,oP8,62 Pnma 1.0825,0.3833,0.4388,90,90,90 - gray 5.53 X 11994
Ge-Se GeSe2 hp1 GeSe2,tI12,82 I-4 0.55073,0.55073,0.99374,90,90,90 - - 5.08 X 37580
Ge-Se GeSe2 hp2 GeSe2,tP12,81 P-4 0.53389,0.53389,1.00361,90,90,90 - - 5.35 X 37580
Ge-Se GeSe2 ht GeS2,mP48,14 P121/c1 0.7016,1.6796,1.1831,90,90.65,90 - golden 4.39 X 9616
Ge-Se GeSe2 ht-hp *,o*24,* - 0.7071,0.733,1.212,90,90,90 - - - N 15419
Ge-Se Ge4Se9 Ge4Se9,oP52,29 Pca21 1.7805,0.7002,1.2071,90,90,90 - orange 4.42 X 44217
Ge-Si Ge0.04 Si0.96 rt C,cF8,227 Fd-3m 0.54401,0.54401,0.54401,90,90,90 - - 2.46 X 51159
Ge-Si Ge0.5 Si0.5 hp Sn,tI4,141 I41/amd 0.473,0.473,0.252,90,90,90 - - 5.93 X 15594
Ge-Sm SmGe TlI,oS8,63 Cmcm 0.4387,1.089,0.3993,90,90,90 CrB(TlI)-FeB - 7.76 X 2905
Ge-Sm SmGe1.5 ht2 AlB2,hP3,191 P6/mmm 0.4002,0.4002,0.4244,90,90,120 AlB2 family - 7.31 X 43086
Ge-Sm SmGe1.741 rt *,o**,* - 0.5906,0.5907,1.3799,90,90,90 - - - N 35901
Ge-Sm SmGe2 ThSi2,tI12,141 I41/amd 0.418,0.418,1.38,90,90,90 - - 8.14 X 2286
Ge-Sm SmGe5 rt SmGe5,oI18,71 Immm 0.39805,0.61522,0.9839,90,90,90 - black 7.08 X 53561
Ge-Sm Sm2Ge9 Nd2Ge9,oP22,59 Pmmn 0.39546,0.9464,1.2321,90,90,90 - - 6.87 A 59433
Ge-Sm Sm3Ge5 ht Sm3Ge5,hP16,190 P-62c 0.69238,0.69238,0.8491,90,90,120 - - 7.67 X 46486
Ge-Sm Sm3Ge5 rt Y3Ge5,oF64,43 Fdd2 0.58281,1.7476,1.38749,90,90,90 - - 7.65 X 46486
Ge-Sm Sm4Ge6.89 Nd4Ge7,oS44,20 C222 1 0.589,1.3836,1.1788,90,90,90 - - 7.62 A 35901
Ge-Sm Sm5Ge3 Mn5Si3,hP16,193 P63 /mcm 0.864,0.864,0.652,90,90,120 - - 7.64 X 4619
Ge-Sm Sm5Ge4 Sm5Ge4,oP36,62 Pnma 0.775,1.494,0.784,90,90,90 - - 7.63 X 3320
Ge-Sn Sn0.032 Ge0.968 m C,cF8,227 Fd-3m 0.5662,0.5662,0.5662,90,90,90 - - 5.42 X 4041
Ge-Sr SrGe TlI,oS8,63 Cmcm 0.486,1.14,0.419,90,90,90 CrB(TlI)-FeB - 4.58 X 3775
Ge-Sr SrGe0.76 rt SrSi,oI40,71 Immm 0.484,1.338,1.852,90,90,90 - - 3.95 X 8678
Ge-Sr SrGe1.85 ht AlB2,hP3,191 P6/mmm 0.4259,0.4259,0.4578,90,90,120 AlB2 family - 5.12 X 44930
Ge-Sr SrGe2 hp EuGe2,hP3,164 P-3m1 0.4104,0.4104,0.5165,90,90,120 AlB2 family - 5.13 X 12892
Ge-Sr SrGe2 BaSi2,oP24,62 Pnma 0.8739,0.6567,1.1215,90,90,90 - - 4.81 X 44930
Ge-Sr SrGe5.5 SrGe5.5 ,oS44,63 Cmcm 0.40981,1.1159,1.26825,90,90,90 - gray silver 5.58 X 44655
Ge-Sr Sr2Ge Co2Si-b,oP12,62 Pnma 0.813,0.52,0.958,90,90,90 - - 4.06 X 9488
Ge-Sr Sr5Ge3 Cr5B3,tI32,140 I4/mcm 0.8134,0.8134,1.5771,90,90,90 - black gray 4.18 X 36728
Ge-Sr Sr7Ge6 Ca7Sn6,oP52,62 Pnma 0.779,2.358,0.859,90,90,90 - - 4.42 X 58930
Ge-Ta TaGe2 CrSi2,hP9,180 P6222 0.4938,0.4938,0.673,90,90,120 - - 11.43 X 6541
Ge-Ta Ta3Ge ht Ni3P,tI32,82 I-4 1.03421,1.03421,0.51532,90,90,90 - - 14.83 X 14411
Ge-Ta Ta3Ge ht1 Ti3P,tP32,86 P42 /n 1.02679,1.02679,0.52167,90,90,90 - - 14.87 A 15272
Ge-Ta Ta5Ge3 ht W5Si3,tI32,140 I4/mcm 1.001,1.001,0.515,90,90,90 - - 14.45 X 786
Ge-Ta Ta5Ge3 rt Cr5B3,tI32,140 I4/mcm 0.6599,0.6599,1.201,90,90,90 - - 14.26 X 786
Ge-Ta Ta5Ge3 stab Mn5Si3,hP16,193 P63 /mcm 0.7581,0.7581,0.5235,90,90,120 - - 14.31 X 929
Ge-Tb TbGe TlI,oS8,63 Cmcm 0.4264,1.0683,0.396,90,90,90 CrB(TlI)-FeB - 8.53 X 58749
Ge-Tb TbGe1.5 ht AlB2,hP3,191 P6/mmm 0.3931,0.3931,0.4137,90,90,120 AlB2 family - 8.03 X 33327
Ge-Tb TbGe1.7 ht ThSi2,tI12,141 I41/amd 0.4075,0.4075,1.3745,90,90,90 - - 8.22 A 36537
Ge-Tb TbGe2 TbGe2,oS24,65 Cmmm 0.40964,2.9834,0.39877,90,90,90 - - 8.29 X 21368
Ge-Tb TbGe3 ht DyGe3,oS16,63 Cmcm 0.40446,2.0786,0.39126,90,90,90 - - 7.61 X 48756
Ge-Tb TbGe5 ht-hp LaGe5,oI12,71 Immm 0.3957,0.6111,0.9836,90,90,90 - - 7.29 X 55450
Ge-Tb Tb0.57 Ge2 ZrGa2,oS12,65 Cmmm 0.4043,2.0738,0.3914,90,90,90 close-packed structure - 4.77 X 34624
Ge-Tb Tb11Ge10 Ho11Ge10,tI84,139 I4/mmm 1.088,1.088,1.6475,90,90,90 - - 8.43 A 21796
Ge-Tb Tb3Ge4 Er3Ge4,oS28,63 Cmcm 0.40454,1.0633,1.4218,90,90,90 - - 8.33 X 33327
Ge-Tb Tb3Ge5 rt cub Y3Ge5,oF64,43 Fdd2 0.5745,1.7253,1.3724,90,90,90 - - 8.20 X 52565
Ge-Tb Tb3Ge5 rt hex Sm3Ge5,hP16,190 P-62c 0.6861,0.6861,0.8339,90,90,120 - - 8.20 X 52565
Ge-Tb Tb5Ge3 Mn5Si3,hP16,193 P63 /mcm 0.84956,0.84956,0.63861,90,90,120 - - 8.42 X 58742
Ge-Tb Tb5Ge4 Sm5Ge4,oP36,62 Pnma 0.7581,1.4565,0.7645,90,90,90 - - 8.54 X 11674
Ge-Te GeTe hp GeTe,oP16,60 Pbcn 0.7441,0.7678,0.5435,90,90,90 - - 8.56 X 33677
Ge-Te GeTe ht NaCl,cF8,225 Fm-3m 0.59859,0.59859,0.59859,90,90,90 rocksalt family - 6.20 X 16085
Ge-Te GeTe rt Te+ GeS,oP8,62 Pnma 1.1848,0.4094,0.4365,90,90,90 - - 6.28 A 15181
Ge-Te GeTe rt GeTe,hR6,160 R3m 0.41639,0.41639,1.06922,90,90,120 rocksalt family - 6.21 X 20317
Ge-Te GeTe4 hp *,cF*,* - 0.642,0.642,0.642,90,90,90 - - - N 17539
Ge-Te GeTe4 rt *,cP40,* - 1.109,1.109,1.109,90,90,90 - - - N 11664
Ge-Te Ge2Te3 tf *,hP*,164 P-3m1 0.417,0.417,5.3,90,90,120 - - - N 2796
Ge-Th ThGe NaCl,cF8,225 Fm-3m 0.6053,0.6053,0.6053,90,90,90 rocksalt family - 9.12 X 43087
Ge-Th ThGe1.5 orth2 *,oP*,27 Pcc2 0.6989,0.8432,0.8136,90,90,90 - - - N 1918
Ge-Th ThGe1.6 orth1 *,oF*,70 Fddd 0.5889,0.5913,1.4219,90,90,90 - - - N 1918
Ge-Th ThGe2 ht ThSi2,tI12,141 I41/amd 0.4106,0.4106,1.4193,90,90,90 - - 10.47 X 983
Ge-Th ThGe2 rt orth1 ZrSi2,oS12,63 Cmcm 0.4223,1.6911,0.4052,90,90,90 close-packed structure - 8.66 X 1609
Ge-Th ThGe2 rt orth2 ZrGa2,oS12,65 Cmmm 0.4023,1.6642,0.416,90,90,90 close-packed structure - 9.00 X 1609
Ge-Th ThGe3 stab *,cP*,* - 1.172,1.172,1.172,90,90,90 - - - N 983
Ge-Th Th2Ge CuAl2,tI12,140 I4/mcm 0.7403,0.7403,0.6088,90,90,90 - - 10.68 X 6743
Ge-Th Th3Ge2 U3Si2,tP10,127 P4/mbm 0.7971,0.7971,0.417,90,90,90 - - 10.55 X 983
Ge-Ti TiGe TiSi,oP8,25 Pmm2 0.3809,0.6834,0.5235,90,90,90 - - 5.87 A 1141
Ge-Ti TiGe2 TiSi2,oF24,70 Fddd 0.5025,0.8602,0.8778,90,90,90 - - 6.76 A 43133
Ge-Ti Ti0.85 Ge0.15 rt Mg,hP2,194 P63 /mmc 0.2947,0.2947,0.4677,90,90,120 close-packed structure - 4.87 X 49291
Ge-Ti Ti3Ge Ni3P,tI32,82 I-4 1.029,1.029,0.514,90,90,90 - - 5.28 A 2863
Ge-Ti Ti5Ge3 Mn5Si3,hP16,193 P63 /mcm 0.757,0.757,0.5249,90,90,120 - - 5.83 A 58749
Ge-Ti Ti6Ge5 V6Si5,oI44,72 Ibam 0.7954,1.6915,0.5233,90,90,90 - - 6.14 X 5108
Ge-Tm TmGe rt TlI,oS8,63 Cmcm 0.4185,1.0524,0.3885,90,90,90 CrB(TlI)-FeB - 9.38 X 22921
Ge-Tm TmGe1.5 AlB2,hP3,191 P6/mmm 0.388,0.388,0.407,90,90,120 AlB2 family - 8.69 X 57363
Ge-Tm TmGe1.83 ht DyGe1.85 ,oS24,36 Cmc21 0.405,2.946,0.3887,90,90,90 - - 8.64 A 57363
Ge-Tm TmGe1.9 TmGe1.9 ,oP20,51 Pmma 0.3879,0.4034,2.2544,90,90,90 - - 8.67 X 37393
Ge-Tm TmGe2 ZrSi2,oS12,63 Cmcm 0.3997,1.5719,0.38604,90,90,90 close-packed structure - 8.60 X 50136
Handbook of Inorganic Substances – Edition 2015 : Data 103

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ge-Tm TmGe 3 DyGe3,oS16,63 Cmcm 0.399,2.0488,0.38794,90,90,90 - - 8.10 X 53861


Ge-Tm Tm11 Ge10 Ho11 Ge10,tI84,139 I4/mmm 1.072,1.072,1.605,90,90,90 - - 9.31 A 57363
Ge-Tm Tm2 Ge3 Tm2 Ge3,mS20,15 C12/c1 0.90577,0.66386,0.77596,90,115.678,90 - - 8.78 X 35830
Ge-Tm Tm2 Ge5 Er2Ge5,oP14,59 Pmmn 0.3875,0.4,1.8103,90,90,90 - - 8.30 A 37393
Ge-Tm Tm3 Ge4 Er3Ge4,oS28,63 Cmcm 0.39629,1.0437,1.3988,90,90,90 - - 9.15 X 34671
Ge-Tm Tm5 Ge3 Mn5 Si3,hP16,193 P63/mcm 0.83,0.83,0.622,90,90,120 - - 9.51 X 4619
Ge-Tm Tm5 Ge4 Sm5 Ge4,oP36,62 Pnma 0.71,1.442,0.729,90,90,90 - - 10.10 A 57363
Ge-U UGe ThIn,oP24,57 Pbcm 0.9827,0.8932,0.5841,90,90,90 - - 12.07 X 33402
Ge-U UGe 1.57 AlB2 ,hP3,191 P6/mmm 0.3954,0.3954,0.4125,90,90,120 AlB2 family - 10.47 X 35813
Ge-U UGe 2 ZrGa2,oS12,65 Cmmm 0.4036,1.4928,0.4116,90,90,90 close-packed structure - 10.26 X 33102
Ge-U UGe 3 Cu3Au,cP4,221 Pm-3m 0.4206,0.4206,0.4206,90,90,90 close-packed structure - 10.17 X 13909
Ge-U U5Ge 4 Ti5Ga4,hP18,193 P63/mcm 0.8744,0.8744,0.5863,90,90,120 AlB2 family - 12.67 X 33281
Ge-V VGe 2 hp CrSi2,hP9,180 P6222 0.4806,0.4806,0.6634,90,90,120 - - 7.36 A 21473
Ge-V V11Ge 8 Cr11 Ge8,oP76,62 Pnma 1.34,0.5021,1.61,90,90,90 - - 7.00 A 21322
Ge-V V17Ge 31 V17Ge31,tP192,118 P-4n2 0.591,0.591,8.365,90,90,90 chimney-ladder structure grayish 7.08 X 3785
Ge-V V3Ge Cr3Si,cP8,223 Pm-3n 0.47832,0.47832,0.47832,90,90,90 Frank-Kasper phase - 6.84 X 16431
Ge-V V5Ge 3 stab Mn5 Si3,hP16,193 P63/mcm 0.7295,0.7295,0.497,90,90,120 - - 6.85 X 974
Ge-V V5Ge 3 W5Si3,tI32,140 I4/mcm 0.9566,0.9566,0.4841,90,90,90 - - 7.08 A 21322
Ge-W WGe 2 hp1 PbCl2,oP12,62 Pnma 0.6399,0.3445,0.8549,90,90,90 - - 11.60 A 31799
Ge-W WGe 2 hp2 MoSi2,tI6,139 I4/mmm 0.332,0.332,0.8192,90,90,90 b.c.c. family - 12.10 X 11549
Ge-W W5Ge3 hp1 W5Si3,tI32,140 I4/mcm 0.981,0.981,0.492,90,90,90 - - 15.95 A 11549
Ge-W W5Ge3 hp2 Cr5B3,tI32,140 I4/mcm 0.625,0.625,1.172,90,90,90 - - 16.50 A 11549
Ge-Y YGe TlI,oS8,63 Cmcm 0.4262,1.0694,0.3941,90,90,90 CrB(TlI)-FeB - 5.97 X 2482
Ge-Y YGe 1.5 ht AlB2 ,hP3,191 P6/mmm 0.39337,0.39337,0.41424,90,90,120 AlB2 family - 5.92 X 38115
Ge-Y YGe 1.67 YGe1.67 ,hP24,190 P-62c 0.6838,0.6838,0.8298,90,90,120 - - 6.23 X 35899
Ge-Y YGe 1.82 YGe1.82 ,oS28,63 Cmcm 0.41158,2.9835,0.39351,90,90,90 - - 6.08 X 35827
Ge-Y YGe 1.9 TbGe2,oS24,65 Cmmm 0.4106,2.9986,0.39955,90,90,90 - - 6.13 X 35809
Ge-Y YGe 2 ht *,oP48,* - 0.8,0.82,1.492,90,90,90 - - - N 6739
Ge-Y YGe 2 ht? ThSi2,tI12,141 I41/amd 0.406,0.406,1.3683,90,90,90 - - 6.89 X 2304
Ge-Y YGe 2.69 DyGe3,oS16,63 Cmcm 0.40431,2.0765,0.3912,90,90,90 - - 5.75 X 35827
Ge-Y Y11Ge 10 Ho11 Ge10,tI84,139 I4/mmm 1.0881,1.0881,1.643,90,90,90 - - 5.82 A 38115
Ge-Y Y2Ge 3 *,oP20,49 Pccm 0.6943,0.8276,0.7845,90,90,90 - - - N 6739
Ge-Y Y2Ge 7 ht *,oS72,* - 0.4047,1.5636,2.084,90,90,90 - - - N 6739
Ge-Y Y3Ge 4 Er3Ge4,oS28,63 Cmcm 0.40562,1.0655,1.4252,90,90,90 - - 6.01 X 35827
Ge-Y Y3Ge 5 Y3Ge5,oF64,43 Fdd2 0.5746,1.7284,1.3696,90,90,90 - - 6.15 X 16565
Ge-Y Y5Ge 3 Mn5 Si3,hP16,193 P63/mcm 0.846,0.846,0.636,90,90,120 - - 5.58 X 4619
Ge-Y Y5Ge 4 Sm5 Ge4,oP36,62 Pnma 0.76316,1.46976,0.76966,90,90,90 - - 5.65 X 50513
Ge-Yb YbGe1.5 ht AlB2 ,hP3,191 P6/mmm 0.396,0.396,0.418,90,90,120 AlB2 family - 8.25 X 2286
Ge-Yb YbGe2.83 YbGe2.83 ,hP20,164 P-3m1 0.83657,0.83657,0.70469,90,90,120 - - 5.89 X 54949
Ge-Yb Yb11 Ge10 Ho11 Ge10,tI84,139 I4/mmm 1.0728,1.0728,1.6474,90,90,90 - - 9.21 X 41714
Ge-Yb Yb2Ge PbCl2,oP12,62 Pnma 0.7567,0.4822,0.9022,90,90,90 - - 8.45 X 41623
Ge-Yb Yb3Ge 5 ht Pu3Pd5,oS32,63 Cmcm 0.93739,0.75569,0.9517,90,90,90 - gray silver 8.69 X 58801
Ge-Yb Yb3Ge 5 rt Th3Pd5,hP8,189 P-62m 0.685,0.685,0.4177,90,90,120 AlB2 family - 8.63 X 41714
Ge-Yb Yb3Ge 8 Yb3Ge8,aP22,2 P-1 0.7307,0.7415,1.0365,69.32,70.24,65.02 - - 7.87 X 41714
Ge-Yb Yb5Ge 3 stab Mn5 Si3,hP16,193 P63/mcm 0.8413,0.8413,0.6474,90,90,120 - - 9.06 X 41714
Ge-Yb Yb5Ge 4 Sm5 Ge4,oP36,62 Pnma 0.7342,1.4958,0.7828,90,90,90 - - 8.93 X 41714
Ge-Zr ZrGe FeB-b,oP8,62 Pnma 0.7068,0.3899,0.5396,90,90,90 CrB(TlI)-FeB - 7.32 A 21322
Ge-Zr ZrGe 2 ZrSi2,oS12,63 Cmcm 0.37893,1.4975,0.37606,90,90,90 close-packed structure - 7.36 X 838
Ge-Zr Zr3Ge Ti3P,tP32,86 P42/n 1.1073,1.1073,0.5474,90,90,90 - - 6.85 A 21322
Ge-Zr Zr5Ge3 Mn5 Si3,hP16,193 P63/mcm 0.8029,0.8029,0.5594,90,90,120 - - 7.17 A 21322
Ge-Zr Zr5Ge4 Zr5Si4,tP36,92 P41212 0.723,0.723,1.315,90,90,90 - - 7.21 A 53364
H-Hf HfH1.74 CaF2 ,cF12,225 Fm-3m 0.4701,0.4701,0.4701,90,90,90 fluorite family - 11.52 X 16082
H-Hf HfH1.98 hex Mg,hP2,194 P63/mmc 0.4918,0.4918,0.5354,90,90,120 close-packed structure - 5.35 F 16082
H-Hf HfH2 tet ThH2,tI6,139 I4/mmm 0.34726,0.34726,0.4405,90,90,90 fluorite family - 11.29 X 33151
H-Ho HoH0.2 Mg,hP2,194 P63/mmc 0.3584,0.3584,0.562,90,90,120 close-packed structure - 8.77 F 14275
H-Ho HoH1.8 CaF2 ,cF12,225 Fm-3m 0.51649,0.51649,0.51649,90,90,90 fluorite family - 8.04 X 52421
H-Ho HoH3 hp BiF3 ,cF16,225 Fm-3m 0.525,0.525,0.525,90,90,90 b.c.c. family - 7.71 X 48695
H-Ho HoH3 *,hP8,* - 0.364,0.364,0.657,90,90,120 - - - N 48695
H-I HI lt1 HCl,cF52,225 Fm-3m 0.629,0.629,0.629,90,90,90 - - 3.41 A 5610
H-I HI lt2 HBr,oS12,64 Cmce 0.6566,0.6049,0.6127,90,90,90 - - 3.49 A 5610
H-K KH rt NaCl,cF8,225 Fm-3m 0.57,0.57,0.57,90,90,90 rocksalt family - 1.44 X 39
H-La LaH2.23 lt CeH2.43 ,tI32,141 I41/amd 0.5633,0.5633,1.1334,90,90,90 - - 5.21 A 22442
H-La LaH2.6 lt1 CeH3,cF44,225 Fm-3m 0.56239,0.56239,0.56239,90,90,90 fluorite family - 5.29 X 17388
H-Li LiH rt NaCl,cF8,225 Fm-3m 0.40752,0.40752,0.40752,90,90,90 rocksalt family colorless 0.78 X 18885
H-Lu LuH0.19 lt Mg,hP2,194 P63/mmc 0.3525,0.3525,0.5608,90,90,120 close-packed structure - 9.64 F 8345
H-Lu LuH2 CaF2 ,cF12,225 Fm-3m 0.5033,0.5033,0.5033,90,90,90 fluorite family - 9.22 X 10717
H-Lu LuH3 hp BiF3 ,cF16,225 Fm-3m 0.512,0.512,0.512,90,90,90 b.c.c. family - 8.81 X 48695
H-Lu LuH3 HoH3,hP24,165 P-3c1 0.6143,0.6143,0.6443,90,90,120 - - 8.42 A 2271
H-Mg MgH2 hp1 *,hR24,* - 0.453,0.453,1.099,90,90,120 - black - N 13559
H-Mg MgH2 hp2 Fe2N0.94 ,oP12,60 Pbcn 0.45139,0.54391,0.49406,90,90,90 - brown 1.44 X 47155
H-Mg MgH2 hp3 ZrO2,oP12,29 Pca21 0.46965,0.43966,0.44118,90,90,90 - - 1.92 X 47155
H-Mg MgH2 hp4 SrH2 ,oP12,62 Pnma 0.49536,0.29453,0.56677,90,90,90 - - 2.11 X 47155
H-Mg MgH2 TiO2 ,tP6,136 P42/mnm 0.45147,0.45147,0.30193,90,90,90 - gray 1.42 X 47155
H-Mn MnH0.073 MnH0.038 ,cI70,217 I-43m 0.89403,0.89403,0.89403,90,90,90 - - 7.41 X 34665
H-Mn MnH0.95 hp NiAs,hP4,194 P63/mmc 0.2695,0.2695,0.4373,90,90,120 AlB2 family - 6.75 X 20177
H-Mo MoH0.95 lt NiAs,hP4,194 P63/mmc 0.2937,0.2937,0.4758,90,90,120 AlB2 family - 9.05 X 21821
H-N N4H4 lt N4H4,aP34,2 P-1 0.419,0.712,1.023,106.5,90.0,102.0 - colorless 1.40 X 15694
H-N [NH3] hp1 Cu,cF4,225 Fm-3m 0.4968,0.4968,0.4968,90,90,90 close-packed structure - 0.92 X 16824
104 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

H-N [NH3] hp2 Mg,hP2,194 P63 /mmc 0.329,0.329,0.538,90,90,120 - - 1.12 X 22514


H-N [NH3] lt [NH3],cP16,198 P213 0.51305,0.51305,0.51305,90,90,90 - colorless 0.84 X 33365
H-N [NH4][N3] [NH4][N3],oP32,53 Pmna 0.88978,0.38067,0.86735,90,90,90 - colorless 1.36 X 42494
H-N [N2H4] lt [N2H4],mP8,11 P121/m1 0.356,0.578,0.453,90,109.5,90 - - 2.42 X 364
H-N [N2H5][N3 ] [N2H5][N3 ],mP40,14 P121/c1 0.5663,0.5506,1.2436,90,114.0,90 - - 1.41 X 7956
H-Na NaH rt NaCl,cF8,225 Fm-3m 0.4901,0.4901,0.4901,90,90,90 rocksalt family - 1.35 X 55953
H-Nb NbH0.021 ht W,cI2,229 Im-3m 0.3307,0.3307,0.3307,90,90,90 b.c.c. family - 8.53 F 46697
H-Nb NbH0.75 hp *,tI*,* - 0.311,0.311,0.354,90,90,90 - - - N 16337
H-Nb NbH0.85 rt TaH0.5 ,oS8,21 C222 0.3436,0.4832,0.4883,90,90,90 - - 7.68 A 16746
H-Nb NbH2 CaF2,cF12,225 Fm-3m 0.4564,0.4564,0.4564,90,90,90 fluorite family - 6.63 X 19101
H-Nd NdH2 CaF2,cF12,225 Fm-3m 0.5469,0.5469,0.5469,90,90,90 fluorite family brown dark 5.94 X 15203
H-Nd NdH2.2 BiF3,cF16,225 Fm-3m 0.5451,0.5451,0.5451,90,90,90 b.c.c. family - 6.01 X 33151
H-Nd NdH3 HoH3,hP24,165 P-3c1 0.66629,0.66629,0.68853,90,90,120 - brown dark 5.54 A 37435
H-Nd Nd2H4.70 Nd2H4.72 ,tI28,109 I41md 0.5422,0.5422,1.0908,90,90,90 - - 6.07 A 16182
H-Ni NiH hp NaCl,cF8,225 Fm-3m 0.374,0.374,0.374,90,90,90 rocksalt family - 7.58 X 21821
H-Ni NiH0.01 Cu,cF4,225 Fm-3m 0.371,0.371,0.371,90,90,90 close-packed structure - 7.64 F 16449
H-Ni Ni2H ht Ni2H,hP3,156 P3m1 0.266,0.266,0.433,90,90,120 CdI2 -PbI2 polytype - 7.41 X 11530
H-Np NpH2 CaF2,cF12,225 Fm-3m 0.53475,0.53475,0.53475,90,90,90 fluorite family - 10.38 X 20189
H-Np NpH2.7 BiF3,cF16,225 Fm-3m 0.5348,0.5348,0.5348,90,90,90 b.c.c. family - 10.41 X 2705
H-Np NpH3 HoH3,hP24,165 P-3c1 0.65045,0.65045,0.67086,90,90,120 - - 9.73 A 20189
H-O [H2O] hp II [H2O],hR108,148 R-3 1.29827,1.29827,0.6253,90,90,120 ice II - 1.18 X 2076
H-O [H2O] hp III [H2O],tP60,92 P41212 0.673,0.673,0.683,90,90,90 ice III - 1.16 X 3813
H-O [H2O] hp IV [H2O],hR240,167 R-3c 0.87292,0.87292,1.70658,90,90,120 ice IV - 1.28 X 14307
H-O [H2O] hp V [H2O],mS140,15 C12/c1 1.035,0.754,0.922,90,109.2,90 ice V - 1.23 X 3339
H-O [H2O] hp VI [H2O],tP50,137 P42 /nmc 0.60871,0.60871,0.5579,90,90,90 - - 1.45 A 46905
H-O [H2O] hp VII [H2O],cP20,224 Pn-3m 0.3368,0.3368,0.3368,90,90,90 ice VII - 1.57 A 15206
H-O [H2O] lt [H2O],hP20,194 P63 /mmc 0.44975,0.44975,0.73224,90,90,120 ice I hexagonal - 0.93 X 43259
H-O [H2O] tf [H2O],cF40,227 Fd-3m 0.636,0.636,0.636,90,90,90 - - 0.93 A 1264
H-O [H2O2] lt [H2O2],tP16,92 P41212 0.40162,0.40162,0.78545,90,90,90 - - 1.78 X 13278
H-O [H2O2][H2 O]2 lt [H2O2][H2 O]2,mS40,15 C12/c1 0.9030,0.9479,0.4510,90,117.23,90 - - 1.36 X 1208
H-Pa PaH1.67 ht *,cF*,227 Fd-3m 0.9219,0.9219,0.9219,90,90,90 - - - N 17095
H-Pa PaH3 ht UH3,cP32,223 Pm-3n 0.6642,0.6642,0.6642,90,90,90 - - 10.61 A 17095
H-Pd PdH0.01 Cu,cF4,225 Fm-3m 0.409,0.409,0.409,90,90,90 close-packed structure - 10.33 F 16449
H-Pd PdH0.64 rt NaCl,cF8,225 Fm-3m 0.403,0.403,0.403,90,90,90 rocksalt family - 10.86 X 11530
H-Pd Pd0.75 H tf cub Pd0.75 H,cP14,221 Pm-3m 0.2995,0.2995,0.2995,90,90,90 - - 9.99 X 13738
H-Pd Pd0.75 H tf tet Pd0.75 H,tP4,115 P-4m2 0.2896,0.2896,0.3330,90,90,90 - - 9.61 X 13734
H-Pr PrH2 CaF2,cF12,225 Fm-3m 0.5517,0.5517,0.5517,90,90,90 fluorite family - 5.65 X 12914
H-Pr PrH3 BiF3,cF16,225 Fm-3m 0.5468,0.5468,0.5468,90,90,90 b.c.c. family - 5.85 X 53301
H-Pr Pr2H4.72 Nd2H4.72 ,tI28,109 I41md 0.5472,0.5472,1.102,90,90,90 - - 5.77 A 16182
H-Pu PuH1.93 rt CaF2,cF12,225 Fm-3m 0.53593,0.53593,0.53593,90,90,90 fluorite family - 10.61 X 18386
H-Pu PuH2.13 BiF3,cF16,225 Fm-3m 0.5356,0.5356,0.5356,90,90,90 b.c.c. family - 10.64 X 20213
H-Pu PuH3 rt Na3As,hP8,194 P63 /mmc 0.378,0.378,0.676,90,90,120 - - 9.81 A 771
H-Rb RbH rt NaCl,cF8,225 Fm-3m 0.6037,0.6037,0.6037,90,90,90 rocksalt family - 2.61 X 39
H-Re ReH0.23 lt NiAs,hP4,194 P63 /mmc 0.2801,0.2801,0.4465,90,90,120 AlB2 family - 20.41 X 18747
H-Rh RhH0.95 lt NaCl,cF8,225 Fm-3m 0.401,0.401,0.401,90,90,90 rocksalt family - 10.70 X 21821
H-S [H2S] hp [H2S],cP52,205 Pa-3 0.5765,0.5765,0.5765,90,90,90 - - 1.18 A 4812
H-S [H2S] hp2 [H2S],cP28,198 P213 0.4931,0.4931,0.4931,90,90,90 - - 1.89 X 35052
H-S [H2S] hp3 [H2S],tI48,142 I41/acd 0.685,0.685,0.9203,90,90,90 - yellow thin 2.10 X 35052
H-S [H2S] lt1 CaF2,cF12,225 Fm-3m 0.5797,0.5797,0.5797,90,90,90 fluorite family - 1.16 X 211
H-S [H2S] lt3 [H2S],tP4,77 P42 0.675,0.675,0.4131,90,90,90 - - 1.20 X 1708
H-Sc ScH0.39 lt Mg,hP2,194 P63 /mmc 0.334,0.334,0.529,90,90,120 close-packed structure - 2.95 F 2792
H-Sc ScH2 hp CaF2,cF12,225 Fm-3m 0.47796,0.47796,0.47796,90,90,90 fluorite family - 2.86 X 47039
H-Sc ScH2.9 hp ScH2.9 ,hP10,194 P63 /mmc 0.3373,0.3373,0.6121,90,90,120 - - 2.64 X 47309
H-Se [H2Se] CaF2,cF12,225 Fm-3m 0.6024,0.6024,0.6024,90,90,90 fluorite family - 2.46 X 211
H-Si SiH SiH,hP4,164 P-3m1 0.383,0.383,0.54,90,90,120 - - 1.41 X 27989
H-Si SiH4 lt SnBr4,mP20,14 P121/c1 0.5699,0.3814,0.5643,90,104.38,90 - - 1.80 X 49360
H-Sm SmH2 CaF2,cF12,225 Fm-3m 0.53773,0.53773,0.53773,90,90,90 fluorite family - 6.51 X 22929
H-Sm SmH3 hp BiF3,cF16,225 Fm-3m 0.537,0.537,0.537,90,90,90 b.c.c. family - 6.58 X 48695
H-Sm SmH3 HoH3,hP24,165 P-3c1 0.6567,0.6567,0.6801,90,90,120 - - 6.02 A 48138
H-Sm Sm3H7 *,tI*,87 I4/m 0.3778,0.3778,0.53647,90,90,90 - - - N 14428
H-Sr SrH2 hp Co1.75 Ge,hP6,194 P63 /mmc 0.39583,0.39583,0.52527,90,90,120 AlB2 family - 4.18 X 53317
H-Sr SrH2 rt PbCl2,oP12,62 Pnma 0.61,0.37664,0.7141,90,90,90 - white 3.63 X 53317
H-Ta TaH0.1 lt W,cI2,229 Im-3m 0.3322,0.3322,0.3322,90,90,90 b.c.c. family - 16.40 F 10043
H-Ta TaH0.84 ht2 TaH0.5 ,oS8,21 C222 0.346,0.483,0.479,90,90,90 - - 15.08 A 17100
H-Ta TaH0.84 lt *,tI*,* - 0.345,0.345,0.34,90,90,90 - - - N 17100
H-Ta Ta2H rt Ta2H,oS6,21 C222 0.3398,0.4738,0.4763,90,90,90 - - 15.72 X 11562
H-Tb TbH0.2 rt Mg,hP2,194 P63 /mmc 0.3612,0.3612,0.57,90,90,120 close-packed structure - 8.21 F 14275
H-Tb TbH2 CaF2,cF12,225 Fm-3m 0.52425,0.52425,0.52425,90,90,90 fluorite family - 7.42 X 28374
H-Tb TbH3 HoH3,hP24,165 P-3c1 0.6409,0.6409,0.6658,90,90,120 - - 6.81 A 2271
H-Tc Tc2H0.9 CdI2,hP3,164 P-3m1 0.2801,0.2801,0.4454,90,90,120 CdI2 -PbI2 polytype - 10.80 X 17530
H-Th ThH2 ThH2,tI6,139 I4/mmm 0.41,0.41,0.503,90,90,90 fluorite family - 9.19 X 413
H-Th Th4H15 Cu15Si4,cI76,220 I-43d 0.911,0.911,0.911,90,90,90 - - 8.29 X 484
H-Ti TiH m PtS,tP4,131 P42 /mmc 0.297,0.297,0.459,90,90,90 - - 4.01 X 16879
H-Ti TiH0.13 hp Ti,hP3,191 P6/mmm 0.4625,0.4625,0.2828,90,90,120 - - 4.57 F 20186
H-Ti TiH0.17 rt Mg,hP2,194 P63 /mmc 0.29472,0.29472,0.46758,90,90,120 close-packed structure - 4.54 F 29412
H-Ti TiH0.71 hp *,tI4,* - 0.321,0.321,0.357,90,90,90 - - - N 20186
H-Ti TiH0.85 hp NbH0.95 ,oP8,48 Pnnn 0.409,0.434,0.445,90,90,90 - - 4.10 X 20186
H-Ti TiH2 rt cub CaF2,cF12,225 Fm-3m 0.44512,0.44512,0.44512,90,90,90 fluorite family gray 3.76 X 54634
Handbook of Inorganic Substances – Edition 2015 : Data 105

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

H-Ti TiH2 rt tet ThH2,tI6,139 I4/mmm 0.2998,0.2998,0.3415,90,90,90 fluorite family - 5.40 X 54634
H-Tm TmH0.3 Mg,hP2,194 P63/mmc 0.3589,0.3589,0.5685,90,90,120 close-packed structure - 8.86 F 12493
H-Tm TmH2 CaF2 ,cF12,225 Fm-3m 0.50915,0.50915,0.50915,90,90,90 fluorite family green dark 8.60 X 10717
H-Tm TmH3 HoH3,hP24,165 P-3c1 0.6234,0.6234,0.6489,90,90,120 - - 7.85 A 2271
H-U UH3 ht UH3 ,cP32,223 Pm-3n 0.6643,0.6643,0.6643,90,90,90 - - 10.92 X 18555
H-U UH3 rt Cr3Si,cP8,223 Pm-3n 0.416,0.416,0.416,90,90,90 Frank-Kasper phase - 11.12 X 616
H-V VH0.9 rt *,t**,* - 0.446,0.446,0.3666,90,90,90 - - - N 33151
H-V VH2 ht CaF2 ,cF12,225 Fm-3m 0.4271,0.4271,0.4271,90,90,90 fluorite family - 4.52 X 19101
H-V V2H rt V2H,mS6,12 C12/m1 0.44566,0.30022,0.4476,90,95.609,90 - - 5.73 X 19967
H-V V2H1.10 rt V2H1.1 ,tI56,141 I41/amd 0.6035,0.6035,0.6872,90,90,90 - - 5.47 X 18745
H-W WH hp NiAs,hP4,194 P63/mmc 0.288,0.288,0.46,90,90,120 AlB2 family - 18.58 X 58620
H-Y YH1.98 CaF2 ,cF12,225 Fm-3m 0.5205,0.5205,0.5205,90,90,90 fluorite family - 4.28 X 13618
H-Y YH3 hp1 BiF3 ,cF16,225 Fm-3m 0.528,0.528,0.528,90,90,90 b.c.c. family - 4.15 X 48695
H-Y YH3 hp2 *,hR27,166 R-3m 0.35146,0.35146,8.1455,90,90,120 - - 4.73 P 49353
H-Y YH3 HoH3,hP24,165 P-3c1 0.63587,0.63587,0.66068,90,90,120 - - 3.96 X 46762
H-Y YHx rt Mg,hP2,194 P63/mmc 0.3652,0.3652,0.5777,90,90,120 close-packed structure - 4.43 F 9921
H-Yb YbH2 hp Mg,hP2,194 P63/mmc 0.3596,0.3596,0.4802,90,90,120 close-packed structure - 10.81 F 17378
H-Yb YbH2 ht CaF2 ,cF12,225 Fm-3m 0.5192,0.5192,0.5192,90,90,90 fluorite family - 8.31 X 4099
H-Yb YbH2 m CaF2 ,cF12,225 Fm-3m 0.5253,0.5253,0.5253,90,90,90 fluorite family - 8.02 X 4099
H-Yb YbH2 rt PbCl2,oP12,62 Pnma 0.59,0.3576,0.6776,90,90,90 - purple 8.13 X 15818
H-Yb YbH2.6 BiF3 ,cF16,225 Fm-3m 0.518,0.518,0.518,90,90,90 b.c.c. family black 8.39 X 19161
H-Yb Yb3H8 Yb3H8,hP33,162 P-31m 0.6344,0.6344,0.9002,90,90,120 - black 8.37 A 40873
H-Zr ZrH tet PtS,tP4,131 P42/mmc 0.32995,0.32995,0.48386,90,90,90 - - 5.81 X 56475
H-Zr ZrH1.651 CaF2 ,cF12,225 Fm-3m 0.4777,0.4777,0.4777,90,90,90 fluorite family - 5.66 X 18404
H-Zr ZrH2 rt ThH2,tI6,139 I4/mmm 0.35179,0.35179,0.4447,90,90,90 fluorite family - 5.63 X 27402
He-N He[N2]11 hp He[N2]11,hP54,176 P63/m 0.7936,0.7936,0.936,90,90,120 - - 2.03 X 57140
He-Ne NeHe2 hp MgZn2,hP12,194 P63/mmc 0.377,0.377,0.6155,90,90,120 Friauf-Laves phase - 2.47 X 54676
Hf-Hg HgHf2 CuZr2,tI6,139 I4/mmm 0.3345,0.3345,1.1496,90,90,90 close-packed structure - 14.40 A 3663
Hf-I HfI3 TiCl3,hP8,193 P63/mcm 0.7225,0.7225,0.659,90,90,120 - - 6.23 X 2190
Hf-I HfI4 mon HfI4 ,mS40,15 C12/c1 1.1787,1.1801,1.2905,90,116.30,90 - orange red 5.66 X 13365
Hf-I HfI4 tricl ZrI4,aP20,2 P-1 0.8337,0.8337,1.2915,108.25,108.25,90.09 - - 5.66 X 19504
Hf-I Hf0.86 I3 Hf0.86 I3,hR72,166 R-3m 1.2503,1.2503,1.9996,90,90,120 - black 5.90 X 56028
Hf-In Hf0.67 In1.33 CuAu,tP2,123 P4/mmm 0.308,0.308,0.451,90,90,90 close-packed structure - 10.57 X 2857
Hf-In Hf2In5 Hg5Mn2,tP14,127 P4/mbm 1.02471,1.02471,0.30566,90,90,90 - - 9.63 X 31483
Hf-In Hf3In4 Ti3In4,tP14,127 P4/mbm 1.023,1.023,0.3053,90,90,90 - - 10.34 A 2857
Hf-Ir HfIr3 Cu3Au,cP4,221 Pm-3m 0.39054,0.39054,0.39054,90,90,90 close-packed structure - 21.05 X 54854
Hf-Ir Hf0.94 Ir1.06 rt *,o**,* - 0.305,0.468,0.475,90,90,90 - - - N 2323
Hf-Ir Hf2Ir Ti2Ni,cF96,227 Fd-3m 1.232,1.232,1.232,90,90,90 - - 15.61 A 4705
Hf-Ir Hf5Ir3 Zr5Ir3,hP48,178 P6122 0.7863,0.7863,1.689,90,90,120 - - 16.19 A 18771
Hf-Mn HfMn2 hex1 MgZn2,hP12,194 P63/mmc 0.4956,0.4956,0.8122,90,90,120 Friauf-Laves phase - 11.09 X 1528
Hf-Mn HfMn2 hex2 MgNi2,hP24,194 P63/mmc 0.5016,0.5016,1.6367,90,90,120 Friauf-Laves phase - 10.74 A 1013
Hf-Mn Hf2Mn cub Ti2Ni,cF96,227 Fd-3m 1.1886,1.1886,1.1886,90,90,90 - - 13.04 A 12440
Hf-Mo HfMo2 rt MgCu2,cF24,227 Fd-3m 0.75696,0.75696,0.75696,90,90,90 Friauf-Laves phase - 11.34 X 50094
Hf-Mo Hf0.2 Mo0.8 W,cI2,229 Im-3m 0.31992,0.31992,0.31992,90,90,90 b.c.c. family - 11.41 X 1446
Hf-Mo Hf0.33 Mo0.67 m W,cI2,229 Im-3m 0.3226,0.3226,0.3226,90,90,90 b.c.c. family - 12.19 X 15236
Hf-Mo Hf0.7 Mo0.3 ht W,cI2,229 Im-3m 0.34167,0.34167,0.34167,90,90,90 b.c.c. family - 12.80 X 50094
Hf-Mo Hf1.1 Mo1.9 ht MgNi2,hP24,194 P63/mmc 0.5354,0.5354,1.735,90,90,120 Friauf-Laves phase - 11.68 A 7647
Hf-N HfN0.41 rt Mg,hP2,194 P63/mmc 0.3222,0.3222,0.5157,90,90,120 close-packed structure - 13.20 F 1480
Hf-N HfN0.67 rt TiS,hR18,166 R-3m 0.3206,0.3206,2.326,90,90,120 - - 13.56 X 5486
Hf-N HfN0.75 ht Sc0.67 Te,hR24,166 R-3m 0.3214,0.3214,3.112,90,90,120 - - 13.53 X 5486
Hf-N HfN0.75 NaCl,cF8,225 Fm-3m 0.4525,0.4525,0.4525,90,90,90 rocksalt family - 13.55 X 23113
Hf-N Hf3N4 Th3P 4,cI28,220 I-43d 0.6701,0.6701,0.6701,90,90,90 - - 13.06 X 42125
Hf-Nb Hf0.17 Nb0.83 m Cu,cF4,225 Fm-3m 0.419,0.419,0.419,90,90,90 close-packed structure - 9.70 X 30355
Hf-Nb Hf0.22 Nb0.78 W,cI2,229 Im-3m 0.33466,0.33466,0.33466,90,90,90 b.c.c. family - 9.90 X 3593
Hf-Nb Hf0.9 Nb0.1 m Cu,cF4,225 Fm-3m 0.457,0.457,0.457,90,90,90 close-packed structure - 11.83 X 30355
Hf-Ni HfNi ht CsCl,cP2,221 Pm-3m 0.313,0.313,0.313,90,90,90 b.c.c. family - 12.84 X 39329
Hf-Ni HfNi rt TlI,oS8,63 Cmcm 0.321,0.999,0.41,90,90,90 CrB(TlI)-FeB - 11.98 A 39329
Hf-Ni HfNi2 MgCu2,cF24,227 Fd-3m 0.6906,0.6906,0.6906,90,90,90 Friauf-Laves phase - 11.93 X 6969
Hf-Ni HfNi3 ht BaPb3,hR36,166 R-3m 0.52787,0.52787,1.92324,90,90,120 close-packed structure - 11.42 X 11272
Hf-Ni HfNi3 rt Ta(Rh0.33Pd0.67 )3,hP40,194 P63/mmc 0.52822,0.52822,2.13916,90,90,120 close-packed structure - 11.39 X 11272
Hf-Ni HfNi5 Be5Au,cF24,216 F-43m 0.669,0.669,0.669,90,90,90 Friauf-Laves phase - 10.47 A 38111
Hf-Ni Hf0.01 Ni0.99 Cu,cF4,225 Fm-3m 0.3536,0.3536,0.3536,90,90,90 close-packed structure - 9.00 X 17833
Hf-Ni Hf0.97 Ni0.03 rt Mg,hP2,194 P63/mmc 0.319,0.319,0.5,90,90,120 close-packed structure - 13.18 X 39329
Hf-Ni Hf2Ni ht CuAl2,tI12,140 I4/mcm 0.6405,0.6405,0.5252,90,90,90 - - 12.82 X 6743
Hf-Ni Hf2Ni m cub Ti2Ni,cF96,227 Fd-3m 1.21,1.21,1.21,90,90,90 - - 12.47 A 44179
Hf-Ni Hf2Ni m tet CuAl2,tI12,140 I4/mcm 0.647,0.647,0.548,90,90,90 - - 12.04 A 44179
Hf-Ni Hf2Ni7 Zr2Ni7,mS36,12 C12/m1 0.4657,0.8191,1.2102,90,95.509,90 - - 11.10 A 7832
Hf-Ni Hf3Ni7 ht Hf3Ni7,aP20,2 P-1 0.65138,0.65890,0.76271,104.87,104.60,112.71 - - 11.72 X 11274
Hf-Ni Hf7Ni10 Zr7Ni10,oS68,64 Cmce 1.2248,0.909,0.9116,90,90,90 - - 12.02 A 44959
Hf-Ni Hf8Ni21 ht Hf8Ni21,aP29,2 P-1 0.64275,0.80007,0.85540,75.18,68.14,75.61 - - 11.36 X 11273
Hf-Ni Hf9Ni11 Zr9Pt11,tI40,87 I4/m 0.979,0.979,0.653,90,90,90 - - 11.95 A 1415
Hf-O HfO0.25 rt Mg,hP2,194 P63/mmc 0.3213,0.3213,0.51,90,90,120 close-packed structure - 13.29 F 1922
Hf-O HfO2 hp1 ZrO2,oP24,61 Pbca 0.50598,1.00172,0.52276,90,90,90 - - 10.55 X 25228
Hf-O HfO2 hp2 PbCl2,oP12,62 Pnma 0.55544,0.3307,0.64572,90,90,90 - - 11.79 X 33090
Hf-O HfO2 hp3 *,t*12,* - 0.498,0.498,0.426,90,90,90 - - 13.23 N 27999
Hf-O HfO2 ht CaF2 ,cF12,225 Fm-3m 0.51165,0.51165,0.51165,90,90,90 fluorite family - 10.44 X 28734
Hf-O HfO2 ht1 ZrO2,oP16,57 Pbcm 0.50073,0.52276,0.5058,90,90,90 - - 10.56 X 20777
Hf-O HfO2 ht2 ZrO2,tP6,137 P42/nmc 0.37654,0.37654,0.5175,90,90,90 fluorite family - 9.53 A 4058
106 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Hf-O HfO2 rt ZrO2-b,mP12,14 P121/c1 0.51187,0.51693,0.5297,90,99.18,90 - - 10.10 X 24983


Hf-O Hf3O0.5 rt Ti3O,hP16,163 P-31c 0.5559,0.5559,1.02,90,90,120 - - 13.22 X 7638
Hf-O Hf6O rt Hf+ WCl6,hR21,148 R-3 0.5559,0.5559,1.53,90,90,120 - - 13.22 X 7638
Hf-Os HfOs CsCl,cP2,221 Pm-3m 0.3239,0.3239,0.3239,90,90,90 b.c.c. family - 18.02 X 1148
Hf-Os HfOs2 MgZn2,hP12,194 P63 /mmc 0.5184,0.5184,0.8468,90,90,120 Friauf-Laves phase - 18.84 X 1059
Hf-Os Hf2Os stab Ti2Ni,cF96,227 Fd-3m 1.2278,1.2278,1.2278,90,90,90 - - 15.71 A 16183
Hf-Os Hf54Os17 Hf54Os17,oI142,71 Immm 1.3856,1.4104,1.457,90,90,90 - - 15.01 X 17804
Hf-P HfP TiP,hP8,194 P63 /mmc 0.365,0.365,1.237,90,90,120 - - 9.75 X 1713
Hf-P HfP2 PbCl2,oP12,62 Pnma 0.6467,0.3497,0.8646,90,90,90 - - 8.17 A 2318
Hf-P Hf2P Ta2P,oP36,58 Pnnm 1.2258,1.5031,0.35738,90,90,90 - - 11.74 X 3868
Hf-P Hf3P Ti3P,tP32,86 P42 /n 1.06654,1.06654,0.52925,90,90,90 - - 12.50 X 15878
Hf-P Hf3P 2 Th2S3,oP20,62 Pnma 1.0128,0.35707,0.9868,90,90,90 - black 11.12 X 31343
Hf-P Hf7P 4 Nb7P 4,mS44,12 C12/m1 1.5488,0.3526,1.4553,90,104.83,90 - black 11.87 X 31299
Hf-Pd HfPd2 MoSi2,tI6,139 I4/mmm 0.3399,0.3399,0.8658,90,90,90 b.c.c. family - 12.99 A 28749
Hf-Pd HfPd3 stab Cu3Au,cP4,221 Pm-3m 0.3961,0.3961,0.3961,90,90,90 close-packed structure - 13.30 X 5984
Hf-Pd HfPd3 TiNi3,hP16,194 P63 /mmc 0.5593,0.5593,0.9197,90,90,120 close-packed structure - 13.27 A 28749
Hf-Pd Hf2Pd stab Ti2Ni,cF96,227 Fd-3m 1.23605,1.23605,1.23605,90,90,90 - - 13.04 A 1019
Hf-Pd Hf2Pd CuZr2,tI6,139 I4/mmm 0.3251,0.3251,1.1061,90,90,90 close-packed structure - 13.16 X 1765
Hf-Po HfPo NiAs,hP4,194 P63 /mmc 0.4058,0.4058,0.6717,90,90,120 AlB2 family - 13.43 X 11923
Hf-Pt HfPt TlI,oS8,63 Cmcm 0.3345,1.0269,0.4288,90,90,90 CrB(TlI)-FeB - 16.85 A 2469
Hf-Pt HfPt3 hex TiNi3,hP16,194 P63 /mmc 0.5636,0.5636,0.9208,90,90,120 close-packed structure - 20.03 A 1152
Hf-Pt Hf0.1 Pt0.9 Cu,cF4,225 Fm-3m 0.395,0.395,0.395,90,90,90 close-packed structure - 20.85 X 10878
Hf-Pt Hf0.92Pt3.08 cub Cu3Au,cP4,221 Pm-3m 0.3983,0.3983,0.3983,90,90,90 close-packed structure - 20.11 X 10878
Hf-Pt Hf1.2 Pt1.8 rt MoSi2,tI6,139 I4/mmm 0.343,0.343,0.873,90,90,90 b.c.c. family - 18.28 A 2323
Hf-Pt Hf2Pt stab Ti2Ni,cF96,227 Fd-3m 1.2461,1.2461,1.2461,90,90,90 - - 15.16 A 1019
Hf-Pu Pu0.90 Hf0.10 rt *,o**,* - 1.0415,1.0428,1.1245,90,90,90 - - - N 3725
Hf-Pu Pu0.91 Hf0.09 m Mg,hP2,194 P63 /mmc 0.3205,0.3205,0.51,90,90,120 close-packed structure - 17.43 X 3306
Hf-Pu Pu0.92 Hf0.08 ht5 W,cI2,229 Im-3m 0.36358,0.36358,0.36358,90,90,90 b.c.c. family - 16.50 X 2277
Hf-Pu Pu0.94 Hf0.06 ht3 Cu,cF4,225 Fm-3m 0.46346,0.46346,0.46346,90,90,90 close-packed structure - 16.02 X 4147
Hf-Re HfRe2 MgZn2,hP12,194 P63 /mmc 0.5239,0.5239,0.8584,90,90,120 Friauf-Laves phase - 17.93 X 1059
Hf-Re Hf0.01 Re0.99 Mg,hP2,194 P63 /mmc 0.27557,0.27557,0.4446,90,90,120 close-packed structure - 21.14 X 4835
Hf-Re Hf0.88 Re0.12 ht W,cI2,229 Im-3m 0.35,0.35,0.35,90,90,90 b.c.c. family - 13.90 X 1514
Hf-Re Hf0.99 Re0.01 rt Mg,hP2,194 P63 /mmc 0.32,0.32,0.508,90,90,120 close-packed structure - 13.16 X 1514
Hf-Re Hf21Re25 Zr21Re25,hR276,167 R-3c 2.5773,2.5773,0.876,90,90,120 - - 16.62 A 18808
Hf-Re Hf5Re24 Ti5Re24,cI58,217 I-43m 0.9708,0.9708,0.9708,90,90,90 - - 19.46 A 1739
Hf-Rh HfRh Rh+ CsCl,cP2,221 Pm-3m 0.3227,0.3227,0.3227,90,90,90 b.c.c. family - 13.91 X 2431
Hf-Rh HfRh3 Cu3Au,cP4,221 Pm-3m 0.3912,0.3912,0.3912,90,90,90 close-packed structure - 13.51 X 2431
Hf-Rh Hf0.84 Rh1.16 ht *,oS*,* - 0.37,0.431,0.439,90,90,90 - - - N 2323
Hf-Rh Hf0.96 Rh1.04 rt CuTi,tP2,123 P4/mmm 0.3275,0.3275,0.3157,90,90,90 b.c.c. family - 13.65 X 25383
Hf-Rh Hf2Rh Ti2Ni,cF96,227 Fd-3m 1.2271,1.2271,1.2271,90,90,90 - - 13.23 A 12440
Hf-Rh Hf3Rh5 Rh5Ge3,oP16,55 Pbam 0.558,1.073,0.425,90,90,90 - - 13.70 X 4872
Hf-Ru HfRu CsCl,cP2,221 Pm-3m 0.3232,0.3232,0.3232,90,90,90 b.c.c. family - 13.75 X 6922
Hf-S HfS WC,hP2,187 P-6m2 0.3378,0.3378,0.3434,90,90,120 AlB2 family - 10.30 X 23030
Hf-S HfS2 CdI2,hP3,164 P-3m1 0.3622,0.3622,0.5848,90,90,120 CdI2 -PbI2 polytype brown 6.06 A 10784
Hf-S HfS3 ZrSe3,mP8,11 P121/m1 0.50923,0.35952,0.8967,90,97.38,90 - orange 5.60 X 8707
Hf-S Hf0.67 S NiAs,hP4,194 P63 /mmc 0.3635,0.3635,0.5839,90,90,120 AlB2 family brown 7.54 X 957
Hf-S Hf0.7 S rt Zr0.65 S,cF64,227 Fd-3m 1.018,1.018,1.018,90,90,90 rocksalt family black 7.91 X 5583
Hf-S Hf2S NbS2,hP6,194 P63 /mmc 0.33736,0.33736,1.17882,90,90,120 - - 11.12 X 3301
Hf-Sb HfSb cub FeSi,cP8,198 P213 0.559,0.559,0.559,90,90,90 - - 11.42 A 2863
Hf-Sb HfSb orth ZrSb,oS24,63 Cmcm 0.3779,1.0338,1.3842,90,90,90 - - 11.06 X 39471
Hf-Sb HfSb2 ht UAs2,tP6,129 P4/nmm 0.392,0.392,0.868,90,90,90 - - 10.51 A 2863
Hf-Sb HfSb2 rt TiAs2,oP24,58 Pnnm 0.98781,1.4989,0.38506,90,90,90 - - 9.83 X 6502
Hf-Sb Hf3Sb Ni3P,tI32,82 I-4 1.11899,1.11899,0.56364,90,90,90 - - 12.37 X 14411
Hf-Sb Hf5Sb3 Y5Bi3,oP32,62 Pnma 0.74075,0.8718,1.0736,90,90,90 - - 12.05 X 35943
Hf-Sc Sc0.5 Hf0.5 rt Mg,hP2,194 P63 /mmc 0.3231,0.3231,0.5087,90,90,120 close-packed structure - 8.07 X 25364
Hf-Se HfSe2 CdI2,hP3,164 P-3m1 0.3746,0.3746,0.6155,90,90,120 CdI2 -PbI2 polytype brown 7.47 A 17267
Hf-Se HfSe3 TiS3,mP8,11 P121/m1 0.5388,0.37216,0.9428,90,97.78,90 - black 7.36 X 8707
Hf-Se Hf0.67 Se Ti0.62 S,hP8,186 P63 mc 0.37165,0.37165,1.24304,90,90,120 - - 8.87 X 28827
Hf-Se Hf0.92 Se WC,hP2,187 P-6m2 0.34958,0.34958,0.36069,90,90,120 AlB2 family - 10.58 X 28827
Hf-Se Hf2Se NbS2,hP6,194 P63 /mmc 0.344,0.344,1.232,90,90,120 - - 11.47 A 3674
Hf-Si HfSi rt FeB-b,oP8,62 Pnma 0.6889,0.3772,0.5223,90,90,90 CrB(TlI)-FeB - 10.11 X 4833
Hf-Si HfSi2 ZrSi2,oS12,63 Cmcm 0.3672,1.457,0.3641,90,90,90 close-packed structure - 8.00 X 4833
Hf-Si Hf2Si CuAl2,tI12,140 I4/mcm 0.6553,0.6553,0.5186,90,90,90 - - 11.49 X 6743
Hf-Si Hf3Si2 U3Si2,tP10,127 P4/mbm 0.6988,0.6988,0.3675,90,90,90 - - 10.95 X 4833
Hf-Si Hf5Si3 stab Mn5Si3,hP16,193 P63 /mcm 0.7844,0.7844,0.5492,90,90,120 - - 11.08 X 4833
Hf-Si Hf5Si4 Zr5Si4,tP36,92 P41212 0.7039,0.7039,1.283,90,90,90 - - 10.50 X 4833
Hf-Sn HfSn FeSi,cP8,198 P213 0.5594,0.5594,0.5594,90,90,90 - - 11.28 X 2094
Hf-Sn HfSn2 CrSi2,hP9,180 P6222 0.54816,0.54816,0.76113,90,90,120 - - 10.46 A 55913
Hf-Sn Hf5Sn3 Mn5Si3,hP16,193 P63 /mcm 0.83656,0.83656,0.57077,90,90,120 - - 11.99 X 58486
Hf-Sn Hf5Sn4 Ti5Ga4,hP18,193 P63 /mcm 0.8334,0.8334,0.5694,90,90,120 AlB2 family - 13.26 A 55916
Hf-Ta Hf0.5 Ta0.5 W,cI2,229 Im-3m 0.3419,0.3419,0.3419,90,90,90 b.c.c. family - 14.93 X 9248
Hf-Tc HfTc CsCl,cP2,221 Pm-3m 0.327,0.327,0.327,90,90,90 b.c.c. family - 13.13 X 1682
Hf-Tc HfTc2 MgZn2,hP12,194 P63 /mmc 0.52001,0.52001,0.86175,90,90,120 Friauf-Laves phase - 12.33 A 5329
Hf-Tc Hf0.125 Tc0.875 Mn,cI58,217 I-43m 0.9603,0.9603,0.9603,90,90,90 - - 11.75 A 1490
Hf-Te HfTe2 CdI2,hP3,164 P-3m1 0.3949,0.3949,0.6651,90,90,120 CdI2 -PbI2 polytype brown faint 8.02 X 26361
Hf-Te HfTe3 ZrSe3,mP8,11 P121/m1 0.5879,0.3902,1.0056,90,97.98,90 - - 8.16 A 26485
Hf-Te HfTe5 HfTe5,oS24,63 Cmcm 0.39743,1.4492,1.3730,90,90,90 - - 6.86 X 7216
Hf-Te Hf0.62 Te NiAs,hP4,194 P63 /mmc 0.3954,0.3954,0.6652,90,90,120 AlB2 family black 8.79 X 5739
Handbook of Inorganic Substances – Edition 2015 : Data 107

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Hf-Te Hf2Te ht Nb2Se,mS24,12 C12/m1 1.5163,0.37026,1.0064,90,90.5,90 - - 11.39 X 33178


Hf-Te Hf3Te 2 Hf3Te2,tI10,139 I4/mmm 0.36837,0.36837,1.7901,90,90,90 - black 10.81 X 28498
Hf-Th Th0.053 Hf0.947 rt Mg,hP2,194 P63/mmc 0.3202,0.3202,0.5061,90,90,120 close-packed structure - 13.40 X 1012
Hf-Th Th0.95 Hf0.05 rt Cu,cF4,225 Fm-3m 0.507,0.507,0.507,90,90,90 close-packed structure - 11.69 X 1012
Hf-Ti Hf0.33 Ti0.67 rt Mg,hP2,194 P63/mmc 0.3056,0.3056,0.4827,90,90,120 close-packed structure - 7.74 X 34487
Hf-U UHf2 m Hg2U,hP3,191 P6/mmm 0.497,0.497,0.304,90,90,120 AlB2 family - 15.19 X 1322
Hf-U U0.01 Hf0.99 rt Mg,hP2,194 P63/mmc 0.32116,0.32116,0.51,90,90,120 close-packed structure - 13.06 X 44809
Hf-V HfV2 lt1 YMn2,tI12,141 I41/amd 0.52071,0.52071,0.74014,90,90,90 - - 9.28 X 36948
Hf-V HfV2 lt2 UMn2,oI12,74 Imma 0.52124,0.5191,0.74175,90,90,90 Friauf-Laves phase - 9.28 X 36948
Hf-V HfV2 rt MgCu2,cF24,227 Fd-3m 0.73752,0.73752,0.73752,90,90,90 Friauf-Laves phase - 9.28 X 36948
Hf-V Hf0.013 V0.987 W,cI2,229 Im-3m 0.3028,0.3028,0.3028,90,90,90 b.c.c. family - 6.29 X 18441
Hf-W HfW2 rt MgCu2,cF24,227 Fd-3m 0.7591,0.7591,0.7591,90,90,90 Friauf-Laves phase - 16.59 X 1528
Hf-W Hf0.045W0.955 W,cI2,229 Im-3m 0.318,0.318,0.318,90,90,90 b.c.c. family - 18.96 X 4588
Hf-W Hf0.33 W0.67 ht W,cI2,229 Im-3m 0.3185,0.3185,0.3185,90,90,90 b.c.c. family - 18.72 X 16140
Hf-Zn ZnHf2 CuZr2,tI6,139 I4/mmm 0.325,0.325,1.116,90,90,90 close-packed structure - 11.90 A 2862
Hf-Zn Zn2Hf ht MgNi2,hP24,194 P63/mmc 0.519,0.519,1.689,90,90,120 Friauf-Laves phase - 10.43 A 2862
Hf-Zn Zn2Hf rt MgCu2,cF24,227 Fd-3m 0.732,0.732,0.732,90,90,90 Friauf-Laves phase - 10.47 X 14794
Hf-Zn Zn22 Hf Zn22 Zr,cF184,227 Fd-3m 1.407,1.407,1.407,90,90,90 - - 7.71 A 2862
Hf-Zn Zn3Hf rt *,t**,* - 0.812,0.812,1.612,90,90,90 - - - N 2862
Hf-Zn Zn5Hf *,t**,* - 1.17,1.17,1.16,90,90,90 - - - N 2862
Hf-Zr Hf0.43 Zr0.57 hp Ti,hP3,191 P6/mmm 0.4991,0.4991,0.3093,90,90,120 - - 9.61 X 14222
Hf-Zr Hf0.43 Zr0.57 rt Mg,hP2,194 P63/mmc 0.3209,0.3209,0.5126,90,90,120 close-packed structure - 9.35 X 14222
Hg-Ho HgHo CsCl,cP2,221 Pm-3m 0.366,0.366,0.366,90,90,90 b.c.c. family gray silver 12.38 X 2673
Hg-Ho Hg2 Ho Cd2Ce,hP3,164 P-3m1 0.4798,0.4798,0.347,90,90,120 AlB2 family - 13.59 A 4094
Hg-Ho Hg3 Ho Mg3 Cd,hP8,194 P63/mmc 0.6526,0.6526,0.4872,90,90,120 close-packed structure - 14.17 A 3135
Hg-I HgI HgCl,tI8,139 I4/mmm 0.48974,0.48974,1.1649,90,90,90 moschelite black 7.79 X 57599
Hg-I HgI2 hp hex HgI2 ,hP6,191 P6/mmm 0.422,0.422,1.185,90,90,120 - - 8.26 X 6878
Hg-I HgI2 hp mon *,mP12,14 P121/c1 0.51057,0.54009,1.39574,90,106.64,90 - - - N 43476
Hg-I HgI2 ht1 HgI2 ,tP6,137 P42/nmc 0.437,0.437,1.2443,90,90,90 - red 6.35 X 20764
Hg-I HgI2 ht2 HgI2 ,mP12,4 P1211 0.44081,1.39239,0.80206,90,95.062,90 - - 6.16 X 41478
Hg-I HgI2 m1 HgI2 ,tI48,141 I41/amd 0.87863,0.87863,2.4667,90,90,90 - orange 6.34 X 39867
Hg-I HgI2 m2 HgI2 ,tP24,137 P42/nmc 0.87863,0.87863,1.23335,90,90,90 - orange 6.34 X 39867
Hg-I HgI2 m3 ZnI2 ,tI96,142 I41/acd 1.2393,1.2393,2.4889,90,90,90 - orange 6.32 X 39868
Hg-I HgI2 rt HgBr2,oS12,36 Cmc21 0.4734,0.7408,1.3943,90,90,90 - yellow 6.17 X 41478
Hg-In HgIn lt HgIn,hR6,166 R-3m 0.3571,0.3571,1.3157,90,90,120 - - 10.81 X 6460
Hg-In Hg0.06 In0.94 In,tI2,139 I4/mmm 0.32862,0.32862,0.48324,90,90,90 close-packed structure - 7.63 X 640
Hg-In Hg0.083 In0.917 Cu,cF4,225 Fm-3m 0.4675,0.4675,0.4675,90,90,90 close-packed structure - 7.93 X 5528
Hg-In Hg0.8 In0.2 lt Pu,oF8,70 Fddd 0.3522,0.4847,1.0872,90,90,90 - - 13.13 X 12425
Hg-K KHg KHg,aP8,2 P-1 0.6601,0.6758,0.7052,105.9,101.4,92.8 b.c.c. family golden 5.40 X 32572
Hg-K KHg11 BaHg11,cP36,221 Pm-3m 0.963,0.963,0.963,90,90,90 - gray silver 12.53 X 36547
Hg-K KHg2 KHg2,oI12,74 Imma 0.516,0.81,0.877,90,90,90 AlB2 family gray 7.98 X 668
Hg-K K2Hg7 K2Hg7,hP9,164 P-3m1 0.67175,0.67175,0.64133,90,90,120 - gray silver 9.82 X 36567
Hg-K K3Hg11 La3Al11,oI28,71 Immm 0.5122,1.0063,1.4782,90,90,90 - - 10.13 X 37568
Hg-K K5Hg7 K5Hg7,oP48,57 Pbcm 1.006,1.945,0.834,90,90,90 - - 6.51 X 1189
Hg-K K7Hg31 Ba7Cd31,hP41,191 P6/mmm 1.085,1.085,1.021,90,90,120 - - 10.36 X 37568
Hg-La HgLa CsCl,cP2,221 Pm-3m 0.3864,0.3864,0.3864,90,90,90 b.c.c. family - 9.77 X 9902
Hg-La Hg2 La Cd2Ce,hP3,164 P-3m1 0.496,0.496,0.365,90,90,120 AlB2 family - 11.53 X 4094
Hg-La Hg3 La Mg3 Cd,hP8,194 P63/mmc 0.6816,0.6816,0.4971,90,90,120 close-packed structure - 12.30 A 9902
Hg-La Hg45 La11 Cd45 Sm11,cF448,216 F-43m 2.1977,2.1977,2.1977,90,90,90 Nasicon family - 13.21 A 12439
Hg-La Hg58 La13 Zn58 Gd13,hP142,194 P63/mmc 1.567,1.567,1.548,90,90,120 - - 13.56 A 9902
Hg-La Hg6 La *,oS*,* - 0.5004,0.9763,2.886,90,90,90 - - - N 9902
Hg-Li LiHg rt CsCl,cP2,221 Pm-3m 0.3286,0.3286,0.3286,90,90,90 b.c.c. family - 9.71 X 4313
Hg-Li LiHg3 Mg3 Cd,hP8,194 P63/mmc 0.624,0.624,0.4794,90,90,120 close-packed structure - 12.51 X 102
Hg-Li Li3Hg BiF3 ,cF16,225 Fm-3m 0.6548,0.6548,0.6548,90,90,90 b.c.c. family - 5.24 X 102
Hg-Lu HgLu CsCl,cP2,221 Pm-3m 0.3607,0.3607,0.3607,90,90,90 b.c.c. family gray silver 13.29 X 2673
Hg-Lu Hg3 Lu Mg3 Cd,hP8,194 P63/mmc 0.6467,0.6467,0.4851,90,90,120 close-packed structure - 14.68 A 3135
Hg-Mg MgHg CsCl,cP2,221 Pm-3m 0.3448,0.3448,0.3448,90,90,90 b.c.c. family yellowish 9.11 X 17376
Hg-Mg MgHg2 MoSi2,tI6,139 I4/mmm 0.383,0.383,0.8781,90,90,90 b.c.c. family - 10.97 X 205
Hg-Mg Mg0.9883 Hg0.0117 Mg,hP2,194 P63/mmc 0.32042,0.32042,0.52023,90,90,120 close-packed structure - 1.90 X 351
Hg-Mg Mg2 Hg Co2Si-b,oP12,62 Pnma 0.622,0.4618,0.88,90,90,90 - - 6.55 A 17376
Hg-Mg Mg3 Hg Mg3 Hg,hR72,155 R32 0.8351,0.8351,2.5845,90,90,120 - - 5.24 X 17376
Hg-Mg Mg5 Hg3 Mn5 Si3,hP16,193 P63/mcm 0.8243,0.8243,0.5919,90,90,120 - - 6.90 X 273
Hg-Mn HgMn lt CuTi,tP2,123 P4/mmm 0.3288,0.3288,0.3313,90,90,90 b.c.c. family - 11.85 X 19347
Hg-Mn HgMn rt CsCl,cP2,221 Pm-3m 0.3316,0.3316,0.3316,90,90,90 b.c.c. family gray 11.64 X 3360
Hg-Mn Hg5 Mn2 Hg5Mn2,tP14,127 P4/mbm 0.97577,0.97577,0.2998,90,90,90 - - 12.95 X 1391
Hg-N Hg[N3] Hg[N3],mP16,14 P121/c1 0.35795,1.25907,0.62097,90,110.878,90 - colorless 6.16 X 42348
Hg-N Hg[N3]2 Hg[N3]2,oP28,29 Pca21 1.057,0.623,0.623,90,90,90 - - 4.61 X 7812
Hg-Na NaHg rt NaHg,oS16,63 Cmcm 0.719,1.079,0.521,90,90,90 b.c.c. family golden 7.35 X 558
Hg-Na NaHg2 Hg2U,hP3,191 P6/mmm 0.5029,0.5029,0.32304,90,90,120 AlB2 family - 9.96 X 558
Hg-Na NaHg4 *,hP1150,* - 6.15,6.15,0.97,90,90,120 - - - N 558
Hg-Na Na11 Hg52 Na11 Hg52,hP567,174 P-6 3.9703,3.9703,0.9681,90,90,120 - - 12.08 X 57549
Hg-Na Na2.67 Hg ht2 BiF3 ,cF16,225 Fm-3m 0.7674,0.7674,0.7674,90,90,90 b.c.c. family - 3.85 X 26842
Hg-Na Na3Hg ht Na3Hg,hR12,166 R-3m 0.5404,0.5404,1.342,90,90,120 b.c.c. family gray silver 3.96 X 27098
Hg-Na Na3Hg rt Na3Hg,hP18,194 P63/mmc 0.5405,0.5405,0.9766,90,90,120 - gray silver 3.62 X 29528
Hg-Na Na3Hg2 Zr3Al2,tP20,136 P42/mnm 0.84587,0.84587,0.77078,90,90,90 - golden 5.66 X 45961
Hg-Na Na8Hg3 ht1 *,mS*,* - 0.7676,0.7676,0.7676,90,90.7,90 - - - N 26842
Hg-Na Na8Hg3 rt Yb8In3,hR132,167 R-3c 0.9228,0.9228,5.2638,90,90,120 - gray silver 4.03 X 24190
Hg-Nd HgNd CsCl,cP2,221 Pm-3m 0.3772,0.3772,0.3772,90,90,90 b.c.c. family - 10.67 X 363
108 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Hg-Nd Hg2Nd Cd2Ce,hP3,164 P-3m1 0.4904,0.4904,0.352,90,90,120 AlB2 family - 12.35 X 4094


Hg-Nd Hg45Nd11 Cd45Sm11,cF448,216 F-43m 2.1716,2.1716,2.1716,90,90,90 Nasicon family - 13.77 A 12439
Hg-Ni HgNi rt CuTi,tP2,123 P4/mmm 0.298,0.298,0.314,90,90,90 b.c.c. family - 15.44 X 11113
Hg-Ni Hg4Ni Hg4Pt,cI10,229 Im-3m 0.6016,0.6016,0.6016,90,90,90 - - 13.13 X 548
Hg-O HgO orth HgO,oP8,62 Pnma 0.66225,0.5525,0.3524,90,90,90 montroydite yellow 11.16 X 22864
Hg-O HgO tricl HgO,aP16,2 P-1 0.554,0.665,0.701,90.4,90.1,90.9 - gray 11.14 X 15438
Hg-O HgO trig HgS,hP6,152 P3121 0.3577,0.3577,0.8681,90,90,120 - - 11.22 X 955
Hg-O Hg[O2] cub FeS2,cP12,205 Pa-3 0.532,0.532,0.532,90,90,90 pyrite-marcasite family - 10.26 A 760
Hg-O Hg[O2] mon Hg[O2],mS6,12 C12/m1 0.4470,0.5459,0.3519,90,108.45,90 - - 9.48 X 18631
Hg-O Hg[O2] orth Hg[O2],oP12,61 Pbca 0.4800,0.6080,0.6010,90,90,90 - red yellow 8.81 X 1089
Hg-Pb Hg0.22Pb0.78 Cu,cF4,225 Fm-3m 0.4858,0.4858,0.4858,90,90,90 close-packed structure - 11.92 X 3749
Hg-Pb Hg0.7 Pb1.3 CuAu,tP2,123 P4/mmm 0.3517,0.3517,0.4508,90,90,90 close-packed structure - 12.20 X 9447
Hg-Pd HgPd CuAu,tP2,123 P4/mmm 0.3026,0.3026,0.3702,90,90,90 potarite - 15.04 X 1224
Hg-Pd Hg0.124 Pd0.876 Cu,cF4,225 Fm-3m 0.3943,0.3943,0.3943,90,90,90 close-packed structure - 12.79 X 1364
Hg-Pd Hg5Pd2 Hg5Mn2,tP14,127 P4/mbm 0.9463,0.9463,0.3031,90,90,90 - - 14.88 X 2747
Hg-Po HgPo cub NaCl,cF8,225 Fm-3m 0.625,0.625,0.625,90,90,90 rocksalt family - 11.14 X 1261
Hg-Pr HgPr CsCl,cP2,221 Pm-3m 0.3791,0.3791,0.3791,90,90,90 b.c.c. family - 10.41 X 363
Hg-Pr Hg45Pr11 Cd45Sm11,cF448,216 F-43m 2.1786,2.1786,2.1786,90,90,90 Nasicon family - 13.59 A 12439
Hg-Pt HgPt ht CuAu,tP2,123 P4/mmm 0.2971,0.2971,0.3825,90,90,90 close-packed structure - 19.46 X 528
Hg-Pt Hg0.22Pt0.78 Cu,cF4,225 Fm-3m 0.398,0.398,0.398,90,90,90 close-packed structure - 20.68 X 7659
Hg-Pt Hg2Pt Hg2Pt,tP3,123 P4/mmm 0.4687,0.4687,0.2913,90,90,90 - black gray 15.47 X 528
Hg-Pt Hg4Pt Hg4Pt,cI10,229 Im-3m 0.62001,0.62001,0.62001,90,90,90 - black gray 13.90 X 15190
Hg-Pu Hg42Pu10 Cu41Sn11,cF416,216 F-43m 2.178,2.178,2.178,90,90,90 γ-brass - 13.97 A 3141
Hg-Rb RbHg11 BaHg11,cP36,221 Pm-3m 0.9707,0.9707,0.9707,90,90,90 - gray silver 12.48 X 36547
Hg-Rb RbHg2 KHg2,oI12,74 Imma 0.53,0.8449,0.8981,90,90,90 AlB2 family black 8.04 X 21921
Hg-Rb Rb15Hg16 *,tI124,88 I41/a 1.665,1.665,1.813,90,90,90 - golden - N 22142
Hg-Rb Rb2Hg7 K2Hg7,hP9,164 P-3m1 0.68436,0.68436,0.65774,90,90,120 - gray silver 9.80 X 36567
Hg-Rb Rb3Hg20 Rb3Hg20,cP46,223 Pm-3n 1.0737,1.0737,1.0737,90,90,90 - - 11.45 X 37568
Hg-Rb Rb5Hg19 Rb5Hg19,tI48,87 I4/m 1.1561,1.1561,1.051,90,90,90 - gray silver 10.02 X 36637
Hg-Rb Rb7Hg31 Ba7Cd31,hP41,191 P6/mmm 1.1,1.1,1.0377,90,90,120 - - 10.41 A 37568
Hg-Rh Hg2Rh rt Hg2Pt,tP3,123 P4/mmm 0.4551,0.4551,0.2998,90,90,90 - - 13.48 X 3669
Hg-S HgS hp NaCl,cF8,225 Fm-3m 0.507,0.507,0.507,90,90,90 rocksalt family - 11.86 X 16112
Hg-S HgS ht1 ZnS,cF8,216 F-43m 0.58537,0.58537,0.58537,90,90,90 metacinnabar black 7.70 X 31894
Hg-S HgS ht2 *,hP24,* - 0.701,0.701,1.413,90,90,120 hypercinnabar black - N 11352
Hg-S HgS rt HgS,hP6,152 P3121 0.41317,0.41317,0.94451,90,90,120 cinnabar red 8.30 X 31894
Hg-Sc HgSc CsCl,cP2,221 Pm-3m 0.348,0.348,0.348,90,90,90 b.c.c. family - 9.68 X 1973
Hg-Sc Hg3Sc Mg3Cd,hP8,194 P63 /mmc 0.6369,0.6369,0.4762,90,90,120 close-packed structure - 12.84 X 1973
Hg-Se HgSe 12L *,hP*,* - 0.43,0.43,4.21,90,90,120 - - - N 4666
Hg-Se HgSe 2L *,hP*,* - 0.43,0.43,0.702,90,90,120 - - - N 4666
Hg-Se HgSe hp1 HgS,hP6,152 P3121 0.432,0.432,0.968,90,90,120 - - 8.90 A 2001
Hg-Se HgSe hp2 NaCl,cF8,225 Fm-3m 0.536,0.536,0.536,90,90,90 rocksalt family - 12.06 X 18406
Hg-Se HgSe rt ZnS,cF8,216 F-43m 0.60864,0.60864,0.60864,90,90,90 tiemannite red 8.24 X 4950
Hg-Se Hg0.5 Se0.5 hp3 Sn,tI4,141 I41/amd 0.5112,0.5112,0.2721,90,90,90 - - 13.06 X 18406
Hg-Sm Hg2Sm Cd2Ce,hP3,164 P-3m1 0.4877,0.4877,0.3515,90,90,120 AlB2 family - 12.65 A 4094
Hg-Sm Hg45Sm11 Cd45Sm11,cF448,216 F-43m 2.1651,2.1651,2.1651,90,90,90 Nasicon family - 13.98 A 12439
Hg-Sn Hg0.01 Sn0.99 rt Sn,tI4,141 I41/amd 0.57903,0.57903,0.3177,90,90,90 - - 7.45 X 276
Hg-Sn Hg0.05 Sn0.95 ht (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.32415,0.32415,0.30066,90,90,120 - - 7.45 X 602
Hg-Sn Hg0.1 Sn0.9 rt (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.32074,0.32074,0.29865,90,90,120 - - 7.92 X 24977
Hg-Sr SrHg CsCl,cP2,221 Pm-3m 0.3955,0.3955,0.3955,90,90,90 b.c.c. family - 7.74 X 8282
Hg-Sr SrHg11 BaHg11,cP36,221 Pm-3m 0.95102,0.95102,0.95102,90,90,90 - gray silver 13.29 A 36547
Hg-Sr SrHg2 KHg2,oI12,74 Imma 0.4934,0.7697,0.8472,90,90,90 AlB2 family - 10.09 X 4947
Hg-Sr SrHg3 Mg3Cd,hP8,194 P63 /mmc 0.6906,0.6906,0.5106,90,90,120 close-packed structure - 10.86 A 8282
Hg-Sr SrHg8 SrHg8,oP72,62 Pnma 1.3328,0.49128,2.6446,90,90,90 - black 12.98 X 54118
Hg-Sr Sr10.5 Hg54.5 Ca9(Ca0.95 Hg0.05 )2Hg54,hP65,174 P-6 1.3602,1.3602,0.9818,90,90,120 - - 12.51 X 50397
Hg-Sr Sr13Hg58 Zn58Gd13,hP142,194 P63 /mmc 1.594,1.594,1.579,90,90,120 - - 12.21 A 8282
Hg-Sr Sr14Hg51 Ag51Gd14,hP68,175 P6/m 1.378,1.378,0.988,90,90,120 - - 11.71 A 8282
Hg-Sr Sr3Hg Fe3C-b,oP16,62 Pnma 0.8523,1.108,0.7405,90,90,90 - - 4.40 A 8282
Hg-Sr Sr3Hg2 U3Si2,tP10,127 P4/mbm 0.8883,0.8883,0.4553,90,90,90 - gray silver 6.14 X 32455
Hg-Tb HgTb CsCl,cP2,221 Pm-3m 0.3678,0.3678,0.3678,90,90,90 b.c.c. family gray silver 12.00 X 2329
Hg-Tb Hg2Tb Cd2Ce,hP3,164 P-3m1 0.4833,0.4833,0.3487,90,90,120 AlB2 family - 13.19 A 4094
Hg-Tb Hg3Tb Mg3Cd,hP8,194 P63 /mmc 0.6565,0.6565,0.4887,90,90,120 close-packed structure - 13.85 A 3135
Hg-Te HgTe hp1 HgS,hP6,152 P3121 0.4392,0.4392,1.0033,90,90,120 - - 9.75 X 30899
Hg-Te HgTe hp2 NaCl,cF8,225 Fm-3m 0.5843,0.5843,0.5843,90,90,90 rocksalt family - 10.93 X 16451
Hg-Te HgTe hp3 ZnTe,oS8,63 Cmcm 0.55626,0.61516,0.5105,90,90,90 - - 12.48 X 32256
Hg-Te HgTe rt ZnS,cF8,216 F-43m 0.6463,0.6463,0.6463,90,90,90 coloradoite - 8.08 X 20084
Hg-Th HgTh2 CuAl2,tI12,140 I4/mcm 0.7696,0.7696,0.5902,90,90,90 - - 12.63 X 19174
Hg-Th Hg0.5 Th0.5 ht Cu,cF4,225 Fm-3m 0.48,0.48,0.48,90,90,90 close-packed structure - 12.99 X 1017
Hg-Th Hg2Th CaIn2,hP6,194 P63 /mmc 0.4822,0.4822,0.7438,90,90,120 AlB2 family - 14.04 X 19174
Hg-Th Hg3Th Mg3Cd,hP8,194 P63 /mmc 0.6716,0.6716,0.4902,90,90,120 close-packed structure - 14.46 X 19174
Hg-Ti HgTi CuAu,tP2,123 P4/mmm 0.3009,0.3009,0.4041,90,90,90 close-packed structure - 11.28 X 639
Hg-Ti HgTi3 ht1 Cr3Si,cP8,223 Pm-3n 0.51888,0.51888,0.51888,90,90,90 Frank-Kasper phase - 8.18 X 639
Hg-Ti HgTi3 ht2 Cu3Au,cP4,221 Pm-3m 0.41654,0.41654,0.41654,90,90,90 close-packed structure - 7.91 X 639
Hg-Tl TlHg m CsCl,cP2,221 Pm-3m 0.3712,0.3712,0.3712,90,90,90 b.c.c. family - 13.15 X 11603
Hg-Tl Tl0.15 Hg0.85 m In,tI2,139 I4/mmm 0.3271,0.3271,0.4692,90,90,90 close-packed structure - 13.31 X 11603
Hg-Tl Tl0.25 Hg0.75 lt Cu,cF4,225 Fm-3m 0.4624,0.4624,0.4624,90,90,90 close-packed structure - 13.54 X 11603
Hg-Tl Tl0.85 Hg0.15 m W,cI2,229 Im-3m 0.3794,0.3794,0.3794,90,90,90 b.c.c. family - 12.39 X 11603
Hg-Tl Tl0.95 Hg0.05 rt Mg,hP2,194 P63 /mmc 0.3425,0.3425,0.5476,90,90,120 close-packed structure - 12.19 X 11603
Hg-Tm HgTm CsCl,cP2,221 Pm-3m 0.3632,0.3632,0.3632,90,90,90 b.c.c. family gray silver 12.81 X 2673
Handbook of Inorganic Substances – Edition 2015 : Data 109

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Hg-Tm Hg3 Tm Mg3 Cd,hP8,194 P63/mmc 0.6491,0.6491,0.4856,90,90,120 close-packed structure - 14.45 A 3135
Hg-U Hg0.75 U0.25 ht Mg,hP2,194 P63/mmc 0.332,0.332,0.4875,90,90,120 close-packed structure - 14.98 X 520
Hg-U Hg2 U Hg2U,hP3,191 P6/mmm 0.4976,0.4976,0.3218,90,90,120 AlB2 family - 15.38 X 520
Hg-U Hg45 U11 Cd45 Sm11,cF448,216 F-43m 2.172,2.172,2.172,90,90,90 Nasicon family - 15.10 A 12439
Hg-Y HgY CsCl,cP2,221 Pm-3m 0.368,0.368,0.368,90,90,90 b.c.c. family - 9.65 X 1973
Hg-Y Hg2 Y Hg2U,hP3,191 P6/mmm 0.4771,0.4771,0.3536,90,90,120 AlB2 family - 11.68 X 2305
Hg-Y Hg3 Y Mg3 Cd,hP8,194 P63/mmc 0.6541,0.6541,0.487,90,90,120 close-packed structure - 12.71 X 1973
Hg-Yb HgYb CsCl,cP2,221 Pm-3m 0.3731,0.3731,0.3731,90,90,90 b.c.c. family gray silver 11.95 X 2673
Hg-Yb Hg2 Yb Cd2Ce,hP3,164 P-3m1 0.4896,0.4896,0.3534,90,90,120 AlB2 family - 13.00 X 4094
Hg-Yb Hg3 Yb Mg3 Cd,hP8,194 P63/mmc 0.6596,0.6596,0.5021,90,90,120 close-packed structure - 13.60 A 3135
Hg-Yb Hg51 Yb14 Ag51 Gd14,hP68,175 P6/m 1.341,1.341,0.961,90,90,120 - - 14.04 A 12439
Hg-Zn ZnHg3 lt *,hP*,* - 0.4703,0.4703,3.3251,90,90,120 - - - N 21108
Hg-Zn Zn0.75 Hg0.25 (Cu0.75 Ti0.25),oS4,63 Cmcm 0.2708,0.4696,0.5471,90,90,90 close-packed structure - 9.47 X 15768
Hg-Zn Zn0.98 Hg0.02 Mg,hP2,194 P63/mmc 0.26617,0.26617,0.49771,90,90,120 close-packed structure - 7.40 X 276
Hg-Zr HgZr CuAu,tP2,123 P4/mmm 0.315,0.315,0.417,90,90,90 close-packed structure - 11.71 X 639
Hg-Zr HgZr3 Cr3Si,cP8,223 Pm-3n 0.55583,0.55583,0.55583,90,90,90 Frank-Kasper phase - 9.17 X 639
Hg-Zr Hg3 Zr Cu3Au,cP4,221 Pm-3m 0.43652,0.43652,0.43652,90,90,90 close-packed structure - 13.84 X 639
Ho-I HoI3 rt *,hP168,* - 1.9772,1.9772,2.0846,90,90,120 - yellow - N 28060
Ho-In HoIn rt *,t**,* - 0.97,0.97,0.85,90,90,90 - - - N 9912
Ho-In HoIn3 Cu3Au,cP4,221 Pm-3m 0.45734,0.45734,0.45734,90,90,90 close-packed structure - 8.84 X 52448
Ho-In Ho2 In Co1.75 Ge,hP6,194 P63/mmc 0.53216,0.53216,0.66667,90,90,120 AlB2 family - 9.03 X 47256
Ho-In Ho3 In5 Pu3Pd5,oS32,63 Cmcm 0.981,0.799,1.026,90,90,90 - - 8.83 A 14288
Ho-In Ho5 In3 ht Mn5 Si3,hP16,193 P63/mcm 0.8939,0.8939,0.6595,90,90,120 - - 8.51 A 4104
Ho-In Ho5 In3 rt W5Si3,tI32,140 I4/mcm 1.2092,1.2092,0.601,90,90,90 - - 8.84 A 8290
Ho-Ir HoIr CsCl,cP2,221 Pm-3m 0.3383,0.3383,0.3383,90,90,90 b.c.c. family - 15.32 X 2469
Ho-Ir HoIr2 MgCu2,cF24,227 Fd-3m 0.7503,0.7503,0.7503,90,90,90 Friauf-Laves phase - 17.28 X 1982
Ho-Ir Ho3 Ir Fe3C-b,oP16,62 Pnma 0.7186,0.9139,0.6326,90,90,90 - - 10.98 A 12087
Ho-Ir Ho3 Ir2 Y3Rh2,tI140,140 I4/mcm 1.1132,1.1132,2.492,90,90,90 - - 13.24 A 13352
Ho-Ir Ho5 Ir2 Mn5 C2,mS28,15 C12/c1 1.5497,0.6399,0.7169,90,96.74,90 - - 11.38 A 13333
Ho-Ir Ho5 Ir3 ht Mn5 Si3,hP16,193 P63/mcm 0.813,0.813,0.6318,90,90,120 - - 12.87 A 15271
Ho-Ir Ho5 Ir3 rt Pu5Rh3,tP32,130 P4/ncc 1.0822,1.0822,0.6255,90,90,90 - - 12.71 A 13352
Ho-Mg MgHo CsCl,cP2,221 Pm-3m 0.377,0.377,0.377,90,90,90 b.c.c. family gray silver 5.87 X 2673
Ho-Mg Mg0.3 Ho0.7 ht W,cI2,229 Im-3m 0.3845,0.3845,0.3845,90,90,90 b.c.c. family - 7.17 X 2388
Ho-Mg Mg2 Ho MgZn2,hP12,194 P63/mmc 0.6015,0.6015,0.9746,90,90,120 Friauf-Laves phase gray silver 4.65 X 31742
Ho-Mg Mg24 Ho5 Ti5Re24,cI58,217 I-43m 1.1233,1.1233,1.1233,90,90,90 - white silver3.30 X 2375
Ho-Mn HoMn12 ThMn12,tI26,139 I4/mmm 0.857,0.857,0.4747,90,90,90 CaCu5-Zr4Al3 - 7.85 X 3779
Ho-Mn HoMn2 ht MgCu2,cF24,227 Fd-3m 0.74614,0.74614,0.74614,90,90,90 Friauf-Laves phase - 8.79 X 26213
Ho-Mn HoMn2 rt MgZn2,hP12,194 P63/mmc 0.5282,0.5282,0.8622,90,90,120 Friauf-Laves phase - 8.76 X 15197
Ho-Mn HoMn5 *,o**,* - 0.309,0.436,0.71,90,90,90 - - - N 1291
Ho-Mn Ho6 Mn23 Th6Mn23,cF116,225 Fm-3m 1.2341,1.2341,1.2341,90,90,90 - - 7.96 A 52473
Ho-N HoN NaCl,cF8,225 Fm-3m 0.4871,0.4871,0.4871,90,90,90 rocksalt family - 10.28 X 50653
Ho-N Ho2 N3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.058,1.058,1.058,90,90,90 - - 8.34 A 6879
Ho-Nd Nd0.6 Ho0.4 rt Sm,hR9,166 R-3m 0.3636,0.3636,2.6146,90,90,120 close-packed structure - 7.61 A 31777
Ho-Ni HoNi FeB-b,oP8,62 Pnma 0.702,0.414,0.5432,90,90,90 CrB(TlI)-FeB - 9.41 X 17068
Ho-Ni HoNi2 lt *,t*24,* - 0.7123,0.7123,0.7129,90,90,90 - - - N 14622
Ho-Ni HoNi2 rt MgCu2,cF24,227 Fd-3m 0.7143,0.7143,0.7143,90,90,90 Friauf-Laves phase - 10.29 X 23634
Ho-Ni HoNi3 PuNi3,hR36,166 R-3m 0.49574,0.49574,2.43475,90,90,120 Laves-CaCu5 - 9.84 X 46611
Ho-Ni HoNi5 CaCu5,hP6,191 P6/mmm 0.4871,0.4871,0.3966,90,90,120 - - 9.34 X 7425
Ho-Ni Ho0.95 Ni2 ht TmNi2,cF192,216 F-43m 1.4259,1.4259,1.4259,90,90,90 Friauf-Laves phase - 10.05 X 46379
Ho-Ni Ho2 Ni17 Th2Ni17,hP38,194 P63/mmc 0.8295,0.8295,0.8018,90,90,120 CaCu5-Zr4Al3 - 9.23 A 24767
Ho-Ni Ho2 Ni7 Gd2Co 7,hR54,166 R-3m 0.49325,0.49325,3.61646,90,90,120 Laves-CaCu5 - 9.69 A 46611
Ho-Ni Ho3 Ni Fe3C-b,oP16,62 Pnma 0.678,0.945,0.619,90,90,90 - - 9.27 A 24767
Ho-Ni Ho3 Ni2 ht Er3Ni2,hR45,148 R-3 0.8499,0.8499,1.5701,90,90,120 - - 9.32 A 35003
Ho-Ni Ho3 Ni2 rt Dy3Ni2,mS20,12 C12/m1 1.33,0.365,0.951,90,105.6,90 - - 9.15 A 7971
Ho-O HoO1.5 tf CaF2 ,cF12,225 Fm-3m 0.518,0.518,0.518,90,90,90 fluorite family - 9.03 X 9339
Ho-O Ho2 O3 ht1 Sm2 O3,mS30,12 C12/m1 1.3943,0.35,0.8644,90,100.18,90 - - 9.07 X 53577
Ho-O Ho2 O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.0606,1.0606,1.0606,90,90,90 - colorless 8.42 X 31428
Ho-Os HoOs2 MgZn2,hP12,194 P63/mmc 0.5297,0.5297,0.8749,90,90,120 Friauf-Laves phase - 17.04 A 3261
Ho-Os Ho3 Os Fe3C-b,oP16,62 Pnma 0.734,0.8985,0.6222,90,90,90 - - 11.09 A 13334
Ho-P HoP rt NaCl,cF8,225 Fm-3m 0.5604,0.5604,0.5604,90,90,90 rocksalt family - 7.39 X 12482
Ho-P HoP5 NdP 5,mP12,11 P121/m1 0.4896,0.937,0.5324,90,102.55,90 - black 4.46 X 35314
Ho-Pb HoPb3 Cu3Au,cP4,221 Pm-3m 0.4801,0.4801,0.4801,90,90,90 close-packed structure - 11.80 X 7486
Ho-Pb Ho5Pb3 Mn5 Si3,hP16,193 P63/mcm 0.8915,0.8915,0.6541,90,90,120 - - 10.67 X 3333
Ho-Pb Ho5Pb4 Sm5 Ge4,oP36,62 Pnma 0.8095,1.541,0.8148,90,90,90 - - 10.81 A 4345
Ho-Pd HoPd ht CsCl,cP2,221 Pm-3m 0.3469,0.3469,0.3469,90,90,90 b.c.c. family - 10.79 X 9389
Ho-Pd HoPd rt FeB-b,oP8,62 Pnma 0.7199,0.4242,0.5604,90,90,90 CrB(TlI)-FeB - 10.53 A 8406
Ho-Pd HoPd3 Cu3Au,cP4,221 Pm-3m 0.4067,0.4067,0.4067,90,90,90 close-packed structure - 11.95 X 14482
Ho-Pd Ho0.1 Pd0.9 Cu,cF4,225 Fm-3m 0.3963,0.3963,0.3963,90,90,90 close-packed structure white silver11.98 X 7474
Ho-Pd Ho2.12Pd0.88 Dy2.12Pd0.88 ,cF144,227 Fd-3m 1.3467,1.3467,1.3467,90,90,90 - - 9.64 X 59663
Ho-Pd Ho3Pd2 U3Si2,tP10,127 P4/mbm 0.7718,0.7718,0.3909,90,90,90 - - 10.09 A 7474
Ho-Pd Ho3Pd4 Pu3Pd4,hR42,148 R-3 1.307,1.307,0.5677,90,90,120 b.c.c. family - 10.92 A 8276
Ho-Po HoPo NaCl,cF8,225 Fm-3m 0.62,0.62,0.62,90,90,90 rocksalt family - 10.42 X 3160
Ho-Pr Pr0.35 Ho0.65 rt Nd,hP4,194 P63/mmc 0.3627,0.3627,1.168,90,90,120 close-packed structure - 7.81 X 18139
Ho-Pr Pr0.4 Ho0.6 Mg,hP2,194 P63/mmc 0.363,0.363,0.575,90,90,120 close-packed structure - 7.86 X 18139
Ho-Pr Pr0.6 Ho0.4 rt Sm,hR9,166 R-3m 0.3623,0.3623,2.664,90,90,120 close-packed structure - 7.43 A 18139
Ho-Pt HoPt FeB-b,oP8,62 Pnma 0.6932,0.4465,0.5528,90,90,90 CrB(TlI)-FeB - 13.98 A 13425
Ho-Pt HoPt2 MgCu2,cF24,227 Fd-3m 0.7586,0.7586,0.7586,90,90,90 Friauf-Laves phase - 16.89 X 3261
Ho-Pt HoPt3 Cu3Au,cP4,221 Pm-3m 0.4058,0.4058,0.4058,90,90,90 close-packed structure - 18.64 X 2487
110 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ho-Pt HoPt5 *,o*72,* - 0.5231,0.9091,2.649,90,90,90 - - - N 7793


Ho-Pt Ho2Pt Co2Si-b,oP12,62 Pnma 0.7054,0.4722,0.8686,90,90,90 - - 12.05 A 11341
Ho-Pt Ho3Pt Fe3C-b,oP16,62 Pnma 0.7019,0.9436,0.6394,90,90,90 - - 10.82 A 12087
Ho-Pt Ho3Pt4 Pu3Pd4,hR42,148 R-3 1.3061,1.3061,0.5661,90,90,120 b.c.c. family - 15.19 A 10744
Ho-Pt Ho5Pt3 Mn5Si3,hP16,193 P63 /mcm 0.8319,0.8319,0.6191,90,90,120 - - 12.62 A 11341
Ho-Pt Ho5Pt4 Sm5Ge4,oP36,62 Pnma 0.7426,1.4492,0.7508,90,90,90 - - 13.19 A 14279
Ho-Re HoRe2 MgZn2,hP12,194 P63 /mmc 0.5378,0.5378,0.8785,90,90,120 Friauf-Laves phase - 16.22 A 2635
Ho-Rh HoRh CsCl,cP2,221 Pm-3m 0.3377,0.3377,0.3377,90,90,90 b.c.c. family - 11.55 X 7014
Ho-Rh HoRh2 MgCu2,cF24,227 Fd-3m 0.7475,0.7475,0.7475,90,90,90 Friauf-Laves phase - 11.79 X 9908
Ho-Rh Ho3Rh2 Y3Rh2,tI140,140 I4/mcm 1.111,1.111,2.499,90,90,90 - - 10.56 A 9564
Ho-Rh Ho5Rh3 ht Mn5Si3,hP16,193 P63 /mcm 0.81,0.81,0.6337,90,90,120 - - 10.45 X 15271
Ho-Rh Ho7Rh3 Th7Fe3,hP20,186 P63 mc 0.9694,0.9694,0.6098,90,90,120 - - 9.79 A 7500
Ho-Ru HoRu2 MgZn2,hP12,194 P63 /mmc 0.5231,0.5231,0.88265,90,90,120 Friauf-Laves phase - 11.66 X 55250
Ho-Ru Ho3Ru Fe3C-b,oP16,62 Pnma 0.7242,0.9087,0.6225,90,90,90 - - 9.66 A 13334
Ho-Ru Ho3Ru2 Er3Ru2,hP10,176 P63 /m 0.7919,0.7919,0.3958,90,90,120 - - 10.77 A 23566
Ho-Ru Ho44Ru25 Y44Ru25,oP276,52 Pnna 2.7811,1.5043,1.5043,90,90,90 - - 10.33 A 23566
Ho-Ru Ho5Ru2 Mn5C2,mS28,15 C12/c1 1.5564,0.6251,0.7264,90,97.26,90 - - 9.73 A 12457
Ho-S HoS lt *,t**,* - 0.5438,0.5438,0.5435,90,90,90 - - - N 15500
Ho-S HoS rt NaCl,cF8,225 Fm-3m 0.5461,0.5461,0.5461,90,90,90 rocksalt family - 8.03 X 18387
Ho-S HoS1.863 HoS1.863 ,mP72,11 P121/m1 1.0961,1.1465,1.0984,90,91.27,90 - red 6.49 X 39230
Ho-S HoS1.885 UAs2,tP6,129 P4/nmm 0.382,0.382,0.784,90,90,90 - red dark 6.54 X 39230
Ho-S HoS2 hp *,c**,* - 0.7784,0.7784,0.7784,90,90,90 - black gray - N 5227
Ho-S Ho10S19 Ce10Se19,tP58,86 P42 /n 0.85694,0.85694,1.56929,90,90,90 - - 6.51 A 59478
Ho-S Ho2S3 hp1-ht Th2S3,oP20,62 Pnma 1.05724,0.38448,1.04115,90,90,90 - black 6.69 X 26831
Ho-S Ho2S3 Ho2S3,mP30,11 P121/m1 1.01243,0.40023,1.74615,90,98.529,90 - - 6.07 X 32695
Ho-S Ho2.67 S4 hp2-ht Th3P 4,cI28,220 I-43d 0.8265,0.8265,0.8265,90,90,90 - - 6.69 A 4627
Ho-S Ho5S7 hp Y5S7,mS24,12 C12/m1 1.273,0.379,1.152,90,104.85,90 - - 6.49 A 3940
Ho-Sb HoSb lt *,t**,* - 0.6122,0.6122,0.6104,90,90,90 - - - N 4826
Ho-Sb HoSb rt NaCl,cF8,225 Fm-3m 0.613,0.613,0.613,90,90,90 rocksalt family gray 8.27 X 23590
Ho-Sb HoSb2 hp-ht HoSb2,oS6,21 C222 0.3343,0.5790,0.7840,90,90,90 - - 8.94 X 5930
Ho-Sb Ho2Sb5 Dy2Sb5,mP28,11 P121/m1 1.3018,0.4149,1.4511,90,102.14,90 - - 8.14 X 41926
Ho-Sb Ho4Sb3 rt Th3P 4,cI28,220 I-43d 0.9071,0.9071,0.9071,90,90,90 - - 9.12 A 19168
Ho-Sb Ho5Sb3 Mn5Si3,hP16,193 P63 /mcm 0.8819,0.8819,0.6184,90,90,120 - - 9.49 X 50799
Ho-Sc Sc0.4 Ho0.6 Mg,hP2,194 P63 /mmc 0.348,0.348,0.547,90,90,120 close-packed structure - 6.77 X 26733
Ho-Se HoSe lt *,t*8,* - 0.5666,0.5666,0.5663,90,90,90 - - - N 15500
Ho-Se HoSe rt NaCl,cF8,225 Fm-3m 0.5666,0.5666,0.5666,90,90,90 rocksalt family - 8.91 X 15500
Ho-Se HoSe2 CeSe2,mP12,14 P121/c1 0.82131,0.40382,0.81633,90,90.071,90 - - 7.92 A 57465
Ho-Se Ho0.75 Se Sc0.685 S,hR12,166 R-3m 0.40257,0.40257,1.96495,90,90,120 - - 7.32 A 3930
Ho-Se Ho10Se19 Ce10Se19,tP58,86 P42 /n 0.89437,0.89437,1.64541,90,90,90 - - 7.95 A 59478
Ho-Se Ho2Se3 Sc2S3,oF80,70 Fddd 0.8126,1.1407,2.4239,90,90,90 - yellow 6.70 X 35386
Ho-Se Ho2.67 Se4 hp-ht Th3P 4,cI28,220 I-43d 0.8614,0.8614,0.8614,90,90,90 - - 7.86 A 4627
Ho-Se Ho8Se14.7 Gd8Se14.9 ,oS150,38 Amm2 1.1993,1.5999,1.6471,90,90,90 - gray silver 7.82 X 49617
Ho-Si HoSi ht FeB-b,oP8,62 Pnma 0.78269,0.38045,0.56431,90,90,90 CrB(TlI)-FeB gray 7.63 X 46652
Ho-Si HoSi rt TlI,oS8,63 Cmcm 0.42313,1.04474,0.38054,90,90,90 CrB(TlI)-FeB - 7.62 X 46652
Ho-Si HoSi1.7 ht1 GdSi1.4 ,oI12,74 Imma 0.393,0.4017,1.337,90,90,90 - gray 6.69 X 22489
Ho-Si HoSi2 ht2 AlB2,hP3,191 P6/mmm 0.3816,0.3816,0.4107,90,90,120 AlB2 family - 7.09 X 19641
Ho-Si HoSi3 hp YbSi3,tI32,139 I4/mmm 0.72047,0.72047,1.06861,90,90,90 - gray 5.97 X 57473
Ho-Si Ho10Si17 Dy10Si17,oI54,44 Imm2 0.8212,1.9063,0.66313,90,90,90 - - 6.80 X 47701
Ho-Si Ho2Si2.5 rt V2B3,oS20,63 Cmcm 0.4197,2.368,0.3798,90,90,90 - - 7.04 A 30184
Ho-Si Ho2Si2.67 Ho2Si2.67 ,oS24,63 Cmcm 0.4191,2.3785,0.38013,90,90,90 - - 7.10 X 34508
Ho-Si Ho5Si3 Mn5Si3,hP16,193 P63 /mcm 0.83533,0.83533,0.628,90,90,120 - - 7.95 X 47006
Ho-Si Ho5Si4 ht Gd5Si4,oP36,62 Pnma 0.73406,1.44574,0.76264,90,90,90 - - 7.69 X 46652
Ho-Sn HoSn2 ZrSi2,oS12,63 Cmcm 0.4358,1.6103,0.4274,90,90,90 close-packed structure - 8.91 X 54585
Ho-Sn HoSn2.85 hp Cu3Au,cP4,221 Pm-3m 0.46544,0.46544,0.46544,90,90,90 close-packed structure - 8.29 X 55456
Ho-Sn HoSn3 GdSn2.75 ,oS16,38 Amm2 0.4335,0.4373,2.1757,90,90,90 - - 8.39 A 27463
Ho-Sn Ho11Sn10 Ho11Ge10,tI84,139 I4/mmm 1.152,1.152,1.68,90,90,90 - - 8.94 A 5633
Ho-Sn Ho2Sn5 Er2Ge5,oP14,59 Pmmn 0.4307,0.4391,1.8928,90,90,90 - - 8.57 A 27463
Ho-Sn Ho3Sn7 Gd3Sn7,oS20,65 Cmmm 0.43495,2.6156,0.44209,90,90,90 close-packed structure - 8.75 X 55456
Ho-Sn Ho5Sn3 Mn5Si3,hP16,193 P63 /mcm 0.8847,0.8847,0.6458,90,90,120 - - 8.96 X 3333
Ho-Tb Tb0.5 Ho0.5 rt Mg,hP2,194 P63 /mmc 0.35929,0.35929,0.56572,90,90,120 close-packed structure - 8.50 X 7476
Ho-Tc HoTc2 MgZn2,hP12,194 P63 /mmc 0.5353,0.5353,0.8813,90,90,120 Friauf-Laves phase - 10.96 A 2225
Ho-Te HoTe rt NaCl,cF8,225 Fm-3m 0.609,0.609,0.609,90,90,90 rocksalt family gray 8.60 X 8218
Ho-Te HoTe2 hp-ht UAs2,tP6,129 P4/nmm 0.4264,0.4264,0.8872,90,90,90 - - 8.65 A 5233
Ho-Te HoTe3 NdTe3,oS16,63 Cmcm 0.4293,2.54,0.4293,90,90,90 - - 7.77 A 18466
Ho-Te Ho2Te3 Sc2S3,oF80,70 Fddd 0.8606,1.2172,2.5818,90,90,90 - - 7.00 X 2549
Ho-Te Ho2Te5 Nd2Te5,oS28,63 Cmcm 0.4411,4.503,0.4411,90,90,90 - - 7.34 A 8218
Ho-Th Th0.15 Ho0.85 Mg,hP2,194 P63 /mmc 0.359,0.359,0.566,90,90,120 close-packed structure - 9.20 X 3570
Ho-Th Th0.43 Ho0.57 rt Cu,cF4,225 Fm-3m 0.5038,0.5038,0.5038,90,90,90 close-packed structure - 10.07 X 4836
Ho-Tl TlHo lt CuTi,tP2,123 P4/mmm 0.35,0.35,0.42,90,90,90 b.c.c. family - 11.92 X 14458
Ho-Tl TlHo rt CsCl,cP2,221 Pm-3m 0.3735,0.3735,0.3735,90,90,90 b.c.c. family gray silver 11.77 X 2673
Ho-Tl Tl3Ho Cu3Au,cP4,221 Pm-3m 0.4668,0.4668,0.4668,90,90,90 close-packed structure - 12.70 X 20898
Ho-Tl Tl3Ho5 Tl+ Cr5B3,tI32,140 I4/mcm 0.7965,0.7965,1.425,90,90,90 - - 10.56 A 20898
Ho-Tl Tl3Ho5 Tl- Mn5Si3,hP16,193 P63 /mcm 0.885,0.885,0.655,90,90,120 - - 10.75 A 20898
Ho-Tl Tl5Ho3 Pu3Pd5,oS32,63 Cmcm 0.993,0.804,1.031,90,90,90 - - 12.24 A 14288
Ho-Zn ZnHo rt CsCl,cP2,221 Pm-3m 0.3548,0.3548,0.3548,90,90,90 b.c.c. family gray silver 8.56 X 45789
Ho-Zn Zn12Ho ThMn12,tI26,139 I4/mmm 0.8858,0.8858,0.5184,90,90,90 CaCu5-Zr4Al3 - 7.75 A 3117
Ho-Zn Zn17Ho2 ht Zn17Th2,hR57,166 R-3m 0.89566,0.89566,1.31261,90,90,120 CaCu5-Zr4Al3 gray 7.87 X 20156
Ho-Zn Zn17Ho2 rt Th2Ni17,hP38,194 P63 /mmc 0.8963,0.8963,0.8747,90,90,120 CaCu5-Zr4Al3 - 7.87 A 2632
Handbook of Inorganic Substances – Edition 2015 : Data 111

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ho-Zn Zn2Ho KHg2,oI12,74 Imma 0.447,0.7048,0.7611,90,90,90 AlB2 family - 8.19 X 6758


Ho-Zn Zn23 Ho6 Th6Mn23,cF116,225 Fm-3m 1.265,1.265,1.265,90,90,90 - - 8.18 A 2632
Ho-Zn Zn3Ho Zn3Y,oP16,62 Pnma 0.6697,0.43655,1.0099,90,90,90 - - 8.12 X 3809
Ho-Zn Zn5Ho Zn5Er,hP36,194 P63/mmc 0.8866,0.8866,0.9188,90,90,120 - - 7.83 A 6030
Ho-Zn Zn58 Ho13 Zn58 Gd13,hP142,194 P63/mmc 1.4238,1.4238,1.3995,90,90,120 - - 8.02 A 45789
Ho-Zn Zn58.71 Ho13 Zn58.71 Ho13,oP324,62 Pnma 1.4007,1.4245,2.4625,90,90,90 - - 8.09 X 48452
Ho-Zr Ho0.5 Zr0.5 m Mg,hP2,194 P63/mmc 0.3385,0.3385,0.534,90,90,120 close-packed structure - 8.03 X 6916
Ho-Zr Ho0.92 Zr0.08 Mg,hP2,194 P63/mmc 0.3594,0.3594,0.5628,90,90,120 close-packed structure - 8.39 X 54606
Ho-Zr Hox Zr rt Mg,hP2,194 P63/mmc 0.3239,0.3239,0.518,90,90,120 close-packed structure - 6.44 X 54606
I-In InI TlI,oS8,63 Cmcm 0.4763,1.2781,0.4909,90,90,90 CrB(TlI)-FeB red 5.37 X 22993
I-In InI2 GaCl2,oP24,52 Pnna 0.8427,1.0965,1.1173,90,90,90 - yellow pale 4.74 X 17718
I-In InI3 mon InI3,mP16,14 P121/c1 0.9837,0.6102,1.2195,90,107.69,90 - - 4.72 X 2204
I-In InI3 rhom *,hR24,146 R3 0.7229,0.7229,2.0514,90,90,120 - red - N 16889
I-Ir IrI3 AlCl3,mS16,12 C12/m1 0.674,1.175,0.688,90,108.,90 - brown red 7.34 A 4097
I-K KI hp CsCl,cP2,221 Pm-3m 0.394,0.394,0.394,90,90,90 b.c.c. family - 4.51 X 2267
I-K KI rt NaCl,cF8,225 Fm-3m 0.7005,0.7005,0.7005,90,90,90 rocksalt family - 3.21 X 45423
I-La LaI (H) ZrCl,hR12,166 R-3m 0.42063,0.42063,3.1947,90,90,120 - green 5.41 A 29870
I-La LaI rt NiAs,hP4,194 P63/mmc 0.39292,0.39292,0.9712,90,90,120 AlB2 family - 6.80 X 46423
I-La LaI2 CuZr2,tI6,139 I4/mmm 0.3912,0.3912,1.3937,90,90,90 close-packed structure violet 6.12 X 26330
I-La LaI3 PuBr3,oS16,63 Cmcm 0.4425,1.3979,1.0048,90,90,90 - - 5.55 A 12808
I-La La2I5 Pr2I5 ,mP14,11 P121/m1 0.8618,0.44038,1.458,90,89.8,90 - bronze 5.48 X 42463
I-Li LiI lt ZnO,hP4,186 P63mc 0.4514,0.4514,0.7311,90,90,120 adamantane structure - 3.45 X 43997
I-Li LiI rt NaCl,cF8,225 Fm-3m 0.606,0.606,0.606,90,90,90 rocksalt family - 3.99 X 19305
I-Lu LuI3 *,hP168,* - 1.958,1.958,2.077,90,90,120 - - - N 26650
I-Mg MgI2 CdI2 ,hP3,164 P-3m1 0.41537,0.41537,0.6862,90,90,120 CdI2-PbI2 polytype colorless 4.51 X 41153
I-Mn MnI2 CdI2 ,hP3,164 P-3m1 0.416,0.416,0.682,90,90,120 CdI2-PbI2 polytype brown pink 5.02 X 22
I-Mo MoI2 MoCl2,oS72,64 Cmce 1.5803,1.2562,1.2562,90,90,90 Chevrel phase brown 5.59 X 14535
I-Mo MoI3 RuBr3,oP16,59 Pmmn 0.642,1.2322,0.7115,90,90,90 - - 5.63 A 24647
I-N I[N3 ] lt I[N3 ]-a,oP24,55 Pbam 0.65551,1.27764,0.39837,90,90,90 - brown dark 3.36 X 57537
I-Na NaI NaCl,cF8,225 Fm-3m 0.64651,0.64651,0.64651,90,90,90 rocksalt family - 3.68 X 46526
I-Nb NbI3 m RuBr3,oP16,59 Pmmn 0.6353,1.214,0.7009,90,90,90 - - 5.82 A 24647
I-Nb NbI4 rt NbI4 ,oS40,36 Cmc21 0.767,1.323,1.393,90,90,90 - - 5.64 X 1621
I-Nb NbI5 mon NbI5 ,mP24,14 P121/c1 1.058,0.658,1.388,90,109.14,90 - - 5.29 X 2038
I-Nb NbI5 tricl UCl5,aP12,2 P-1 0.6977,0.7591,1.0322,109.07,90.93,116.17 - yellow 5.31 X 13864
I-Nb Nb3 I8 Nb3Br8,hR66,166 R-3m 0.76,0.76,4.1715,90,90,120 - - 6.18 X 3145
I-Nb Nb6 I11 lt Nb6I11,oP68,33 Pna21 1.3502,1.5325,1.132,90,90,90 - - 5.54 X 15145
I-Nb Nb6 I11 rt Nb6I11,oP68,56 Pccn 1.132,1.531,1.355,90,90,90 Chevrel phase black 5.53 X 15145
I-Nd NdI2 hp1 CuZr2,tI6,139 I4/mmm 0.3848,0.3848,1.3953,90,90,90 close-packed structure black 6.40 X 26329
I-Nd NdI2 SrBr2,tP30,85 P4/n 1.2592,1.2592,0.76682,90,90,90 - - 5.44 A 28129
I-Nd NdI3 rt PuBr3,oS16,63 Cmcm 0.4295,1.4009,0.9971,90,90,90 - - 5.81 A 12808
I-Ni NiI2 rt CdCl2,hR9,166 R-3m 0.3895,0.3895,1.963,90,90,120 - black 6.04 X 79
I-Np NpI3 PuBr3,oS16,63 Cmcm 0.431,1.393,0.994,90,90,90 - - 6.88 X 322
I-O IO2 IO2,mP24,14 P121/c1 0.78078,0.66997,0.83409,90,116.672,90 - yellow 5.41 X 20109
I-O IO3 IO3,aP16,2 P-1 0.5006,0.6741,0.6795,97.31,96.43,105.36 - yellow 5.36 X 32409
I-O I2O5 I2O5 ,mP28,14 P121/c1 1.1036,0.5063,0.8135,90,107.18,90 - - 5.11 X 5045
I-Os OsI3 RuBr3,oP16,59 Pmmn 0.6277,1.212,0.7012,90,90,90 - - 7.11 A 24647
I-P PI2 PI2,aP6,2 P-1 0.4461,0.7044,0.7346,80.75,73.85,81.78 - orange red 4.35 X 31367
I-P PI3 PI3,hP8,173 P63 0.7133,0.7133,0.7414,90,90,120 - orange red 4.19 X 9843
I-Pb PbI2 10H1 PbI2 -a,hP15,156 P3m1 0.4557,0.4557,3.4895,90,90,120 CdI2-PbI2 polytype - 6.10 X 4948
I-Pb PbI2 10H3 PbI2 -b,hP15,156 P3m1 0.4557,0.4557,3.4895,90,90,120 CdI2-PbI2 polytype - 6.10 X 12391
I-Pb PbI2 10Ha CdI2 -d,hP15,156 P3m1 0.4557,0.4557,3.4895,90,90,120 CdI2-PbI2 polytype - 6.10 X 12391
I-Pb PbI2 18R1 PbI2 -a,hR27,166 R-3m 0.456,0.456,6.281,90,90,120 CdI2-PbI2 polytype - 6.09 X 8730
I-Pb PbI2 20H PbI2 ,hP30,156 P3m1 0.4557,0.4557,6.979,90,90,120 CdI2-PbI2 polytype - 6.10 X 4948
I-Pb PbI2 22H PbI2 ,hP33,156 P3m1 0.4557,0.4557,7.6769,90,90,120 CdI2-PbI2 polytype - 6.10 X 12391
I-Pb PbI2 24H1 PbI2 ,hP36,156 P3m1 0.456,0.456,8.375,90,90,120 CdI2-PbI2 polytype - 6.09 X 9936
I-Pb PbI2 24R2 PbI2 ,hR36,166 R-3m 0.4557,0.4557,8.376,90,90,120 CdI2-PbI2 polytype - 6.10 X 17766
I-Pb PbI2 30H1 PbI2 ,hP45,156 P3m1 0.4557,0.4557,10.47,90,90,120 CdI2-PbI2 polytype - 6.10 X 17766
I-Pb PbI2 30R PbI2 ,hR45,166 R-3m 0.4557,0.4557,10.4685,90,90,120 CdI2-PbI2 polytype - 6.10 X 12391
I-Pb PbI2 36R1 PbI2 ,hR54,166 R-3m 0.4557,0.4557,12.564,90,90,120 CdI2-PbI2 polytype - 6.10 X 17766
I-Pb PbI2 48R PbI2 ,hR72,166 R-3m 0.456,0.456,16.748,90,90,120 CdI2-PbI2 polytype - 6.09 X 10283
I-Pb PbI2 4H PbI2 ,hP20,156 P3m1 0.4554,0.4554,1.3962,90,90,120 CdI2-PbI2 polytype - 6.11 X 23615
I-Pb PbI2 6H PbI2 ,hP9,156 P3m1 0.4557,0.4557,2.0937,90,90,120 CdI2-PbI2 polytype - 6.10 X 1168
I-Pb PbI2 6R CdCl2,hR9,166 R-3m 0.454,0.454,2.07,90,90,120 - - 6.22 X 248
I-Pb PbI2 8H CdI2 ,hP12,164 P-3m1 0.4557,0.4557,2.7916,90,90,120 CdI2-PbI2 polytype - 6.10 X 12391
I-Pb PbI2 hp 14H PbI2 ,hP21,156 P3m1 0.4557,0.4557,4.8853,90,90,120 CdI2-PbI2 polytype - 6.10 X 4948
I-Pb PbI2 ht PbI2 ,hR18,166 R-3m 0.4557,0.4557,4.1874,90,90,120 CdI2-PbI2 polytype - 6.10 X 1168
I-Pb PbI2 ht1 4H CdI2 ,hP6,186 P63mc 0.4557,0.4557,1.3958,90,90,120 CdI2-PbI2 polytype - 6.10 X 1168
I-Pb PbI2 rt 2H CdI2 ,hP3,164 P-3m1 0.4558,0.4558,0.69986,90,90,120 CdI2-PbI2 polytype yellow 6.08 X 23615
I-Pd PdI2 ht CaCl2,oP6,58 Pnnm 0.669,0.8,0.38,90,90,90 - black 5.88 X 3693
I-Pd PdI2 rt PdI2 ,mP12,14 P121/c1 0.669,0.860,0.687,90,103.5,90 - black 6.23 X 3948
I-Pr PrI2 cub PrI2,cF48,216 F-43m 1.236,1.236,1.236,90,90,90 - black 5.55 X 12828
I-Pr PrI2 hex MoS2,hP6,194 P63/mmc 0.4182,0.4182,1.518,90,90,120 - - 5.70 A 12828
I-Pr PrI2 rhom1 MoS2,hR9,160 R3m 0.4182,0.4182,2.2765,90,90,120 - - 5.70 A 12828
I-Pr PrI2 rhom2 CdCl2,hR9,166 R-3m 0.4265,0.4265,2.2471,90,90,120 - black 5.55 X 43180
I-Pr PrI2 tet CuZr2,tI6,139 I4/mmm 0.3864,0.3864,1.394,90,90,90 close-packed structure - 6.30 A 12828
I-Pr PrI3 PuBr3,oS16,63 Cmcm 0.43281,1.4003,0.9988,90,90,90 - green faint 5.72 A 12828
I-Pr Pr2I5 Pr2I5 ,mP14,11 P121/m1 0.86335,0.43108,1.43871,90,90.542,90 - - 5.68 X 25111
I-Pt PtI2 ht *,cI48,* - 1.109,1.109,1.109,90,90,90 - black - N 19702
112 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

I-Pt PtI2 rt PdI2,mP12,14 P121/c1 0.65877,0.8715,0.68894,90,102.76,90 - - 7.73 X 19702


I-Pt PtI3 PtI3,mS32,15 C12/c1 0.6735,1.2061,1.3313,90,101.25,90 - - 7.21 X 17619
I-Pt PtI4 orth TcCl4,oP40,61 Pbca 0.69,1.29,1.564,90,90,90 - black 6.71 X 4903
I-Pt PtI4 tet PtI4,tI40,88 I41/a 0.6769,0.6769,3.1095,90,90,90 - black 6.55 X 9252
I-Pt Pt3I8 Pt3I8,tP44,92 P41212 1.1664,1.1664,1.0682,90,90,90 - black 7.32 X 19702
I-Pu PuI3 PuBr3,oS16,63 Cmcm 0.429,1.39,0.99,90,90,90 - - 7.03 X 322
I-Rb RbI hp CsCl,cP2,221 Pm-3m 0.434,0.434,0.434,90,90,90 b.c.c. family - 4.31 X 2267
I-Rb RbI hp1 NaCl,cF8,225 Fm-3m 0.73466,0.73466,0.73466,90,90,90 rocksalt family - 3.56 X 2171
I-Rb Rb[I3] Cs[I3],oP16,62 Pnma 1.0908,0.6655,0.9711,90,90,90 - black 4.39 X 18797
I-Re ReI3 ReI3,mP24,11 P121/m1 0.8799,1.1309,0.9234,90,110.25,90 - - 6.55 X 4026
I-Rh RhI3 AlCl3,mS16,12 C12/m1 0.677,1.172,0.683,90,109.3,90 - - 6.28 X 4083
I-Ru RuI3 *,hP6,* - 0.6982,0.6982,0.6231,90,90,120 - - - N 3143
I-Sb SbI3 mon BiBr3,mP16,14 P121/c1 0.7281,1.0902,0.8946,90,109.93,90 - green 5.00 X 17681
I-Sb SbI3 rhom BiI3,hR24,148 R-3 0.7302,0.7302,2.0016,90,90,120 - red 5.42 X 35056
I-Sc ScI3 BiI3,hR24,148 R-3 0.7149,0.7149,2.0401,90,90,120 - yellow 4.70 A 2347
I-Sc Sc0.93 I2 rt CdI2,hP3,164 P-3m1 0.40851,0.40851,0.69824,90,90,120 CdI2 -PbI2 polytype black 4.86 X 23363
I-Si SiI2 SiI2,mP60,14 P121/c1 1.0966,1.5782,1.62292,90,120.20,90 - - 3.86 X 17827
I-Si SiI4 SnI4,cP40,205 Pa-3 1.198,1.198,1.198,90,90,90 - orange 4.14 X 37843
I-Si Si2I6 C2Cl6,oP32,62 Pnma 1.3702,1.2498,0.7894,90,90,90 - colorless 4.02 X 31323
I-Sm SmI2 hp1-ht PbCl2,oP12,62 Pnma 0.8893,0.4575,1.1184,90,90,90 - green dark 5.90 A 12830
I-Sm SmI3 hp PuBr3,oS16,63 Cmcm 0.4236,1.4,0.9969,90,90,90 - - 5.97 A 12808
I-Sm SmI3 rt BiI3,hR24,148 R-3 0.749,0.749,2.08,90,90,120 - - 5.24 A 2185
I-Sn SnI2 SnI2,mS18,12 C12/m1 1.417,0.4535,1.087,90,92.0,90 - red 5.32 X 6452
I-Sn SnI4 hp SnI4,cP40,205 Pa-3 1.22681,1.22681,1.22681,90,90,90 - orange red 4.51 X 39577
I-Sr SrI2 hp1-ht PbCl2,oP12,62 Pnma 0.8889,0.463,1.123,90,90,90 - - 4.91 A 12830
I-Sr SrI2 m Sr[OH]2,oP12,62 Pnma 1.2328,0.492,0.8384,90,90,90 - - 4.46 X 22440
I-Sr SrI2 SrI2,oP24,61 Pbca 0.79,1.522,0.822,90,90,90 - - 4.59 X 4901
I-Ta TaI4 TaI4,aP20,2 P-1 0.7059,1.0623,1.0723,79.55,89.78,75.57 - black 5.98 X 51574
I-Ta TaI5 NbBr5,oP48,62 Pnma 1.3962,2.0095,0.6607,90,90,90 - - 5.84 X 51575
I-Ta Ta2I5 Nb2F5,cI42,229 Im-3m 1.102,1.102,1.102,90,90,90 - - 7.42 A 4091
I-Ta Ta3I7 Nb3Cl7,oS80,64 Cmce 1.5032,1.4487,1.2518,90,90,90 Chevrel phase black 6.97 X 28288
I-Tb TbI3 hp PuBr3,oS16,63 Cmcm 0.4161,1.3978,0.9999,90,90,90 - - 6.16 A 12808
I-Tb TbI3 rt BiI3,hR24,148 R-3 0.7526,0.7526,2.0838,90,90,120 - - 5.26 A 2185
I-Te TeI m TeI,mS16,12 C12/m1 1.5383,0.4182,1.1999,90,128.09,90 - - 5.57 X 10233
I-Te TeI TeI,aP16,2 P-1 0.7992,0.8212,0.9958,90.13,102.89,104.37 - black 5.49 X 10233
I-Te TeI4 m mon TeI4,mP80,14 P121/c1 1.1199,1.3599,2.2158,90,98.1,90 - black 5.05 X 22036
I-Te TeI4 m orth TeI4,oP40,31 Pmn21 1.6753,0.6888,1.4539,90,90,90 - black 5.03 X 22036
I-Te TeI4 m tet TeI4,tI80,141 I41/amd 1.6875,1.6875,1.1829,90,90,90 - black 5.01 X 22036
I-Te TeI4 orth TeI4,oP80,62 Pnma 1.3635,1.6798,1.4624,90,90,90 - black 5.04 X 9541
I-Te Te0.5 I2 m trig CdI2,hP3,164 P-3m1 0.4228,0.4228,0.6684,90,90,120 CdI2 -PbI2 polytype black 5.10 X 22036
I-Te Te2I m Te2Br,oP24,62 Pnma 1.5295,0.4123,1.3694,90,90,90 - gray 5.88 X 10233
I-Te Te2I0.88 rt Te2I0.88 ,oS8,65 Cmmm 0.4464,0.4924,0.9037,90,90,90 - black 6.13 X 17852
I-Th ThI2 ht ThI2,hP12,194 P63 /mmc 0.397,0.397,3.175,90,90,120 - golden 7.45 X 4032
I-Th ThI2 rt *,hP*,* - 0.8,0.8,0.787,90,90,120 - black - N 2255
I-Th ThI3 mon *,mS*,15 C12/c1 0.787,3.1492,2.6991,90,90.,90 - black - N 15040
I-Th ThI3 orth ThI3,oS64,66 Cccm 0.8735,2.0297,1.4661,90,90,90 - - 6.26 X 15040
I-Th ThI4 ThI4,mP20,14 P121/c1 0.7766,0.8068,1.4283,90,113.83,90 - yellow 6.00 X 2206
I-Ti TiI2 rt CdI2,hP3,164 P-3m1 0.4122,0.4122,0.6789,90,90,120 CdI2 -PbI2 polytype - 5.02 X 38022
I-Ti TiI3 ht TiCl3,hP8,193 P63 /mcm 0.71446,0.71446,0.65099,90,90,120 - black violet4.95 X 57464
I-Ti TiI3 rt RuBr3,oP16,59 Pmmn 0.64984,1.23391,0.7133,90,90,90 - - 4.98 X 57464
I-Ti TiI4 ht SnI4,cP40,205 Pa-3 1.203,1.203,1.203,90,90,90 - - 4.24 A 16477
I-Ti TiI4 m *,aP100,* - 0.8114,0.8124,6.793,90.07,90.05,90.04 - - - N 17356
I-Ti TiI4 rt UI4,mS20,15 C12/c1 1.3218,0.8075,0.6859,90,90.65,90 - - 5.04 X 28046
I-Tl TlI ht CsCl,cP2,221 Pm-3m 0.4211,0.4211,0.4211,90,90,90 b.c.c. family yellow 7.37 X 16456
I-Tl TlI rt TlI,oS8,63 Cmcm 0.457,1.292,0.524,90,90,90 CrB(TlI)-FeB yellow 7.11 X 120
I-Tl TlI tf NaCl,cF8,225 Fm-3m 0.694,0.694,0.694,90,90,90 rocksalt family - 6.58 X 372
I-Tl Tl[I3] Cs[I3],oP16,62 Pnma 1.0599,0.6419,0.9436,90,90,90 - black 6.05 X 18797
I-Tm TmI2 CdI2,hP3,164 P-3m1 0.45196,0.45196,0.69755,90,90,120 CdI2 -PbI2 polytype - 5.69 A 26873
I-Tm TmI3 BiI3,hR24,148 R-3 0.7415,0.7415,2.078,90,90,120 - - 5.53 A 2185
I-U UI3 PuBr3,oS16,63 Cmcm 0.4334,1.4024,1.0013,90,90,90 - - 6.75 X 14356
I-U UI4 UI4,mS20,15 C12/c1 1.3967,0.8472,0.7510,90,90.54,90 - - 5.57 X 13241
I-V VI2 CdI2,hP3,164 P-3m1 0.4057,0.4057,0.676,90,90,120 CdI2 -PbI2 polytype black violet5.25 X 12766
I-W WI2 MoCl2,oS72,64 Cmce 1.584,1.258,1.259,90,90,90 Chevrel phase - 6.95 A 3762
I-W W15I47 W15I47,mS124,5 C121 4.0883,0.9523,1.1985,90,103.97,90 - - 6.40 X 55513
I-Y YI3 rt BiI3,hR24,148 R-3 0.74864,0.74864,2.088,90,90,120 - colorless 4.62 X 44244
I-Yb YbI2 ht CdI2,hP3,164 P-3m1 0.45097,0.45097,0.69683,90,90,120 CdI2 -PbI2 polytype - 5.78 A 26873
I-Yb YbI2 rt *,cP*,* - 0.4403,0.4403,0.4403,90,90,90 - yellow - N 5296
I-Yb YbI3 BiI3,hR24,148 R-3 0.7434,0.7434,2.072,90,90,120 - - 5.56 A 2185
I-Zn ZnI2 tet1 ZnI2,tI96,142 I41/acd 1.2284,1.2284,2.3582,90,90,90 - colorless 4.77 X 11262
I-Zr ZrI2 mon MoTe2,mP12,11 P121/m1 0.6821,0.3741,1.4937,90,95.66,90 - black 6.04 X 14387
I-Zr ZrI2 orth WTe2,oP12,31 Pmn21 0.3744,0.6831,1.4886,90,90,90 - black 6.02 X 15136
I-Zr ZrI2 rhom ZrCl2,hR54,148 R-3 1.4502,1.4502,0.9996,90,90,120 - - 5.66 X 15146
I-Zr ZrI3 orth RuBr3,oP16,59 Pmmn 0.6679,1.2594,0.7292,90,90,90 - black 5.11 X 23364
I-Zr ZrI4 mon ZrI4,mP30,13 P12/c1 0.8356,0.8326,1.7926,90,103.21,90 - orange red 4.91 X 12168
I-Zr ZrI4 orth *,oP20,29 Pca21 0.7077,0.8379,1.364,90,90,90 - - - N 14503
I-Zr ZrI4 tricl ZrI4,aP20,2 P-1 0.8343,0.8348,1.2978,108.27,108.18,90.04 - - 4.91 X 19585
I-Zr Zr0.88 I3 hex TiCl3,hP8,193 P63 /mcm 0.7239,0.7239,0.6673,90,90,120 - black blue 5.06 X 15141
In-Ir IrIn2 Mg2Cu,oF48,70 Fddd 0.53467,0.9801,1.8049,90,90,90 - gray light 11.85 X 37587
Handbook of Inorganic Substances – Edition 2015 : Data 113

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

In-Ir IrIn3 orth Fe3C-b,oP16,62 Pnma 0.746,0.8319,0.5315,90,90,90 - - 10.81 X 43120


In-Ir IrIn3 tet IrIn3 ,tP16,136 P42/mnm 0.69933,0.69933,0.71908,90,90,90 - gray faint 10.14 X 35185
In-Ir Ir0.988 In0.012 Cu,cF4,225 Fm-3m 0.3842,0.3842,0.3842,90,90,90 close-packed structure - 22.41 X 40241
In-K KIn4 BaAl4,tI10,139 I4/mmm 0.48462,0.48462,1.2687,90,90,90 - gray silver 5.56 X 45726
In-K K17In41 K17In41,cF464,227 Fd-3m 2.4241,2.4241,2.4241,90,90,90 - gray silver 5.01 X 28273
In-K K21.33 In39.67 K21(K0.33 In0.67)In39,hR366,166 R-3m 1.7214,1.7214,4.4612,90,90,120 - gray silver 4.69 X 26889
In-K K39In80 K39In80,hP238,164 P-3m1 1.7211,1.7211,2.8888,90,90,120 - gray silver 4.80 X 41589
In-K K8In11 K8In11,hR114,167 R-3c 1.0021,1.0021,5.0891,90,90,120 - gray dark 3.55 X 25579
In-La LaIn CsCl,cP2,221 Pm-3m 0.3985,0.3985,0.3985,90,90,90 b.c.c. family - 6.66 X 2945
In-La LaIn2 KHg2,oI12,74 Imma 0.4759,0.7695,0.9092,90,90,90 AlB2 family - 7.35 X 8299
In-La LaIn3 Cu3Au,cP4,221 Pm-3m 0.4745,0.4745,0.4745,90,90,90 close-packed structure - 7.51 X 52674
In-La La2In Co1.75 Ge,hP6,194 P63/mmc 0.5636,0.5636,0.7065,90,90,120 AlB2 family - 6.71 X 4104
In-La La3In Cu3Au,cP4,221 Pm-3m 0.507,0.507,0.507,90,90,90 close-packed structure - 6.77 X 27429
In-La La3In5 Pu3Pd5,oS32,63 Cmcm 1.0345,0.8424,1.0643,90,90,90 - - 7.10 X 30084
In-Li LiIn hp CsCl,cP2,221 Pm-3m 0.313,0.313,0.313,90,90,90 b.c.c. family - 6.59 X 34780
In-Li LiIn lt LiIn,tI8,141 I41/amd 0.4783,0.4783,0.6799,90,90,90 - - 5.20 X 40519
In-Li LiIn rt NaTl,cF16,227 Fd-3m 0.68014,0.68014,0.68014,90,90,90 b.c.c. family gray bluish 5.14 X 40519
In-Li LiIn3 hp Cu3Au,cP4,221 Pm-3m 0.4404,0.4404,0.4404,90,90,90 close-packed structure - 6.83 X 34780
In-Li Li0.14 In0.86 In,tI2,139 I4/mmm 0.32533,0.32533,0.49329,90,90,90 close-packed structure - 6.34 X 896
In-Li Li13 In3 Li13In3,cF128,227 Fd-3m 1.3556,1.3556,1.3556,90,90,90 b.c.c. family gray 2.32 X 12010
In-Li Li2In rt Li2Ga,oS12,63 Cmcm 0.4767,1.0017,0.4735,90,90,90 b.c.c. family gray 3.78 X 12010
In-Li Li3In2 rt Li3Al2,hR15,166 R-3m 0.4748,0.4748,1.474,90,90,120 b.c.c. family - 4.34 X 12896
In-Li Li5In4 rt Li5Ga4,hP9,164 P-3m1 0.478,0.478,0.888,90,90,120 b.c.c. family - 4.67 A 16562
In-Lu LuIn CuAu,tP2,123 P4/mmm 0.32506,0.32506,0.4326,90,90,90 close-packed structure - 10.53 X 31793
In-Lu LuIn2 ZrGa2,oS12,65 Cmmm 0.4541,1.3904,0.4564,90,90,90 close-packed structure - 9.33 A 34451
In-Lu LuIn3 Cu3Au,cP4,221 Pm-3m 0.4544,0.4544,0.4544,90,90,90 close-packed structure - 9.19 X 16143
In-Lu Lu2In Co1.75 Ge,hP6,194 P63/mmc 0.5237,0.5237,0.6568,90,90,120 AlB2 family - 9.89 X 16143
In-Lu Lu3In5 Tm3 Ga5,oP32,62 Pnma 1.2062,1.0255,0.633,90,90,90 - - 9.32 A 34451
In-Lu Lu5In4 Ti5Ga4,hP18,193 P63/mcm 0.9011,0.9011,0.6551,90,90,120 AlB2 family - 9.62 A 34451
In-Mg Mg0.04 In0.96 In,tI2,139 I4/mmm 0.32718,0.32718,0.4845,90,90,90 close-packed structure - 7.12 X 4093
In-Mg Mg0.1 In0.9 ht Cu,cF4,225 Fm-3m 0.4675,0.4675,0.4675,90,90,90 close-packed structure - 6.88 X 4093
In-Mg Mg0.978 In0.022 Mg,hP2,194 P63/mmc 0.32062,0.32062,0.52103,90,90,120 close-packed structure - 1.88 X 50825
In-Mg Mg1.05 In0.95 rt CuAu,tP2,123 P4/mmm 0.32421,0.32421,0.43967,90,90,90 close-packed structure - 4.84 X 2813
In-Mg Mg1.2 In2.8 rt Cu3Au,cP4,221 Pm-3m 0.4589,0.4589,0.4589,90,90,90 close-packed structure - 6.03 X 4093
In-Mg Mg2 In rt Mg2 In,hP9,189 P-62m 0.827,0.827,0.342,90,90,120 Fe2P family - 4.02 X 2041
In-Mg Mg3 In rt Mg3 In,hR48,166 R-3m 0.6323,0.6323,3.106,90,90,120 close-packed structure - 3.48 X 2041
In-Mg Mg5 In2 rt Mg5 Ga2,oI28,72 Ibam 0.736,1.423,0.619,90,90,90 - - 3.60 A 2041
In-Mn Mn0.86 In0.14 ht1 Mn,cP20,213 P4132 0.657,0.657,0.657,90,90,90 - - 7.42 A 358
In-Mn Mn9.75 In3.25 Cu9Al4,cP52,215 P-43m 0.942,0.942,0.942,90,90,90 γ-brass gray silver 7.22 X 12125
In-N InN hp NaCl,cF8,225 Fm-3m 0.4532,0.4532,0.4532,90,90,90 rocksalt family - 9.19 X 29337
In-N InN rt ZnO,hP4,186 P63mc 0.35372,0.35372,0.57029,90,90,120 adamantane structure - 6.92 X 42159
In-Na NaIn rt NaTl,cF16,227 Fd-3m 0.7332,0.7332,0.7332,90,90,90 b.c.c. family gray silver 4.64 X 12494
In-Na Na15 In27.4 Na15 In27.4 ,oS344,63 Cmcm 1.6108,3.5279,1.5931,90,90,90 - gray silver 5.12 X 27657
In-Na Na2In Na2Tl,oS48,20 C222 1 0.8836,1.3855,1.1762,90,90,90 - - 2.97 X 27657
In-Na Na7In11.76 Na7In11.76 ,tP228,137 P42/nmc 1.6093,1.6093,2.3384,90,90,90 - - 4.97 X 25967
In-Nb Nb0.75 In0.25 W,cI2,229 Im-3m 0.3326,0.3326,0.3326,90,90,90 b.c.c. family - 8.88 X 2273
In-Nb Nb3 In Cr3Si,cP8,223 Pm-3n 0.5293,0.5293,0.5293,90,90,90 Frank-Kasper phase - 8.81 X 15730
In-Nd NdIn CsCl,cP2,221 Pm-3m 0.3819,0.3819,0.3819,90,90,90 b.c.c. family - 7.72 X 12694
In-Nd NdIn3 rt Cu3Au,cP4,221 Pm-3m 0.464,0.464,0.464,90,90,90 close-packed structure - 8.12 X 14574
In-Nd Nd2 In Co1.75 Ge,hP6,194 P63/mmc 0.549,0.549,0.685,90,90,120 AlB2 family - 7.49 X 21318
In-Nd Nd3 In rt Cu3Au,cP4,221 Pm-3m 0.494,0.494,0.494,90,90,90 close-packed structure - 7.54 X 14574
In-Nd Nd3 In5 Pu3Pd5,oS32,63 Cmcm 1.008,0.8155,1.044,90,90,90 - - 7.79 A 14288
In-Ni NiIn ht CsCl,cP2,221 Pm-3m 0.312,0.312,0.312,90,90,90 b.c.c. family - 9.49 X 51219
In-Ni NiIn rt CoSn,hP6,191 P6/mmm 0.5241,0.5241,0.4349,90,90,120 AlB2 family - 8.36 X 56898
In-Ni Ni0.8 In0.2 m W,cI2,229 Im-3m 0.2929,0.2929,0.2929,90,90,90 b.c.c. family - 9.24 X 3683
In-Ni Ni0.96 In0.04 Cu,cF4,225 Fm-3m 0.3566,0.3566,0.3566,90,90,90 close-packed structure - 8.93 X 17833
In-Ni Ni1.78 In ht Co1.75 Ge,hP6,194 P63/mmc 0.4265,0.4265,0.5163,90,90,120 AlB2 family - 8.96 X 2279
In-Ni Ni13 In9 rt Ni13 Ga9,mS44,12 C12/m1 1.07215,0.83905,0.90376,90,125.368,90 AlB2 family - 9.00 X 46692
In-Ni Ni2In rt Co1.75 Ge,hP6,194 P63/mmc 0.41889,0.41889,0.5123,90,90,120 AlB2 family - 9.91 X 10078
In-Ni Ni2In3 Ni2Al3,hP5,164 P-3m1 0.439,0.439,0.51,90,90,120 - - 9.01 X 280
In-Ni Ni3In hp Cu3Au,cP4,221 Pm-3m 0.3762,0.3762,0.3762,90,90,90 close-packed structure - 9.07 X 17351
In-Ni Ni3In rt Mg3 Cd,hP8,194 P63/mmc 0.532,0.532,0.4242,90,90,120 close-packed structure - 9.29 X 359
In-Ni Ni3In6.4 Ru3Sn7,cI40,229 Im-3m 0.918,0.918,0.918,90,90,90 - - 7.82 X 3240
In-Ni Ni7In3 rt Cu7In3,aP40,2 P-1 0.65697,0.89083,0.97945,73.144,82.911,90.285 - - 9.22 X 46692
In-Np NpIn3 Cu3Au,cP4,221 Pm-3m 0.4611,0.4611,0.4611,90,90,90 close-packed structure - 9.85 X 27906
In-O In2O3 hp1 Al2O3,hR30,167 R-3c 0.5487,0.5487,1.451,90,90,120 - colorless 7.31 X 4625
In-O In2O3 hp2 Rh2S3,oP20,60 Pbcn 0.7875,0.5432,0.5539,90,90,90 - - 7.78 X 51229
In-O In2O3 hp3 Cr3C2-b,oP20,62 Pnma 0.5473,0.3003,1.1618,90,90,90 - - 9.66 X 51282
In-O In2O3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.01206,1.01206,1.01206,90,90,90 - yellow 7.12 X 45542
In-P InP hp1 NaCl,cF8,225 Fm-3m 0.5243,0.5243,0.5243,90,90,90 rocksalt family - 6.72 X 20586
In-P InP rt ZnS,cF8,216 F-43m 0.587,0.587,0.587,90,90,90 adamantane structure black 4.79 X 26911
In-P InP 3 hp SnP 3 ,hR24,166 R-3m 0.7449,0.7449,0.9885,90,90,120 - - 4.36 X 16385
In-P In0.5 P 0.5 hp2 Sn,tI4,141 I41/amd 0.498,0.498,0.258,90,90,90 - - 7.57 X 20586
In-Pb In0.5 Pb0.5 Cu,cF4,225 Fm-3m 0.485,0.485,0.485,90,90,90 close-packed structure - 9.37 X 3293
In-Pb In0.87 Pb0.13 In,tI2,139 I4/mmm 0.328,0.328,0.5,90,90,90 close-packed structure - 7.83 X 16400
In-Pb In0.87 Pb0.13 In,tI2,139 I4/mmm 0.344,0.344,0.455,90,90,90 close-packed structure - 7.82 X 16400
In-Pd PdIn CsCl,cP2,221 Pm-3m 0.3249,0.3249,0.3249,90,90,90 b.c.c. family - 10.71 X 41493
In-Pd Pd0.85 In0.15 Cu,cF4,225 Fm-3m 0.3939,0.3939,0.3939,90,90,90 close-packed structure - 11.70 X 11627
114 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

In-Pd Pd1.5 In0.5 tet1 CuAu,tP2,123 P4/mmm 0.28722,0.28722,0.38008,90,90,90 close-packed structure - 11.49 X 49770
In-Pd Pd2In rt Co2Si-b,oP12,62 Pnma 0.56168,0.42171,0.82278,90,90,90 - - 11.17 X 49770
In-Pd Pd2In3 Ni2Al3,hP5,164 P-3m1 0.452,0.452,0.549,90,90,120 - - 9.53 X 280
In-Pd Pd3In ht TiAl3,tI8,139 I4/mmm 0.40996,0.40996,0.74759,90,90,90 close-packed structure gray 11.47 X 53427
In-Pd Pd3In tet2 ZrAl3,tI16,139 I4/mmm 0.40545,0.40545,1.52592,90,90,90 close-packed structure gray 11.49 X 53427
In-Pd Pd3In tf SrPb3,tP4,123 P4/mmm 0.40711,0.40711,0.38044,90,90,90 close-packed structure - 11.43 X 50600
In-Pd Pd3In7 Ru3Sn7,cI40,229 Im-3m 0.94323,0.94323,0.94323,90,90,90 - - 8.89 X 34195
In-Pd Pd5In3 rt Rh5Ge3,oP16,55 Pbam 0.56135,1.1042,0.42426,90,90,90 - - 11.07 X 49770
In-Pr PrIn m CsCl,cP2,221 Pm-3m 0.3955,0.3955,0.3955,90,90,90 b.c.c. family - 6.86 X 2945
In-Pr PrIn3 Cu3Au,cP4,221 Pm-3m 0.46716,0.46716,0.46716,90,90,90 close-packed structure - 7.91 X 2680
In-Pr Pr2In Co1.75 Ge,hP6,194 P63 /mmc 0.5534,0.5534,0.6893,90,90,120 AlB2 family - 7.21 X 4104
In-Pr Pr3In Cu3Au,cP4,221 Pm-3m 0.499,0.499,0.499,90,90,90 close-packed structure - 7.18 X 12446
In-Pr Pr3In5 rt Pu3Pd5,oS32,63 Cmcm 1.0147,0.8208,1.043,90,90,90 - - 7.62 A 12446
In-Pt PtIn Pt+ CuAl,mS20,12 C12/m1 1.31641,0.44299,0.75797,90,123.261,90 - - 13.92 X 11598
In-Pt PtIn2 ht CaF2,cF12,225 Fm-3m 0.6365,0.6365,0.6365,90,90,90 damiaoite red copper 10.94 X 27508
In-Pt Pt0.5 In0.5 ht Cu,cF4,225 Fm-3m 0.3948,0.3948,0.3948,90,90,90 yixunite - 16.73 X 8587
In-Pt Pt0.94 In0.06 Cu,cF4,225 Fm-3m 0.3938,0.3938,0.3938,90,90,90 close-packed structure - 20.70 X 11627
In-Pt Pt1.5 In ht Co1.75 Ge,hP6,194 P63 /mmc 0.435,0.435,0.555,90,90,120 AlB2 family - 14.88 X 7021
In-Pt Pt13In9 Ni13Ga9,mS44,12 C12/m1 1.11258,0.8802,0.9439,90,125.663,90 AlB2 family - 15.79 X 11998
In-Pt Pt2In3 rt Ni2Al3,hP5,164 P-3m1 0.453,0.453,0.551,90,90,120 - - 12.46 A 27508
In-Pt Pt3In cub Cu3Au,cP4,221 Pm-3m 0.401,0.401,0.401,90,90,90 close-packed structure - 18.03 X 27508
In-Pt Pt3In tet SrPb3,tP4,123 P4/mmm 0.393,0.393,0.387,90,90,90 close-packed structure - 19.45 X 1560
In-Pt Pt3In2 rt Tl2Pt3,hP20,194 P63 /mmc 0.5575,0.5575,1.3657,90,90,120. - - 14.73 X 4105
In-Pt Pt3In7 Ru3Sn7,cI40,229 Im-3m 0.94274,0.94274,0.94274,90,90,90 - - 11.01 X 41030
In-Pt Pt5.5 In2.5 rt Pt5Ga3,oS16,65 Cmmm 0.818,0.781,0.409,90,90,90 close-packed structure - 17.29 X 4696
In-Pu PuIn rt CuAu,tP2,123 P4/mmm 0.3402,0.3402,0.4538,90,90,90 close-packed structure - 11.35 X 2814
In-Pu PuIn3 Cu3Au,cP4,221 Pm-3m 0.46096,0.46096,0.46096,90,90,90 close-packed structure - 9.98 X 2814
In-Pu Pu0.5 In0.5 ht In,tI2,139 I4/mmm 0.338,0.338,0.455,90,90,90 close-packed structure - 11.46 X 2703
In-Pu Pu0.75 In0.25 ht Cu,cF4,225 Fm-3m 0.475,0.475,0.475,90,90,90 close-packed structure - 13.12 X 2703
In-Pu Pu0.94 In0.06 ht3 Cu,cF4,225 Fm-3m 0.465,0.465,0.465,90,90,90 close-packed structure - 15.61 X 2814
In-Pu Pu3In rt Cu3Au,cP4,221 Pm-3m 0.4705,0.4705,0.4705,90,90,90 close-packed structure - 13.50 X 2814
In-Rb RbIn4 BaAl4,tI10,139 I4/mmm 0.4928,0.4928,1.2575,90,90,90 - gray silver 5.92 X 45726
In-Rb Rb2In3 Rb2In3,tI20,139 I4/mmm 0.68735,0.68735,1.5899,90,90,90 - - 4.56 X 28123
In-Rb Rb8In11 K8In11,hR114,167 R-3c 1.0301,1.0301,5.2367,90,90,120 - - 4.03 X 28223
In-Rh RhIn CsCl,cP2,221 Pm-3m 0.319,0.319,0.319,90,90,90 b.c.c. family - 11.14 X 16441
In-Rh RhIn3 IrIn3,tP16,136 P42 /mnm 0.69828,0.69828,0.71111,90,90,90 - gray faint 8.57 X 35185
In-Ru RuIn3 IrIn3,tP16,136 P42 /mnm 0.7003,0.7003,0.7247,90,90,90 - black 8.33 X 30273
In-Ru Ru3In Mg3Cd,hP8,194 P63 /mmc 0.5942,0.5942,0.4689,90,90,120 close-packed structure - 9.68 A 2302
In-S InS hp mon InS,mP8,14 P121/c1 0.38554,1.07668,0.54157,90,134.503,90 - red 6.08 X 41058
In-S InS rt InS,oP8,58 Pnnm 0.4453,1.065,0.39457,90,90,90 - red 5.21 X 31147
In-S In2S3 hp Al2O3,hR30,167 R-3c 0.6561,0.6561,1.757,90,90,120 - - 4.96 X 12021
In-S In2S3 ht2 *,o**,* - 0.413,0.539,1.059,90,90,90 - - - N 6367
In-S In2S3 rt In2S3,tI80,141 I41/amd 0.76205,0.76205,3.23603,90,90,90 - red 4.61 X 55992
In-S In2.67 S4 ht1 Fe3O4,cF56,227 Fd-3m 1.0774,1.0774,1.0774,90,90,90 spinel family white 4.62 X 20682
In-S In5S4 (Sn) In5S4,cP72,205 Pa-3 1.234,1.234,1.234,90,90,90 - red 4.97 X 13007
In-S In6S7 In5(In0.91 Sn0.09 )0.92 S7,mP26,11 P121/m1 0.909,0.3887,1.71919,90,101.951,90 - black 5.10 X 3362
In-Sb InSb hp1 InSb,oP2,25 Pmm2 0.299,0.585,0.3117,90,90,90 - - 7.21 X 16597
In-Sb InSb hp2 InSb,oP4,59 Pmmn 0.5357,0.5712,0.3063,90,90,90 - - 8.38 X 11580
In-Sb InSb hp2-ht NaCl,cF8,225 Fm-3m 0.6132,0.6132,0.6132,90,90,90 rocksalt family - 6.82 X 12559
In-Sb InSb hp4 CsCl,cP2,221 Pm-3m 0.339,0.339,0.339,90,90,90 b.c.c. family - 10.08 X 22752
In-Sb InSb rt ZnS,cF8,216 F-43m 0.6463,0.6463,0.6463,90,90,90 adamantane structure - 5.82 X 57486
In-Sb InSb tf ZnO,hP4,186 P63 mc 0.457,0.457,0.748,90,90,120 adamantane structure - 5.81 A 905
In-Sb In0.4 Sb0.6 hp1-ht Po,cP1,221 Pm-3m 0.3047,0.3047,0.3047,90,90,90 - - 6.98 X 16597
In-Sb In0.44 Sb0.56 hp2-ht Po,hR3,166 R-3m 0.42916,0.42916,0.53665,90,90,120 - - 6.91 X 16597
In-Sb In0.5 Sb0.5 hp1-ht Sn,tI4,141 I41/amd 0.581,0.581,0.3136,90,90,90 - - 7.42 X 11580
In-Sb In0.5 Sb0.5 hp3 (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.301,0.301,0.279,90,90,120 - - 8.97 X 22752
In-Sb In0.7 Sb0.3 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3205,0.3205,0.2981,90,90,120 - - 7.32 X 2755
In-Sb In2Sb hp Co1.75 Ge,hP6,194 P63 /mmc 0.5364,0.5364,0.6408,90,90,120 AlB2 family - 7.31 X 14623
In-Sb In5Sb3 hp In5Bi3,tI32,140 I4/mcm 0.834,0.834,1.234,90,90,90 - - 7.27 A 14623
In-Sc ScIn tet CuAu,tP2,123 P4/mmm 0.32096,0.32096,0.4326,90,90,90 close-packed structure - 5.95 X 31793
In-Sc ScIn2 ZrGa2,oS12,65 Cmmm 0.444,1.3571,0.4459,90,90,90 close-packed structure - 6.79 A 31793
In-Sc ScIn3 Cu3Au,cP4,221 Pm-3m 0.446,0.446,0.446,90,90,90 close-packed structure - 7.29 X 16143
In-Sc Sc1.1 In0.9 cub CsCl,cP2,221 Pm-3m 0.3564,0.3564,0.3564,90,90,90 b.c.c. family - 5.60 X 31793
In-Sc Sc2In Co1.75 Ge,hP6,194 P63 /mmc 0.505,0.505,0.63,90,90,120 AlB2 family - 4.89 X 47389
In-Sc Sc3In hp-ht Cu3Au,cP4,221 Pm-3m 0.4458,0.4458,0.4458,90,90,90 close-packed structure - 4.68 X 17351
In-Sc Sc3In Mg3Cd,hP8,194 P63 /mmc 0.6421,0.6421,0.5183,90,90,120 close-packed structure - 4.48 X 1622
In-Se InSe hp HgCl,tI8,139 I4/mmm 0.387,0.387,1.085,90,90,90 - - 7.92 A 51226
In-Se InSe ht-hp InSe,mS8,12 C12/m1 1.174,0.411,0.461,90,110.3,90 - - 6.17 X 15353
In-Se InSe lt GaS-a,hP8,194 P63 /mmc 0.40037,0.40037,1.6644,90,90,120 - - 5.57 X 58531
In-Se InSe rt GaSe,hR12,160 R3m 0.4002,0.4002,2.4946,90,90,120 - - 5.58 X 13092
In-Se In2Se3 ht 2H *,hP10,194 P63 /mmc 0.40242,0.40242,1.9251,90,90,120 - - 5.74 N 55176
In-Se In2Se3 ht 3R Bi2Te3,hR15,166 R-3m 0.405,0.405,2.941,90,90,120 - - 5.56 X 3178
In-Se In2Se3 ht1 In2Se3,hP30,169 P61 0.71286,0.71286,1.9381,90,90,120 - black 5.45 X 32073
In-Se In2Se3 ht2 *,hP5,* - 0.4,0.4,0.956,90,90,120 - - - N 8131
In-Se In2Se3 rt 3R Bi2Te3,hR15,166 R-3m 0.4025,0.4025,2.8762,90,90,120 - - 5.76 A 12390
In-Se In2Se3 rt hex In2Se3,hP160,173 P63 1.6,1.6,1.924,90,90,120 - - 5.81 X 1516
In-Se In2.67 Se4 ht2 Fe3O4,cF56,227 Fd-3m 1.0099,1.0099,1.0099,90,90,90 spinel family - 8.03 A 2639
In-Se In4Se3 In4Se3,oP28,58 Pnnm 1.2308,1.5296,0.40806,90,90,90 - black 6.02 X 31135
Handbook of Inorganic Substances – Edition 2015 : Data 115

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

In-Se In5Se 7 ht *,c*48,* - 1.096,1.096,1.096,90,90,90 - - - N 6595


In-Se In6Se 7 (Sn) In5(In0.91 Sn0.09 )0.92 S7 ,mP26,11 P121/m1 0.9433,0.4064,1.7663,90,100.92,90 - black 6.20 X 31136
In-Sm SmIn CsCl,cP2,221 Pm-3m 0.3815,0.3815,0.3815,90,90,90 b.c.c. family - 7.93 X 15253
In-Sm SmIn3 rt Cu3Au,cP4,221 Pm-3m 0.462,0.462,0.462,90,90,90 close-packed structure - 8.33 X 14574
In-Sm Sm2 In Co1.75 Ge,hP6,194 P63/mmc 0.545,0.545,0.679,90,90,120 AlB2 family - 7.90 X 14574
In-Sm Sm3 In rt Cu3Au,cP4,221 Pm-3m 0.488,0.488,0.488,90,90,90 close-packed structure - 8.09 X 14574
In-Sm Sm3 In5 Pu3Pd5,oS32,63 Cmcm 1.00137,0.81211,1.03858,90,90,90 - gray 8.06 X 56675
In-Sn In0.05 Sn0.95 rt Sn,tI4,141 I41/amd 0.58274,0.58274,0.31814,90,90,90 - - 7.29 X 2131
In-Sn In0.2 Sn0.8 (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3206,0.3206,0.2996,90,90,120 - - 7.34 X 8053
In-Sn In0.75 Sn0.25 lt In,tI2,139 I4/mmm 0.3459,0.3459,0.4397,90,90,90 close-packed structure - 7.31 X 8053
In-Sn In0.87 Sn0.13 In,tI2,139 I4/mmm 0.325,0.325,0.505,90,90,90 close-packed structure - 7.18 X 16400
In-Sr SrIn SrIn,oF64,43 Fdd2 1.023,2.615,0.84,90,90,90 - gray silver 4.79 X 45726
In-Sr SrIn2 CaIn2,hP6,194 P63/mmc 0.5009,0.5009,0.8036,90,90,120 AlB2 family gray silver 6.03 X 45726
In-Sr SrIn3 Mg3 Cd,hP8,194 P63/mmc 0.6769,0.6769,0.5481,90,90,120 close-packed structure gray white 6.60 A 3142
In-Sr SrIn4 EuIn4,mS20,12 C12/m1 1.2079,0.51245,0.992,90,114.85,90 - gray silver 6.52 X 37262
In-Sr SrIn5 CaCu5,hP6,191 P6/mmm 0.5937,0.5937,0.4827,90,90,120 - gray white 7.46 X 3142
In-Sr Sr11 In7 Ca11 Ga7,cF144,225 Fm-3m 1.772,1.772,1.772,90,90,90 - - 4.22 X 50550
In-Sr Sr28 In11 Ca28 Ga11,oI78,44 Imm2 0.5826,6.6878,0.8235,90,90,90 - gray silver 3.85 X 44112
In-Sr Sr3In11 La3Al11,oI28,71 Immm 0.49328,1.124,1.428,90,90,90 - black 6.40 X 43071
In-Sr Sr3In5 Ca3Ga5,oS32,63 Cmcm 0.49683,1.1958,1.6664,90,90,90 - gray silver 5.62 X 38744
In-Sr Sr5In3 Cr5B3,tI32,140 I4/mcm 0.8744,0.8744,1.6429,90,90,90 - gray silver 4.14 X 44112
In-Tb TbIn rt *,t**,* - 0.962,0.962,0.842,90,90,90 - - - N 9912
In-Tb TbIn3 Cu3Au,cP4,221 Pm-3m 0.4593,0.4593,0.4593,90,90,90 close-packed structure - 8.63 X 54841
In-Tb Tb2In Co1.75 Ge,hP6,194 P63/mmc 0.536,0.536,0.6702,90,90,120 AlB2 family - 8.62 X 21318
In-Tb Tb3In5 Pu3Pd5,oS32,63 Cmcm 0.987,0.802,1.028,90,90,90 - - 8.58 A 14288
In-Tb Tb5In3 W5Si3,tI32,140 I4/mcm 1.224,1.224,0.601,90,90,90 - gray silver 8.40 A 16143
In-Te InTe hp1 NaCl,cF8,225 Fm-3m 0.6133,0.6133,0.6133,90,90,90 rocksalt family - 6.98 X 56991
In-Te InTe hp2 CsCl,cP2,221 Pm-3m 0.363,0.363,0.363,90,90,90 b.c.c. family - 8.42 X 19437
In-Te InTe m *,tP8,* - 0.606,0.606,0.655,90,90,90 - - - N 2783
In-Te InTe rt TlSe,tI16,140 I4/mcm 0.8454,0.8454,0.7152,90,90,90 - black 6.30 X 9612
In-Te InTe x In,tI2,139 I4/mmm 0.326,0.326,0.494,90,90,90 close-packed structure - 7.26 X 56996
In-Te In0.67 Te ht ZnS,cF8,216 F-43m 0.616,0.616,0.616,90,90,90 adamantane structure - 5.81 X 20084
In-Te In2 Te 3 hp Bi2Te3,hR15,166 R-3m 0.4143,0.4143,2.676,90,90,120 - - 7.67 A 26591
In-Te In2 Te 3 orth *,oI*,44 Imm2 0.4357,1.3072,0.6162,90,90,90 - - - N 33177
In-Te In2 Te 3 rt In2 Te3,cF180,216 F-43m 1.85,1.85,1.85,90,90,90 - - 5.78 X 1526
In-Te In2 Te 3 tet In2 Te3,tI30,107 I4mm 1.30779,1.30779,0.6165,90,90,90 - - 5.79 X 1107
In-Te In2 Te 3 tf *,hP5,* - 0.435,0.435,0.713,90,90,120 - - - N 5226
In-Te In2 Te 5 mon1 In2 Te5,mS28,9 C1c1 0.439,1.639,1.352,90,91.65,90 - black 5.93 X 9606
In-Te In2 Te 5 mon2 In2 Te5,mS84,15 C12/c1 1.666,0.436,4.134,90,100.1,90 - black 5.85 X 11320
In-Te In3 Te 4 cub *,cP*,* - 1.05,1.05,1.05,90,90,90 - - - N 3654
In-Te In3 Te 4 rhom In3 Te4,hR21,166 R-3m 0.426,0.426,4.06,90,90,120 - - 6.67 X 2714
In-Te In3 Te 4 tet *,tI14,* - 0.6173,0.6173,1.2438,90,90,90 - - - N 11127
In-Te In4 Te 3 In4Se3,oP28,58 Pnnm 1.2749,1.5619,0.44348,90,90,90 - black 6.33 X 31135
In-Te In7 Te 10 Al7Te10,hR102,155 R32 1.4873,1.4873,1.891,90,90,120 - black 5.72 X 31156
In-Th ThIn ThIn,oP24,57 Pbcm 1.0806,0.9954,0.6520,90,90,90 - - 9.86 X 17190
In-Th ThIn3 Cu3Au,cP4,221 Pm-3m 0.4701,0.4701,0.4701,90,90,90 close-packed structure - 9.21 X 17129
In-Th Th2In CuAl2,tI12,140 I4/mcm 0.7775,0.7775,0.6087,90,90,90 - - 10.45 X 6743
In-Th Th3In5 Pu3Pd5,oS32,63 Cmcm 1.0193,0.8205,1.0374,90,90,90 - - 9.72 X 17129
In-Ti Ti1.12 In0.88 InBi,tP4,129 P4/nmm 0.42369,0.42369,0.42176,90,90,90 - - 6.79 X 41711
In-Ti Ti2In5 Hg5Mn2,tP14,127 P4/mbm 1.00035,1.00035,0.29977,90,90,90 - gray faint 7.42 X 31242
In-Ti Ti3In rt Mg3 Cd,hP8,194 P63/mmc 0.5978,0.5978,0.4812,90,90,120 close-packed structure - 5.77 A 41711
In-Ti Ti8In5 Ti8In5,cP52,215 P-43m 0.99578,0.99578,0.99578,90,90,90 - - 6.44 X 41711
In-Tl Tl0.12 In0.88 rt In,tI2,139 I4/mmm 0.32824,0.32824,0.4912,90,90,90 close-packed structure - 7.88 X 2711
In-Tl Tl0.5 In0.5 rt Cu,cF4,225 Fm-3m 0.4784,0.4784,0.4784,90,90,90 close-packed structure - 9.68 X 1852
In-Tl Tl0.749 In0.251 ht W,cI2,229 Im-3m 0.3828,0.3828,0.3828,90,90,90 b.c.c. family - 10.77 X 352
In-Tl Tl0.9 In0.1 rt Mg,hP2,194 P63/mmc 0.34475,0.34475,0.5525,90,90,120 close-packed structure - 11.41 X 1852
In-Tm TmIn CsCl,cP2,221 Pm-3m 0.3737,0.3737,0.3737,90,90,90 b.c.c. family - 9.03 X 16143
In-Tm TmIn3 Cu3Au,cP4,221 Pm-3m 0.45207,0.45207,0.45207,90,90,90 close-packed structure - 9.23 X 22467
In-Tm Tm2 In Co1.75 Ge,hP6,194 P63/mmc 0.5273,0.5273,0.662,90,90,120 AlB2 family - 9.43 X 16143
In-Tm Tm3 In5 Tm3 Ga5,oP32,62 Pnma 1.2107,1.0243,0.6351,90,90,90 - - 9.12 A 31793
In-Tm Tm5 In4 Ti5Ga4,hP18,193 P63/mcm 0.9095,0.9095,0.6568,90,90,120 AlB2 family - 9.20 A 31793
In-U UIn3 Cu3Au,cP4,221 Pm-3m 0.4606,0.4606,0.4606,90,90,90 close-packed structure - 9.90 X 7733
In-V V3In hp *,t**,* - 0.6153,0.6153,0.9477,90,90,90 - - - N 8278
In-Y YIn3 Cu3Au,cP4,221 Pm-3m 0.45935,0.45935,0.45935,90,90,90 close-packed structure - 7.42 X 2680
In-Y Y0.5 In0.5 In,tI2,139 I4/mmm 0.32569,0.32569,0.4942,90,90,90 close-packed structure - 6.45 X 51930
In-Y Y2In Co1.75 Ge,hP6,194 P63/mmc 0.537,0.537,0.679,90,90,120 AlB2 family gray silver 5.73 X 16143
In-Y Y3In5 ht Pu3Pd5,oS32,63 Cmcm 0.984,0.8002,1.0315,90,90,90 - - 6.88 X 30084
In-Y Y3In5 rt Tm3 Ga5,oP32,62 Pnma 1.2219,1.0328,0.6424,90,90,90 - - 6.89 X 30084
In-Y Y5In3 Mn5 Si3,hP16,193 P63/mcm 0.896,0.896,0.671,90,90,120 - gray silver 5.62 A 16143
In-Yb YbIn CsCl,cP2,221 Pm-3m 0.3828,0.3828,0.3828,90,90,90 b.c.c. family - 8.52 X 4104
In-Yb YbIn2 CaIn2,hP6,194 P63/mmc 0.4889,0.4889,0.763,90,90,120 AlB2 family - 8.47 X 2405
In-Yb YbIn3 Cu3Au,cP4,221 Pm-3m 0.4613,0.4613,0.4613,90,90,90 close-packed structure - 8.75 X 3584
In-Yb Yb2In rt Co2Si-b,oP12,62 Pnma 0.7072,0.534,0.9866,90,90,90 - - 8.22 X 6003
In-Yb Yb8In3 Yb8In3,hR132,167 R-3c 0.9545,0.9545,5.4272,90,90,120 - - 8.05 X 22424
In-Zr ZrIn2 HfGa2,tI24,141 I41/amd 0.4387,0.4387,2.7238,90,90,90 close-packed structure gray light 8.13 X 37587
In-Zr ZrIn3 ht TiAl3,tI8,139 I4/mmm 0.4238,0.4238,0.9786,90,90,90 close-packed structure - 8.23 X 2857
In-Zr ZrIn3 rt ZrAl3,tI16,139 I4/mmm 0.4303,0.4303,1.894,90,90,90 close-packed structure - 8.25 A 2857
In-Zr Zr0.5 In0.5 ht Cu,cF4,225 Fm-3m 0.4418,0.4418,0.4418,90,90,90 close-packed structure - 7.94 X 2320
116 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

In-Zr Zr1.33 In0.67 CuAu,tP2,123 P4/mmm 0.3097,0.3097,0.45318,90,90,90 close-packed structure - 7.57 X 38101
In-Zr Zr3In Cu3Au,cP4,221 Pm-3m 0.446,0.446,0.446,90,90,90 close-packed structure - 7.27 X 1721
Ir-La LaIr2 MgCu2,cF24,227 Fd-3m 0.7603,0.7603,0.7603,90,90,90 Friauf-Laves phase - 15.82 X 56225
Ir-La LaIr3 PuNi3,hR36,166 R-3m 0.537,0.537,2.6418,90,90,120 Laves-CaCu5 - 16.21 A 23067
Ir-La LaIr5 CaCu5,hP6,191 P6/mmm 0.5385,0.5385,0.4213,90,90,120 - - 17.26 X 23067
Ir-La La2Ir7 ht Gd2Co7,hR54,166 R-3m 0.5281,0.5281,3.9537,90,90,120 Laves-CaCu5 - 16.94 A 23067
Ir-La La2Ir7 rt Ce2Ni7,hP36,194 P63 /mmc 0.5371,0.5371,2.5995,90,90,120 Laves-CaCu5 - 16.60 A 23067
Ir-La La3Ir Fe3C-b,oP16,62 Pnma 0.7458,1.0096,0.6662,90,90,90 - - 8.06 A 27429
Ir-La La5Ir2 rt Mn5C2,mS28,15 C12/c1 1.6884,0.6759,0.741,90,95.92,90 - - 8.52 A 23067
Ir-La La5Ir3 ht Pu5Rh3,tP32,130 P4/ncc 1.1435,1.1435,0.6604,90,90,90 - - 9.78 A 23067
Ir-La La7Ir3 Th7Fe3,hP20,186 P63 mc 1.0214,1.0214,0.6462,90,90,120 - - 8.81 A 23067
Ir-Li LiIr LiRh,hP2,187 P-6m2 0.26493,0.26493,0.4397,90,90,120 close-packed structure black gray 12.37 X 11628
Ir-Li LiIr3 LiIr3,oI8,44 Imm2 0.26726,0.86946,0.46703,90,90,90 close-packed structure - 17.86 X 9929
Ir-Lu LuIr CsCl,cP2,221 Pm-3m 0.333,0.333,0.333,90,90,90 b.c.c. family - 16.51 X 2764
Ir-Lu LuIr2 m MgCu2,cF24,227 Fd-3m 0.7457,0.7457,0.7457,90,90,90 Friauf-Laves phase - 17.92 X 20749
Ir-Lu Lu3Ir Fe3C-b,oP16,62 Pnma 0.7101,0.8884,0.6247,90,90,90 - - 12.09 A 12087
Ir-Lu Lu5Ir2 Mn5C2,mS28,15 C12/c1 1.5062,0.6279,0.7073,90,96.94,90 - - 12.60 X 13333
Ir-Lu Lu5Ir3 ht Mn5Si3,hP16,193 P63 /mcm 0.8024,0.8024,0.6217,90,90,120 - - 13.91 A 15271
Ir-Lu Lu5Ir3 rt Pu5Rh3,tP32,130 P4/ncc 1.0539,1.0539,0.6093,90,90,90 - - 14.25 A 13352
Ir-Mg MgIr2 MgZn2,hP12,194 P63 /mmc 0.5169,0.5169,0.8385,90,90,120 Friauf-Laves phase - 14.00 X 44119
Ir-Mg Mg1.037 Ir0.963 MgIr,oS304,64 Cmce 1.8505,1.6191,1.6801,90,90,90 - black 10.55 X 42712
Ir-Mg Mg13Ir3 (Mg0.75 In0.25 )13Ir3,hR96,167 R-3c 1.607,1.607,0.84488,90,90,120 - - 4.71 X 44104
Ir-Mg Mg2.30 Ir2.70 V2(Co 0.57 Si0.43 )3,mS50,12 C12/m1 1.8582,0.52308,0.8551,90,97.645,90 Frank-Kasper phase - 11.59 X 43845
Ir-Mg Mg3Ir Cu3P,hP24,185 P63 cm 0.7927,0.7927,0.819,90,90,120 - - 5.93 X 27391
Ir-Mg Mg44Ir7 Mg44Rh7,cF408,216 F-43m 2.0097,2.0097,2.0097,90,90,90 - gray dark 3.96 X 6510
Ir-Mg Mg7Ir3 Ru3Sn7,cI40,229 Im-3m 0.9061,0.9061,0.9061,90,90,90 - - 6.67 A 41941
Ir-Mn MnIr rt CuAu,tP2,123 P4/mmm 0.2726,0.2726,0.3643,90,90,90 close-packed structure - 15.16 X 2508
Ir-Mn Mn0.4 Ir0.6 Cu,cF4,225 Fm-3m 0.3811,0.3811,0.3811,90,90,90 close-packed structure - 16.48 X 721
Ir-Mn Mn0.8 Ir0.2 ht Cu,cF4,225 Fm-3m 0.378,0.378,0.378,90,90,90 close-packed structure - 10.13 X 8407
Ir-Mn Mn0.9 Ir0.1 rt In,tI2,139 I4/mmm 0.26375,0.26375,0.379,90,90,90 close-packed structure - 8.65 X 8407
Ir-Mn Mn3Ir rt Cu3Au,cP4,221 Pm-3m 0.3772,0.3772,0.3772,90,90,90 close-packed structure - 11.05 X 8407
Ir-Mo MoIr rt AuCd,oP4,51 Pmma 0.4429,0.2752,0.4804,90,90,90 close-packed structure - 16.34 A 2443
Ir-Mo MoIr3 Mg3Cd,hP8,194 P63 /mmc 0.5487,0.5487,0.4385,90,90,120 close-packed structure - 19.54 A 2443
Ir-Mo Mo0.22 Ir0.78 Cu,cF4,225 Fm-3m 0.38555,0.38555,0.38555,90,90,90 close-packed structure - 19.82 X 2018
Ir-Mo Mo0.5Ir0.5 ht Mg,hP2,194 P63 /mmc 0.277,0.277,0.4424,90,90,120 close-packed structure - 16.28 X 2018
Ir-Mo Mo0.72 Ir0.28 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9631,0.9631,0.4957,90,90,90 Frank-Kasper phase - 13.32 X 2081
Ir-Mo Mo0.9Ir0.1 W,cI2,229 Im-3m 0.3141,0.3141,0.3141,90,90,90 b.c.c. family - 11.31 X 2018
Ir-Mo Mo3.06 Ir0.94 Cr3Si,cP8,223 Pm-3n 0.4967,0.4967,0.4967,90,90,90 Frank-Kasper phase - 12.85 X 22319
Ir-Nb NbIr3 Cu3Au,cP4,221 Pm-3m 0.389,0.389,0.389,90,90,90 close-packed structure - 18.89 X 2385
Ir-Nb Nb0.1 Ir0.9 Cu,cF4,225 Fm-3m 0.3862,0.3862,0.3862,90,90,90 close-packed structure - 21.02 X 2385
Ir-Nb Nb0.6 Ir0.4 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.986,0.986,0.505,90,90,90 Frank-Kasper phase - 13.46 X 2081
Ir-Nb Nb0.8 Ir1.2 TaIr,oP12,51 Pmma 1.3633,0.2817,0.4813,90,90,90 close-packed structure - 16.44 A 2385
Ir-Nb Nb0.93 Ir0.07 W,cI2,229 Im-3m 0.3273,0.3273,0.3273,90,90,90 b.c.c. family - 9.46 X 2385
Ir-Nb Nb0.95 Ir1.05 CuAu,tP2,123 P4/mmm 0.2851,0.2851,0.3861,90,90,90 close-packed structure - 15.35 X 2385
Ir-Nb Nb3Ir Cr3Si,cP8,223 Pm-3n 0.51333,0.51333,0.51333,90,90,90 Frank-Kasper phase - 11.56 X 3823
Ir-Nd NdIr2 MgCu2,cF24,227 Fd-3m 0.7602,0.7602,0.7602,90,90,90 Friauf-Laves phase - 15.99 X 23067
Ir-Nd NdIr3 cub Cu3Au,cP4,221 Pm-3m 0.3836,0.3836,0.3836,90,90,90 close-packed structure - 21.21 X 22361
Ir-Nd NdIr3 rhom PuNi3,hR36,166 R-3m 0.5328,0.5328,2.5998,90,90,120 Laves-CaCu5 - 16.86 A 23067
Ir-Nd NdIr5 CaCu5,hP6,191 P6/mmm 0.5324,0.5324,0.4332,90,90,120 - - 17.26 X 23067
Ir-Nd Nd2Ir7 Gd2Co7,hR54,166 R-3m 0.5298,0.5298,3.888,90,90,120 Laves-CaCu5 - 17.23 A 23067
Ir-Nd Nd3Ir Fe3C-b,oP16,62 Pnma 0.7315,0.9702,0.6447,90,90,90 - - 9.07 A 23067
Ir-Nd Nd5Ir2 Mn5C2,mS28,15 C12/c1 1.6409,0.6584,0.7305,90,96.6,90 - - 9.37 A 23067
Ir-Nd Nd5Ir3 ht Pu5Rh3,tP32,130 P4/ncc 1.1157,1.1157,0.6432,90,90,90 - - 10.77 X 12073
Ir-Ni Ir0.38 Ni0.62 Cu,cF4,225 Fm-3m 0.37755,0.37755,0.37755,90,90,90 close-packed structure - 13.51 X 56225
Ir-Np NpIr2 MgCu2,cF24,227 Fd-3m 0.7509,0.7509,0.7509,90,90,90 Friauf-Laves phase - 19.50 X 6793
Ir-O IrO2 TiO2,tP6,136 P42 /mnm 0.45051,0.45051,0.31586,90,90,90 - - 11.62 X 32857
Ir-Os Os0.25 Ir0.75 Cu,cF4,225 Fm-3m 0.3836,0.3836,0.3836,90,90,90 close-packed structure - 22.56 X 45263
Ir-Os Os0.65 Ir0.35 Mg,hP2,194 P63 /mmc 0.27361,0.27361,0.43417,90,90,120 close-packed structure - 22.52 X 3585
Ir-P IrP 2 CoSb2,mP12,14 P121/c1 0.57453,0.57915,0.58494,90,111.575,90 pyrite-marcasite family - 9.33 X 5748
Ir-P IrP 3 CoAs3,cI32,204 Im-3 0.80151,0.80151,0.80151,90,90,90 - - 7.36 X 4481
Ir-P Ir2P CaF2,cF12,225 Fm-3m 0.5543,0.5543,0.5543,90,90,90 fluorite family - 16.20 X 1279
Ir-Pa PaIr3 Cu3Au,cP4,221 Pm-3m 0.4047,0.4047,0.4047,90,90,90 close-packed structure - 20.24 X 9952
Ir-Pb IrPb NiAs,hP4,194 P63 /mmc 0.3993,0.3993,0.5566,90,90,120 AlB2 family - 17.26 X 357
Ir-Pd Ir0.40Pd0.60 Cu,cF4,225 Fm-3m 0.3862,0.3862,0.3862,90,90,90 close-packed structure - 16.23 X 56973
Ir-Pr PrIr2 MgCu2,cF24,227 Fd-3m 0.7621,0.7621,0.7621,90,90,90 Friauf-Laves phase - 15.77 X 17389
Ir-Pr PrIr3 PuNi3,hR36,166 R-3m 0.53325,0.53325,2.628,90,90,120 Laves-CaCu5 - 16.57 A 48336
Ir-Pr Pr3Ir Fe3C-b,oP16,62 Pnma 0.7329,0.9844,0.6518,90,90,90 - - 8.69 A 12087
Ir-Pr Pr5Ir2 Mn5C2,mS28,15 C12/c1 1.6538,0.661,0.7329,90,96.67,90 - - 9.09 A 13333
Ir-Pr Pr5Ir3 Pu5Rh3,tP32,130 P4/ncc 1.1276,1.1276,0.6499,90,90,90 - - 10.30 A 12073
Ir-Pr Pr7Ir3 Th7Fe3,hP20,186 P63 mc 1.0043,1.0043,0.6312,90,90,120 - - 9.42 A 7500
Ir-Pt Ir0.5Pt0.5 Cu,cF4,225 Fm-3m 0.3894,0.3894,0.3894,90,90,90 close-packed structure - 21.79 X 52525
Ir-Pu PuIr2 MgCu2,cF24,227 Fd-3m 0.7518,0.7518,0.7518,90,90,90 Friauf-Laves phase - 19.65 X 7597
Ir-Pu Pu5Ir3 W5Si3,tI32,140 I4/mcm 1.1015,1.1015,0.5621,90,90,90 - - 17.50 X 10391
Ir-Pu Pu5Ir4 Sm5Ge4,oP36,62 Pnma 0.7245,1.46,0.7455,90,90,90 - - 16.75 X 9492
Ir-Re Re0.3 Ir0.7 Cu,cF4,225 Fm-3m 0.3846,0.3846,0.3846,90,90,90 close-packed structure - 22.23 X 45269
Ir-Re Re0.6 Ir0.4 Mg,hP2,194 P63 /mmc 0.27545,0.27545,0.43739,90,90,120 close-packed structure - 21.80 X 3585
Ir-Rh Ir0.5 Rh0.5 Cu,cF4,225 Fm-3m 0.3825,0.3825,0.3825,90,90,90 close-packed structure - 17.51 X 40587
Ir-Ru Ru0.4 Ir0.6 Cu,cF4,225 Fm-3m 0.382,0.382,0.382,90,90,90 close-packed structure - 18.56 X 49432
Handbook of Inorganic Substances – Edition 2015 : Data 117

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ir-Ru Ru0.67 Ir0.33 Mg,hP2,194 P63/mmc 0.2716,0.2716,0.4312,90,90,120 close-packed structure - 15.81 X 49432
Ir-S IrS1.9 FeS2 ,cP12,205 Pa-3 0.568,0.568,0.568,90,90,90 pyrite-marcasite family - 9.18 A 4034
Ir-S IrS2 IrSe 2,oP24,62 Pnma 1.9791,0.35673,0.56242,90,90,90 pyrite-marcasite family - 8.58 X 23798
Ir-S Ir2S3 Rh2S3,oP20,60 Pbcn 0.85,0.602,0.617,90,90,90 - - 10.11 A 21741
Ir-S Ir3S8 Rh3Se8,hR33,148 R-3 0.79277,0.79277,0.96587,90,90,120 - - 7.90 A 4946
Ir-Sb IrSb NiAs,hP4,194 P63/mmc 0.3978,0.3978,0.5521,90,90,120 AlB2 family - 13.78 X 991
Ir-Sb IrSb2 CoSb2,mP12,14 P121/c1 0.65945,0.65492,0.66951,90,115.158,90 pyrite-marcasite family - 11.06 X 5748
Ir-Sb IrSb3 CoAs3,cI32,204 Im-3 0.91491,0.91491,0.91491,90,90,90 - gray dark 9.67 X 37071
Ir-Sc ScIr CsCl,cP2,221 Pm-3m 0.3206,0.3206,0.3206,90,90,90 b.c.c. family - 11.95 X 28754
Ir-Sc ScIr2 MgCu2,cF24,227 Fd-3m 0.735,0.735,0.735,90,90,90 Friauf-Laves phase - 14.37 X 28754
Ir-Sc ScIr3 Cu3Au,cP4,221 Pm-3m 0.39,0.39,0.39,90,90,90 close-packed structure - 17.40 X 28754
Ir-Sc Sc11 Ir4 Sc11 Ir4,cF120,225 Fm-3m 1.335,1.335,1.335,90,90,90 - - 7.05 X 13083
Ir-Sc Sc2Ir Ti2Ni,cF96,227 Fd-3m 1.229,1.229,1.229,90,90,90 - - 8.08 A 28754
Ir-Sc Sc44 Ir7 Mg44 Rh7,cF408,216 F-43m 2.075,2.075,2.075,90,90,90 - - 4.94 A 28754
Ir-Sc Sc57 Ir13 Sc57 Rh13,cP140,200 Pm-3 1.435,1.435,1.435,90,90,90 - - 5.69 A 28754
Ir-Se IrSe 2 IrSe 2,oP24,62 Pnma 2.0955,0.37429,0.59381,90,90,90 pyrite-marcasite family - 9.99 X 23798
Ir-Se IrSe 3 IrSe 3,aP32,2 P-1 0.8405,0.8405,1.0236,90,90,120 - - 9.10 X 4946
Ir-Se Ir0.58 Se1.68 Ir0.58 Se1.68 ,hR36,148 R-3 0.83636,0.83636,1.02101,90,90,120 pyrite-marcasite family black 7.87 X 20546
Ir-Si IrSi ht FeAs,oP8,62 Pnma 0.5558,0.3211,0.6273,90,90,90 AlB2 family - 13.07 X 889
Ir-Si IrSi2 CaF2 ,cF12,225 Fm-3m 0.567,0.567,0.567,90,90,90 fluorite family - 9.05 X 53185
Ir-Si IrSi3 ht IrSi3 ,hP8,186 P63mc 0.4351,0.4351,0.6622,90,90,120 - - 8.46 X 5928
Ir-Si IrSi3 rt *,mS*,* - 0.65467,0.4377,0.76976,90,91.594,90 - - - N 14837
Ir-Si Ir1.4 Si ht Co1.75 Ge,hP6,194 P63/mmc 0.3963,0.3963,0.5126,90,90,120 AlB2 family - 14.16 X 1679
Ir-Si Ir2Si Co2Si-b,oP12,62 Pnma 0.5284,0.3989,0.7615,90,90,90 - - 17.07 A 1335
Ir-Si Ir3Si Ir3Si,tI16,140 I4/mcm 0.5232,0.5232,0.7973,90,90,90 - - 18.41 A 13355
Ir-Si Ir3Si4 rt Rh3Si4,oP28,62 Pnma 1.88741,0.36979,0.57717,90,90,90 - - 11.36 X 5047
Ir-Si Ir3Si5 rt Ir3Si5,mP64,14 P121/c1 0.64060,1.4162,1.1553,90,116.69,90 - - 10.17 X 19807
Ir-Si Ir4Si5 rt Rh4Si5,mP18,11 P121/m1 0.58805,0.36181,1.2359,90,100.14,90 - - 11.67 A 5047
Ir-Sm SmIr3 PuNi3,hR36,166 R-3m 0.53007,0.53007,2.597,90,90,120 Laves-CaCu5 - 17.20 A 48336
Ir-Sm Sm3 Ir Fe3C-b,oP16,62 Pnma 0.7273,0.9584,0.6397,90,90,90 - - 9.58 X 12087
Ir-Sm Sm5 Ir2 Mn5 C2,mS28,15 C12/c1 1.6144,0.6522,0.7264,90,96.7,90 - - 9.94 A 13333
Ir-Sm Sm5 Ir3 Pu5Rh3,tP32,130 P4/ncc 1.1035,1.1035,0.6372,90,90,90 - - 11.37 A 12073
Ir-Sn IrSn NiAs,hP4,194 P63/mmc 0.398,0.398,0.563,90,90,120 AlB2 family - 13.37 X 11633
Ir-Sn IrSn2 CaF2 ,cF12,225 Fm-3m 0.6338,0.6338,0.6338,90,90,90 fluorite family - 11.21 X 275
Ir-Sn IrSn4 hp-ht AuSn4,oS20,41 Aea2 0.6274,0.6337,1.1352,90,90,90 - - 9.82 A 17144
Ir-Sn IrSn4 ht IrSn4,tI40,142 I41/acd 0.63096,0.63096,2.277,90,90,90 - - 9.77 X 40568
Ir-Sn IrSn4 rt IrGe 4,hP15,152 P3121 0.6791,0.6791,0.8575,90,90,120 - - 9.70 X 31877
Ir-Sn Ir0.985 Sn0.015 Cu,cF4,225 Fm-3m 0.384,0.384,0.384,90,90,90 close-packed structure - 22.42 X 33133
Ir-Sn Ir3Sn7 Ru3Sn7,cI40,229 Im-3m 0.93529,0.93529,0.93529,90,90,90 - - 11.43 X 41941
Ir-Sn Ir5Sn7 Co5Ge7,tI24,107 I4mm 0.8536,0.8536,0.6465,90,90,90 - gray silver 12.63 X 37396
Ir-Sr SrIr2 MgCu2,cF24,227 Fd-3m 0.77,0.77,0.77,90,90,90 Friauf-Laves phase - 13.74 X 938
Ir-Ta TaIr TaIr,oP12,51 Pmma 1.3661,0.2830,0.4803,90,90,90 close-packed structure gray 20.02 X 2019
Ir-Ta TaIr3 Cu3Au,cP4,221 Pm-3m 0.3886,0.3886,0.3886,90,90,90 close-packed structure - 21.44 X 2019
Ir-Ta Ta0.1 Ir0.9 Cu,cF4,225 Fm-3m 0.3857,0.3857,0.3857,90,90,90 close-packed structure - 22.12 X 2019
Ir-Ta Ta0.75 Ir0.25 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9928,0.9928,0.5159,90,90,90 Frank-Kasper phase - 18.00 A 2019
Ir-Ta Ta0.82 Ir1.18 rt CuAu,tP2,123 P4/mmm 0.282,0.282,0.3859,90,90,90 close-packed structure - 20.30 X 2019
Ir-Tb TbIr2 MgCu2,cF24,227 Fd-3m 0.7532,0.7532,0.7532,90,90,90 Friauf-Laves phase - 16.89 X 2437
Ir-Tb Tb3Ir Fe3C-b,oP16,62 Pnma 0.7217,0.9318,0.6361,90,90,90 - - 10.39 A 12087
Ir-Tb Tb3Ir2 Y3Rh2,tI140,140 I4/mcm 1.1206,1.1206,2.504,90,90,90 - - 12.74 A 13352
Ir-Tb Tb5Ir2 Mn5 C2,mS28,15 C12/c1 1.5749,0.6462,0.7208,90,96.73,90 - - 10.75 A 13333
Ir-Tb Tb5Ir3 ht Mn5 Si3,hP16,193 P63/mcm 0.8211,0.8211,0.6361,90,90,120 - - 12.26 A 15271
Ir-Tb Tb5Ir3 rt Pu5Rh3,tP32,130 P4/ncc 1.0905,1.0905,0.6299,90,90,90 - - 12.16 A 13352
Ir-Tc Tc0.5 Ir0.5 Mg,hP2,194 P63/mmc 0.274,0.274,0.4348,90,90,120 close-packed structure - 17.05 X 1920
Ir-Te IrTe 2 hp IrTe 2,mS18,12 C12/m1 1.9975,0.40016,0.53119,90,90.818,90 - - 10.50 X 37213
Ir-Te IrTe 2 trig CdI2 ,hP3,164 P-3m1 0.39284,0.39284,0.5404,90,90,120 shuangfengite - 10.29 X 25534
Ir-Te Ir0.62 Te1.68 Ir0.58 Se1.68 ,hR36,148 R-3 0.90669,0.90669,1.11047,90,90,120 pyrite-marcasite family black 8.41 X 25125
Ir-Th ThIr TlI,oS8,63 Cmcm 0.3894,1.113,0.4266,90,90,90 CrB(TlI)-FeB - 15.24 A 2229
Ir-Th ThIr2 MgCu2,cF24,227 Fd-3m 0.7661,0.7661,0.7661,90,90,90 Friauf-Laves phase - 18.21 X 2229
Ir-Th ThIr5 CaCu5,hP6,191 P6/mmm 0.5335,0.5335,0.4286,90,90,120 - - 18.75 X 2229
Ir-Th Th0.99 Ir0.01 rt Cu,cF4,225 Fm-3m 0.50873,0.50873,0.50873,90,90,90 close-packed structure - 11.69 X 2229
Ir-Th Th7Ir3 Th7Fe3,hP20,186 P63mc 1.0076,1.0076,0.6296,90,90,120 - - 13.20 A 2229
Ir-Ti TiIr lt *,oS*,* - 0.41017,0.34712,0.41628,90,90,90 - - - N 23514
Ir-Ti TiIr rt CuAu,tP2,123 P4/mmm 0.2925,0.2925,0.3446,90,90,90 close-packed structure - 13.52 X 4878
Ir-Ti TiIr3 Cu3Au,cP4,221 Pm-3m 0.3858,0.3858,0.3858,90,90,90 close-packed structure - 18.06 X 2431
Ir-Ti Ti0.6 Ir1.4 CuAu,tP2,123 P4/mmm 0.276,0.276,0.378,90,90,90 close-packed structure - 17.18 X 2431
Ir-Ti Ti1.2 Ir0.8 CsCl,cP2,221 Pm-3m 0.3106,0.3106,0.3106,90,90,90 b.c.c. family - 11.71 X 3251
Ir-Ti Ti3Ir Cr3Si,cP8,223 Pm-3n 0.50118,0.50118,0.50118,90,90,90 Frank-Kasper phase - 8.86 X 33704
Ir-Tm TmIr CsCl,cP2,221 Pm-3m 0.3353,0.3353,0.3353,90,90,90 b.c.c. family - 15.91 X 2469
Ir-Tm TmIr2 MgCu2,cF24,227 Fd-3m 0.74736,0.74736,0.74736,90,90,90 Friauf-Laves phase - 17.61 X 18159
Ir-Tm Tm3 Ir Fe3C-b,oP16,62 Pnma 0.7133,0.899,0.6285,90,90,90 - - 11.52 A 12087
Ir-Tm Tm5 Ir2 Mn5 C2,mS28,15 C12/c1 1.5263,0.6345,0.7141,90,97.01,90 - - 11.89 A 13333
Ir-Tm Tm5 Ir3 ht Mn5 Si3,hP16,193 P63/mcm 0.8094,0.8094,0.6248,90,90,120 - - 13.32 A 15271
Ir-Tm Tm5 Ir3 rt Pu5Rh3,tP32,130 P4/ncc 1.0721,1.0721,0.6189,90,90,90 - - 13.27 A 13352
Ir-U UIr PdBi,mP16,4 P1211 0.562,1.059,0.5598,90,98.93,90 CrB(TlI)-FeB - 17.37 X 20274
Ir-U UIr2 MgCu2,cF24,227 Fd-3m 0.74954,0.74954,0.74954,90,90,90 Friauf-Laves phase - 19.64 X 19436
Ir-U UIr3 Cu3Au,cP4,221 Pm-3m 0.40221,0.40221,0.40221,90,90,90 close-packed structure - 20.79 X 3634
Ir-U U2Ir rt *,mP12,* - 0.5095,0.3457,1.321,90,96.57,90 - - - N 2820
Ir-V VIr rt VIr,oS8,65 Cmmm 0.5797,0.6762,0.2805,90,90,90 b.c.c. family - 14.69 X 23527
118 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ir-V VIr3 Cu3Au,cP4,221 Pm-3m 0.38124,0.38124,0.38124,90,90,90 close-packed structure - 18.81 X 3599


Ir-V V0.16 Ir0.84 Cu,cF4,225 Fm-3m 0.3824,0.3824,0.3824,90,90,90 close-packed structure - 20.15 X 3599
Ir-V V0.8 Ir0.2 W,cI2,229 Im-3m 0.301,0.301,0.301,90,90,90 b.c.c. family - 9.65 X 3599
Ir-V V1.08 Ir0.92 ht CuAu,tP2,123 P4/mmm 0.277,0.277,0.3651,90,90,90 close-packed structure - 13.74 X 23527
Ir-V V3Ir Cr3Si,cP8,223 Pm-3n 0.47876,0.47876,0.47876,90,90,90 Frank-Kasper phase - 10.44 X 3823
Ir-W WIr rt AuCd,oP4,51 Pmma 0.4452,0.276,0.4811,90,90,90 close-packed structure - 21.13 A 2443
Ir-W WIr3 rt Mg3Cd,hP8,194 P63 /mmc 0.5496,0.5496,0.439,90,90,120 close-packed structure - 21.99 A 3134
Ir-W W0.2 Ir0.8 Cu,cF4,225 Fm-3m 0.3843,0.3843,0.3843,90,90,90 close-packed structure - 22.30 X 1989
Ir-W W0.5 Ir0.5 Mg,hP2,194 P63 /mmc 0.2774,0.2774,0.4468,90,90,120 close-packed structure - 20.97 X 985
Ir-W W0.72 Ir0.28 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.967,0.967,0.5,90,90,90 Frank-Kasper phase - 19.84 A 1439
Ir-W W0.99 Ir0.01 W,cI2,229 Im-3m 0.317,0.317,0.317,90,90,90 b.c.c. family - 19.18 X 1989
Ir-Y YIr CsCl,cP2,221 Pm-3m 0.34,0.34,0.34,90,90,90 b.c.c. family - 11.88 X 23067
Ir-Y YIr2 MgCu2,cF24,227 Fd-3m 0.7512,0.7512,0.7512,90,90,90 Friauf-Laves phase - 14.83 X 19183
Ir-Y YIr3 PuNi3,hR36,166 R-3m 0.5279,0.5279,2.5878,90,90,120 Laves-CaCu5 - 15.93 A 23067
Ir-Y Y3Ir Fe3C-b,oP16,62 Pnma 0.7237,0.927,0.6329,90,90,90 - - 7.18 A 23067
Ir-Y Y3Ir2 Y3Rh2,tI140,140 I4/mcm 1.1232,1.1232,2.5158,90,90,90 - - 9.54 A 23067
Ir-Y Y5Ir2 Mn5C2,mS28,15 C12/c1 1.5691,0.6474,0.724,90,96.7,90 - - 7.54 A 23067
Ir-Y Y5Ir3 ht Mn5Si3,hP16,193 P63 /mcm 0.8168,0.8168,0.6407,90,90,120 - - 9.16 A 23067
Ir-Y Y5Ir3 rt Pu5Rh3,tP32,130 P4/ncc 1.0895,1.0895,0.6325,90,90,90 - - 9.03 A 23067
Ir-Y Y64Ir37 *,tP202,126 P4/nnc 1.088,1.088,4.018,90,90,90 - - - N 11154
Ir-Yb YbIr CsCl,cP2,221 Pm-3m 0.3346,0.3346,0.3346,90,90,90 b.c.c. family - 16.19 X 10149
Ir-Yb YbIr2 MgCu2,cF24,227 Fd-3m 0.74638,0.74638,0.74638,90,90,90 Friauf-Laves phase - 17.81 X 18159
Ir-Yb Yb5Ir3 ht Mn5Si3,hP16,193 P63 /mcm 0.8048,0.8048,0.6194,90,90,120 - - 13.78 A 15243
Ir-Yb Yb5Ir3 rt Pu5Rh3,tP32,130 P4/ncc 1.0678,1.0678,0.6157,90,90,90 - - 13.64 A 15243
Ir-Zn ZnIr rt LiRh,hP2,187 P-6m2 0.2761,0.2761,0.4222,90,90,120 close-packed structure - 15.35 X 47725
Ir-Zn Zn11Ir2 Cu5Zn8,cI52,217 I-43m 0.91075,0.91075,0.91075,90,90,90 γ-brass - 9.70 X 6521
Ir-Zn Zn90.6 Ir11.1 ht Zn90.6 Ir11.1 ,cF452,216 F-43m 1.8224,1.8224,1.8224,90,90,90 - gray silver 8.84 X 42773
Ir-Zr ZrIr ht CsCl,cP2,221 Pm-3m 0.3318,0.3318,0.3318,90,90,90 b.c.c. family - 12.89 X 13683
Ir-Zr ZrIr rt ZrIr,oS16,63 Cmcm 0.33686,1.9608,0.43982,90,90,90 - - 12.96 X 52482
Ir-Zr ZrIr2 MgCu2,cF24,227 Fd-3m 0.738,0.738,0.738,90,90,90 Friauf-Laves phase - 15.72 X 13683
Ir-Zr ZrIr3 Cu3Au,cP4,221 Pm-3m 0.394,0.394,0.394,90,90,90 close-packed structure - 18.13 X 13683
Ir-Zr Zr2Ir stab Ti2Ni,cF96,227 Fd-3m 1.247,1.247,1.247,90,90,90 - - 10.27 A 1019
Ir-Zr Zr2Ir CuAl2,tI12,140 I4/mcm 0.651,0.651,0.562,90,90,90 - - 10.45 A 13683
Ir-Zr Zr3Ir V3S,tI32,121 I-42m 1.0788,1.0788,0.5602,90,90,90 - - 9.49 X 17826
Ir-Zr Zr5Ir3 Ir+ Mn5Si3,hP16,193 P63 /mcm 0.802,0.802,0.55,90,90,120 - - 11.20 A 13683
Ir-Zr Zr5Ir3 Zr5Ir3,hP48,178 P6122 0.79306,0.79306,1.7010,90,90,120 - - 11.11 X 18771
K-N K[N3] K[N3],tI16,140 I4/mcm 0.61188,0.61188,0.71015,90,90,90 - - 2.03 X 10318
K-N K3N Cs3O,hP8,193 P63 /mcm 0.7798,0.7798,0.7592,90,90,120 - - 1.09 X 43940
K-Na KNa2 lt MgZn2,hP12,194 P63 /mmc 0.748,0.748,1.227,90,90,120 Friauf-Laves phase - 0.95 A 224
K-O K[O2] ht NaCl,cF8,225 Fm-3m 0.609,0.609,0.609,90,90,90 rocksalt family - 2.09 X 432
K-O K[O2] lt2 K[O2],mS12,15 C12/c1 0.788,0.4036,0.75806,90,117.991,90 - - 2.22 X 8997
K-O K[O2] rt CaC2,tI6,139 I4/mmm 0.4033,0.4033,0.6699,90,90,90 - - 2.17 X 663
K-O K[O3] m K[O3],tI32,140 I4/mcm 0.86358,0.86358,0.71406,90,90,90 - red dark 2.17 X 20693
K-O K2O ht1 *,cP72,* - 1.2125,1.2125,1.2125,90,90,90 - - - N 5189
K-O K2O ht2 *,h**,* - 1.7768,1.7768,2.1235,90,90,120 - - - N 16548
K-O K2O rt CaF2,cF12,225 Fm-3m 0.6436,0.6436,0.6436,90,90,90 fluorite family - 2.35 X 5189
K-O K2[O2] K2[O2],oS16,64 Cmce 0.6733,0.6996,0.6474,90,90,90 - colorless 2.40 X 26803
K-P KP NaP,oP16,19 P212121 0.6016,0.65,1.1288,90,90,90 - black 2.11 A 12818
K-P KP 15 KP 15,aP32,2 P-1 0.71568,0.91528,1.19446,89.628,78.54,71.853 - red ruby 2.30 X 3430
K-P K2P3 ht K2P3,oF80,70 Fddd 0.8305,1.4772,1.8650,90,90,90 - black 1.99 X 17642
K-P K2P3 rt Rb2P 3,oF40,69 Fmmm 0.8624,0.9347,1.4253,90,90,90 - black 1.98 X 17642
K-P K3P Na3As,hP8,194 P63 /mmc 0.5691,0.5691,1.005,90,90,120 - green 1.75 X 1546
K-P K3P11 ht *,cP*,221 Pm-3m 0.9282,0.9282,0.9282,90,90,90 - red - N 25545
K-P K3P11 rt Na3P 11,oP56,60 Pbcn 1.045,1.394,1.0315,90,90,90 - orange red 2.02 X 25545
K-P K4P3 K4P3,oS28,63 Cmcm 0.5049,1.1197,1.4788,90,90,90 - black blue 1.98 X 22148
K-Pb KPb NaPb,tI64,142 I41/acd 1.1532,1.1532,1.8868,90,90,90 - black gray 5.22 X 31276
K-Pb KPb0.83 DyAl,oP16,57 Pbcm 0.672,1.3389,0.652,90,90,90 - gray 4.78 X 36754
K-Pb KPb2 MgZn2,hP12,194 P63 /mmc 0.666,0.666,1.076,90,90,120 Friauf-Laves phase - 7.29 X 814
K-Pb K4Pb9 K4Pb9,mP52,11 P121/m1 0.9648,1.3243,1.5909,90,103.24,90 - gray dark 6.79 X 34327
K-Pb K5Pb24 Ti5Re24,cI58,217 I-43m 1.2358,1.2358,1.2358,90,90,90 - gray silver 9.09 X 36578
K-Pt K0.4Pt *,hR*,* - 0.26462,0.26462,1.7123,90,90,120 - gray - N 47678
K-S KS2 *,aP42,* - 0.688,1.3284,1.3837,65.5,89.88,87.77 - - - N 8896
K-S KS3 *,aP56,* - 0.793,1.37463,1.4266,115.68,99.22,91.697 - - - N 8896
K-S K2S hp K2S,oP12,51 Pmma 0.6529,0.5094,0.8772,90,90,90 - white 2.51 X 40749
K-S K2S CaF2,cF12,225 Fm-3m 0.74048,0.74048,0.74048,90,90,90 fluorite family white 1.80 X 40749
K-S K2S2 Na2[O2],hP12,189 P-62m 0.8494,0.8494,0.5836,90,90,120 - yellow 1.94 X 28184
K-S K2S3 K2S3,oS20,36 Cmc21 0.7309,0.9914,0.7473,90,90,90 - orange red 2.14 X 11043
K-S K2S5 Tl2S5,oP28,19 P212121 0.6494,0.66,1.7414,90,90,90 - orange red 2.12 X 9887
K-Sb KSb LiAs,mP16,14 P121/c1 0.7156,0.6917,1.3355,90,115.17,90 - gray 3.57 X 14750
K-Sb KSb2 KSb2,mS12,12 C12/m1 1.4055,0.4233,0.7053,90,95.02,90 - black 4.49 X 30106
K-Sb K3Sb ht BiF3,cF16,225 Fm-3m 0.8493,0.8493,0.8493,90,90,90 b.c.c. family - 2.59 X 3129
K-Sb K3Sb rt Na3As,hP8,194 P63 /mmc 0.6025,0.6025,1.0693,90,90,120 - - 2.36 X 145
K-Sb K5Sb4 Rb5As4,mS20,12 C12/m1 1.2319,0.54866,1.1258,90,112.27,90 - black 3.22 X 38697
K-Se K2Se CaF2,cF12,225 Fm-3m 0.7676,0.7676,0.7676,90,90,90 fluorite family - 2.31 X 75
K-Se K2Se2 Na2[O2],hP12,189 P-62m 0.8908,0.8908,0.6039,90,90,120 - black 2.83 X 28184
K-Se K2Se3 K2S3,oS20,36 Cmc21 0.7692,1.041,0.7717,90,90,90 - black 3.39 X 11043
K-Se K2Se5 Tl2S5,oP28,19 P212121 0.6715,0.6949,1.7764,90,90,90 - black 3.79 X 26963
K-Se K4.75 Se2.82 rt K4.75 Se2.85 ,mS32,12 C12/m1 1.8289,0.5861,1.2973,90,134.75,90 - red dark 2.75 X 25616
Handbook of Inorganic Substances – Edition 2015 : Data 119

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

K-Se K5Se 3 ht K5Te3,tI32,87 I4/m 1.3159,1.3159,0.5909,90,90,90 - black 2.81 A 25616


K-Si KSi hp NaPb,tI64,142 I41/acd 1.057,1.057,1.71,90,90,90 - - 1.87 A 16888
K-Si KSi KGe,cP64,218 P-43n 1.262,1.262,1.262,90,90,90 - black 1.78 X 45829
K-Si KSi6 *,c**,* - 1.34,1.34,1.34,90,90,90 - - - N 1553
K-Si K12Si17 Rb12 Si17,mP464,14 P121/c1 2.3689,1.3572,4.4509,90,91.248,90 - gray dark 1.76 X 41732
K-Si K2.23 Si17 Na1.5 Si17,cF160,227 Fd-3m 1.47264,1.47264,1.47264,90,90,90 clathrate blue 2.35 X 55896
K-Si K3.75 Si23 rt Na4Si23,cP54,223 Pm-3n 1.02639,1.02639,1.02639,90,90,90 clathrate bluish 2.43 X 55896
K-Sn KSn NaPb,tI64,142 I41/acd 1.1409,1.1409,1.8649,90,90,90 - black gray 3.45 X 36761
K-Sn K12Sn17 hex *,hP*,* - 1.411,1.411,2.315,90,90,120 - - - N 36811
K-Sn K12Sn17 mon1 Rb12 Si17,mP464,14 P121/c1 2.571,1.477,4.819,90,91.64,90 - - 3.61 A 34392
K-Sn K12Sn17 mon2 *,mS*,* - 3.6456,2.6075,4.4805,90,102.5,90 - gray dark - N 41732
K-Sn K26Sn41 Cs26 Sn41,mP560,14 P121/c1 2.5618,1.4792,5.5653,90,98.923,90 - - 3.75 A 42358
K-Sn K4Sn23 Na4Si23,cP54,223 Pm-3n 1.203,1.203,1.203,90,90,90 clathrate - 5.51 X 4929
K-Sn K4Sn9 K4Sn9,mP52,14 P121/c1 1.4238,0.83554,1.6487,90,95.261,90 - gray silver 4.16 X 39758
K-Sn K7.4 Sn25 K8Sn25,cP136,213 P4132 1.6294,1.6294,1.6294,90,90,90 clathrate black 5.00 X 28690
K-Te K2Te CaF2 ,cF12,225 Fm-3m 0.8152,0.8152,0.8152,90,90,90 fluorite family - 2.52 X 75
K-Te K2Te 2 ht Li2[O2]-b,hP8,194 P63/mmc 0.5589,0.5589,1.2188,90,90,120 - black 3.36 X 28184
K-Te K2Te 2 rt Na2[O2],hP12,189 P-62m 0.9514,0.9514,0.65,90,90,120 - purple 3.26 X 28184
K-Te K2Te 3 K2Te3,oP20,62 Pnma 1.5938,1.0097,0.4686,90,90,90 - gray 4.06 X 11378
K-Te K5Te 3 K5Te3,tI32,87 I4/m 1.3742,1.3742,0.6364,90,90,90 - black 3.20 X 24319
K-Tl KTl hp NaTl,cF16,227 Fd-3m 0.756,0.756,0.756,90,90,90 b.c.c. family - 7.49 X 37234
K-Tl KTl KTl,oS48,64 Cmce 1.5329,1.5069,0.8137,90,90,90 - black 5.16 X 27361
K-Tl K10Tl7 K10Tl7,mP68,14 P121/c1 1.0132,2.2323,1.3376,90,93.14,90 - gray 4.01 X 37239
K-Tl K49Tl108 K49Tl108,cP157,200 Pm-3 1.7287,1.7287,1.7287,90,90,90 - gray 7.71 X 28221
K-Tl K6Tl17 K6Tl17,oS184,66 Cccm 1.6625,2.3594,1.5369,90,90,90 - gray silver 8.17 X 41515
K-Tl K8Tl11 K8In11,hR114,167 R-3c 0.9991,0.9991,5.084,90,90,120 - - 5.81 X 26884
K-Zn KZn13 NaZn13,cF112,226 Fm-3c 1.2379,1.2379,1.2379,90,90,90 - - 6.23 X 46673
Kr-Xe Xe0.5 Kr0.5 Cu,cF4,225 Fm-3m 0.6048,0.6048,0.6048,90,90,90 close-packed structure - 3.23 X 6948
La-Mg MgLa CsCl,cP2,221 Pm-3m 0.397,0.397,0.397,90,90,90 b.c.c. family gray silver 4.33 X 59023
La-Mg Mg0.2 La0.8 ht2 W,cI2,229 Im-3m 0.413,0.413,0.413,90,90,90 b.c.c. family - 5.47 X 22687
La-Mg Mg0.9997 La0.0003 Mg,hP2,194 P63/mmc 0.32095,0.32095,0.52114,90,90,120 close-packed structure - 1.74 X 25380
La-Mg Mg11.82 La1.09 Mg11.82 La1.09 ,oI346,71 Immm 1.03391,1.03554,7.7484,90,90,90 - brown 2.28 X 53644
La-Mg Mg12 La rt *,oI338,* - 1.01,1.09,7.74,90,90,90 - - 2.18 N 51926
La-Mg Mg17 La2 Th2Ni17,hP38,194 P63/mmc 1.036,1.036,1.024,90,90,120 CaCu5-Zr4Al3 brown 2.41 X 2009
La-Mg Mg17.35 La1.82 Ag0.3 (Ag0.46 Al0.54)17Dy1.7 ,hP42,194 P63/mmc 1.0387,1.0387,1.0263,90,90,120 - - 2.34 X 56232
La-Mg Mg2 La ht MgCu2,cF24,227 Fd-3m 0.881,0.881,0.881,90,90,90 Friauf-Laves phase colorless 3.64 X 44246
La-Mg Mg3 La BiF3 ,cF16,225 Fm-3m 0.74819,0.74819,0.74819,90,90,90 b.c.c. family - 3.36 X 58197
La-Mg Mg41 La5 ht Mg41 Ce5,tI92,87 I4/m 1.4822,1.4822,1.0468,90,90,90 - - 2.44 A 30759
La-N LaN hp BaO,tP4,129 P4/nmm 0.41875,0.41875,0.31579,90,90,90 b.c.c. family - 9.17 X 58572
La-N LaN NaCl,cF8,225 Fm-3m 0.52912,0.52912,0.52912,90,90,90 rocksalt family white 6.86 X 58572
La-N La[N2] La[N2],hP18,157 P31m 0.6494,0.6494,0.7974,90,90,120 - brown light 5.71 X 59619
La-Ni LaNi TlI,oS8,63 Cmcm 0.39,1.079,0.438,90,90,90 CrB(TlI)-FeB - 7.12 A 19186
La-Ni LaNi2 MgCu2,cF24,227 Fd-3m 0.734,0.734,0.734,90,90,90 Friauf-Laves phase - 8.61 X 20194
La-Ni LaNi3 PuNi3,hR36,166 R-3m 0.50817,0.50817,2.5092,90,90,120 Laves-CaCu5 - 8.39 X 48692
La-Ni LaNi5 CaCu5,hP6,191 P6/mmm 0.50033,0.50033,0.3982,90,90,120 - - 8.32 X 34386
La-Ni La0.94 Ni5.12 Cu5.36 Yb0.82 ,hP14,191 P6/mmm 0.49933,0.49933,0.39998,90,90,120 CaCu5-Zr4Al3 - 8.29 X 40497
La-Ni La2Ni3 La2Ni3,oS20,64 Cmce 0.51138,0.97316,0.79075,90,90,90 - - 7.66 X 9909
La-Ni La2Ni7 ht Gd2Co 7,hR54,166 R-3m 0.5056,0.5056,3.698,90,90,120 Laves-CaCu5 - 8.38 A 4708
La-Ni La2Ni7 rt Ce2Ni7,hP36,194 P63/mmc 0.50577,0.50577,2.47336,90,90,120 Laves-CaCu5 - 8.35 X 43682
La-Ni La3Ni Fe3C-b,oP16,62 Pnma 0.7232,1.0236,0.6599,90,90,90 - - 6.46 A 50356
La-Ni La5Ni19 Sm5 Co19,hP48,194 P63/mmc 0.50491,0.50491,3.2642,90,90,120 Laves-CaCu5 - 8.34 X 52162
La-Ni La7Ni16 rt La7Ni16,tI46,121 I-42m 0.7355,0.7355,1.451,90,90,90 - - 8.09 X 21364
La-Ni La7Ni3 Th7Fe3,hP20,186 P63mc 1.014,1.014,0.6475,90,90,120 - - 6.62 X 11617
La-O LaO hp NaCl,cF8,225 Fm-3m 0.5144,0.5144,0.5144,90,90,90 rocksalt family golden 7.56 X 14372
La-O LaO1.5 ht3 NdO1.5 ,cI26,229 Im-3m 0.451,0.451,0.451,90,90,90 - - 5.90 A 3998
La-O La2O3 (Ni) Sm2 O3,mS30,12 C12/m1 1.46,0.3717,0.9275,90,99.77,90 - - 6.54 A 3972
La-O La2O3 cub (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.1414,1.1414,1.1414,90,90,90 - - 5.82 X 36194
La-O La2O3 ht1 La2O3,hP10,194 P63/mmc 0.393,0.393,0.612,90,90,120 - colorless 6.61 X 2850
La-O La2O3 mon Sm2 O3,mS30,12 C12/m1 1.442,0.3722,0.9109,90,99.73,90 - - 6.74 A 8531
La-O La2O3 rt La2O3,hP5,164 P-3m1 0.39381,0.39381,0.61361,90,90,120 - colorless 6.56 X 12610
La-Os LaOs2 hp-ht MgZn2,hP12,194 P63/mmc 0.542,0.542,0.9,90,90,120 Friauf-Laves phase - 15.07 A 6751
La-Os LaOs2 rt MgCu2,cF24,227 Fd-3m 0.7744,0.7744,0.7744,90,90,90 Friauf-Laves phase - 14.86 X 15274
La-Os La3Os Fe3C-b,oP16,62 Pnma 0.753,0.9919,0.6597,90,90,90 - - 8.18 A 13334
La-P LaP NaCl,cF8,225 Fm-3m 0.6025,0.6025,0.6025,90,90,90 rocksalt family - 5.16 X 25127
La-P LaP 2 LaP 2 ,mS48,9 C1c1 1.2505,1.3942,0.8825,90,134.74,90 - gray dark 4.88 X 9409
La-P LaP 5 mon1 LaP 5 ,mP24,11 P121/m1 0.5576,0.9679,0.9768,90,105.25,90 - black gray 3.84 X 10222
La-P LaP 5 mon2 NdP 5,mP12,11 P121/m1 0.4885,0.9673,0.5577,90,105.32,90 - black 3.84 X 41942
La-P LaP 7 LaP 7 ,mP32,14 P121/c1 0.6989,1.1656,1.02645,90,129.59,90 - black 3.67 X 9251
La-Pb LaPb2 CuZr2,tI6,139 I4/mmm 0.3331,0.3331,1.6918,90,90,90 close-packed structure - 9.79 A 28918
La-Pb LaPb3 Cu3Au,cP4,221 Pm-3m 0.4902,0.4902,0.4902,90,90,90 close-packed structure - 10.72 X 16606
La-Pb La5Pb3 Mn5 Si3,hP16,193 P63/mcm 0.9534,0.9534,0.6977,90,90,120 - - 7.96 A 29066
La-Pb La5Pb4 rt Sm5 Ge4,oP36,62 Pnma 0.8538,1.631,0.8674,90,90,90 - - 8.38 X 4345
La-Pd LaPd rt TlI,oS8,63 Cmcm 0.3945,1.1032,0.466,90,90,90 CrB(TlI)-FeB - 8.03 A 9389
La-Pd LaPd3 Cu3Au,cP4,221 Pm-3m 0.4183,0.4183,0.4183,90,90,90 close-packed structure - 10.39 X 23666
La-Pd LaPd5 CaCu5,hP6,191 P6/mmm 0.53,0.53,0.4431,90,90,120 - - 10.34 X 22361
La-Pd La3Pd4 Pu3Pd4,hR42,148 R-3 1.386,1.386,0.5848,90,90,120 b.c.c. family - 8.63 A 8276
La-Pd La7Pd3 Th7Fe3,hP20,186 P63mc 1.0387,1.0387,0.6552,90,90,120 - - 7.01 A 7492
La-Pt LaPt TlI,oS8,63 Cmcm 0.3972,1.1023,0.4548,90,90,90 CrB(TlI)-FeB - 11.14 A 16607
120 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

La-Pt LaPt2 MgCu2,cF24,227 Fd-3m 0.7781,0.7781,0.7781,90,90,90 Friauf-Laves phase - 14.92 X 7597


La-Pt LaPt5 CaCu5,hP6,191 P6/mmm 0.5392,0.5392,0.438,90,90,120 - - 16.78 X 41936
La-Pt La3Pt2 Er3Ni2,hR45,148 R-3 0.9096,0.9096,1.7303,90,90,120 - - 9.73 A 10402
La-Pt La3Pt4 Pu3Pd4,hR42,148 R-3 1.3838,1.3838,0.5814,90,90,120 b.c.c. family - 12.37 A 10744
La-Pt La7Pt3 Th7Fe3,hP20,186 P63 mc 1.0336,1.0336,0.6516,90,90,120 - - 8.58 A 7500
La-Pu La0.85Pu0.15 ht1 Cu,cF4,225 Fm-3m 0.5256,0.5256,0.5256,90,90,90 close-packed structure - 7.08 X 3754
La-Rh LaRh TlI,oS8,63 Cmcm 0.3985,1.1143,0.4247,90,90,90 CrB(TlI)-FeB - 8.52 A 26180
La-Rh LaRh2 rt MgCu2,cF24,227 Fd-3m 0.7648,0.7648,0.7648,90,90,90 Friauf-Laves phase - 10.24 X 26180
La-Rh LaRh3 ht PuNi3,hR36,166 R-3m 0.5326,0.5326,2.646,90,90,120 Laves-CaCu5 - 10.29 A 6734
La-Rh LaRh3 rt CeNi3,hP24,194 P63 /mmc 0.5306,0.5306,1.7592,90,90,120 Laves-CaCu5 - 10.40 A 30153
La-Rh La2Rh7 ht1 Ce2Ni7,hP36,194 P63 /mmc 0.5296,0.5296,2.613,90,90,120 Laves-CaCu5 - 10.45 A 4874
La-Rh La2Rh7 ht2 Gd2Co7,hR54,166 R-3m 0.5333,0.5333,3.946,90,90,120 Laves-CaCu5 - 10.23 A 4874
La-Rh La3Rh2 Er3Ni2,hR45,148 R-3 0.897,0.897,1.7024,90,90,120 - - 7.84 A 26180
La-Rh La4Rh3 Th3P 4,cI28,220 I-43d 0.8922,0.8922,0.8922,90,90,90 - - 8.08 X 5248
La-Rh La5Rh4 Sm5Ge4,oP36,62 Pnma 0.7601,1.5111,0.7802,90,90,90 - - 8.20 A 26180
La-Rh La7Rh3 Th7Fe3,hP20,186 P63 mc 1.0202,1.0202,0.6506,90,90,120 - - 7.26 A 26180
La-Ru LaRu2 lt *,tI12,* - 0.544,0.544,0.7758,90,90,90 - - - N 8506
La-Ru LaRu2 rt MgCu2,cF24,227 Fd-3m 0.7716,0.7716,0.7716,90,90,90 Friauf-Laves phase - 9.86 X 25319
La-Ru La0.05 Ru0.95 Mg,hP2,194 P63 /mmc 0.2719,0.2719,0.4302,90,90,120 close-packed structure - 12.42 X 17698
La-Ru La3Ru Fe3C-b,oP16,62 Pnma 0.7465,1.0016,0.657,90,90,90 - - 7.00 A 27429
La-Ru La5Ru2 Mn5C2,mS28,15 C12/c1 1.6806,0.6693,0.7444,90,95.86,90 - - 7.15 A 23494
La-Ru La5Ru3 *,o**,* - 1.6,1.6,19.134,90,90,90 - - - N 23494
La-Ru La7Ru3 Sr7Pt3,oP40,62 Pnma 0.7422,2.3562,0.6732,90,90,90 - - 7.20 A 23494
La-S LaS hp CsCl,cP2,221 Pm-3m 0.33068,0.33068,0.33068,90,90,90 b.c.c. family - 7.85 X 49338
La-S LaS NaCl,cF8,225 Fm-3m 0.5848,0.5848,0.5848,90,90,90 rocksalt family golden 5.68 X 18155
La-S LaS1.91 UAs2,tP6,129 P4/nmm 0.3975,0.3975,0.8184,90,90,90 - - 5.14 A 12301
La-S LaS1.96 ht LaS2,oP24,62 Pnma 0.8133,1.6345,0.4133,90,90,90 - red dark 4.88 X 42017
La-S LaS2 cub *,c*24,* - 0.82,0.82,0.82,90,90,90 - brown - N 1095
La-S LaS2 rt CeSe2,mP12,14 P121/c1 0.8317,0.4096,0.8254,90,90.3,90 - brown 4.80 A 30628
La-S LaS2 tet UAs2,tP6,129 P4/nmm 0.40782,0.40782,0.81587,90,90,90 - - 4.97 A 29179
La-S La10S15 Pr10S14O,tI200,142 I41/acd 1.572,1.572,2.07,90,90,90 - yellow 4.86 A 33698
La-S La10S19 Ce10Se19,tP58,86 P42 /n 0.9111,0.9111,1.6336,90,90,90 - - 4.89 X 49625
La-S La2S3 rt Cr3C2-b,oP20,62 Pnma 0.766,0.422,1.588,90,90,90 - maroon 4.84 X 4550
La-S La2.67 S4 ht2 Th3P 4,cI28,220 I-43d 0.8731,0.8731,0.8731,90,90,90 - beige 4.98 X 30219
La-S La3S4 lt *,t*28,* - 0.8754,0.8754,0.8613,90,90,90 - - - N 13751
La-S La3S4 rt Th3P 4,cI28,220 I-43d 0.8728,0.8728,0.8728,90,90,90 - gray green 5.44 A 18012
La-S La3S7 *,t**,* - 0.8185,0.8185,1.656,90,90,90 - - - N 11830
La-S La5S7 hp La5S7,tP26,100 P4bm 1.144,1.144,0.528,90,90,90 - red ruby 4.42 X 9302
La-Sb LaSb hp CuTi,tP2,123 P4/mmm 0.3965,0.3965,0.3233,90,90,90 b.c.c. family - 8.52 X 17187
La-Sb LaSb NaCl,cF8,225 Fm-3m 0.649,0.649,0.649,90,90,90 rocksalt family - 6.33 X 17187
La-Sb LaSb2 SmSb2,oS24,64 Cmce 0.6319,0.6173,1.857,90,90,90 - - 7.01 A 12447
La-Sb La2Sb La2Sb,tI12,139 I4/mmm 0.46357,0.46357,1.81195,90,90,90 - - 6.82 X 57414
La-Sb La4Sb3 Th3P 4,cI28,220 I-43d 0.9649,0.9649,0.9649,90,90,90 - - 6.81 X 13003
La-Sb La5Sb3 Mn5Si3,hP16,193 P63 /mcm 0.942,0.942,0.662,90,90,120 - - 6.92 X 3842
La-Se LaSe hp CsCl,cP2,221 Pm-3m 0.33684,0.33684,0.33684,90,90,90 b.c.c. family - 9.47 X 49338
La-Se LaSe NaCl,cF8,225 Fm-3m 0.6064,0.6064,0.6064,90,90,90 rocksalt family golden 6.49 X 20261
La-Se LaSe1.85 UAs2,tP6,129 P4/nmm 0.4207,0.4207,0.8512,90,90,90 - black 6.28 X 53531
La-Se LaSe2 rt CeSe2,mP12,14 P121/c1 0.858,0.426,0.851,90,89.88,90 - black 6.34 X 14970
La-Se La10Se19 Ce10Se19,tP58,86 P42 /n 0.94688,0.94688,1.71088,90,90,90 - gray 6.26 X 24857
La-Se La2.67 Se4 rt Th3P 4,cI28,220 I-43d 0.90521,0.90521,0.90521,90,90,90 - red ruby 6.15 X 39449
La-Se La3Se4 lt *,t*28,* - 0.8971,0.8971,0.9055,90,90,90 - - - N 9178
La-Si LaSi ht FeB-b,oP8,62 Pnma 0.8392,0.3999,0.6062,90,90,90 CrB(TlI)-FeB gray silver 5.45 X 57496
La-Si LaSi rt LaSi,oS16,63 Cmcm 0.45621,1.34803,0.66259,90,90,90 - golden 5.44 X 36555
La-Si LaSi1.88 lt GdSi1.4 ,oI12,74 Imma 0.4184,0.4272,1.402,90,90,90 - - 5.08 X 2641
La-Si LaSi10 LaSi10,hP22,194 P63 /mmc 0.9623,0.9623,0.4723,90,90,120 - - 3.68 X 52884
La-Si LaSi2 rt ThSi2,tI12,141 I41/amd 0.4326,0.4326,1.384,90,90,90 - - 5.00 X 29027
La-Si LaSi5 mon1 LaSi5,mS24,12 C12/m1 1.511,0.4032,0.8263,90,109.111,90 - - 3.90 X 52884
La-Si LaSi5 mon2 LaSi5,mS36,12 C12/m1 1.4922,0.3906,0.8807,90,107.19,90 - - 3.78 X 52884
La-Si La2.9 Si1.1 m *,oP*,* - 0.3833,0.6821,0.9121,90,90,90 - - - N 19657
La-Si La3Si2 U3Si2,tP10,127 P4/mbm 0.787,0.787,0.45,90,90,90 - - 5.63 X 2648
La-Si La5Si3 stab Mn5Si3,hP16,193 P63 /mcm 0.975,0.975,0.709,90,90,120 - - 4.43 A 2780
La-Si La5Si3 Cr5B3,tI32,140 I4/mcm 0.7976,0.7976,1.4107,90,90,90 - - 5.76 X 40180
La-Si La5Si4 Zr5Si4,tP36,92 P41212 0.8059,0.8059,1.545,90,90,90 - - 5.34 X 56294
La-Sn LaSn ht LaSn,oS120,65 Cmmm 1.76697,1.76828,1.19432,90,90,90 - - 6.88 X 59441
La-Sn LaSn rt TlI,oS8,63 Cmcm 0.47633,1.1911,0.44089,90,90,90 CrB(TlI)-FeB - 6.84 X 59441
La-Sn LaSn2 ZrGa2,oS12,65 Cmmm 0.44267,1.58552,0.45136,90,90,90 close-packed structure - 7.89 A 26419
La-Sn LaSn3 Cu3Au,cP4,221 Pm-3m 0.47777,0.47777,0.47777,90,90,90 close-packed structure - 7.54 X 56873
La-Sn La11Sn10 Ho11Ge10,tI84,139 I4/mmm 1.20898,1.20898,1.8166,90,90,90 - - 6.79 X 59441
La-Sn La2Sn3 Nd2Sn3,aP20,2 P-1 0.6518,0.8592,1.1296,107.29,96.63,100.32 - - 7.20 X 42507
La-Sn La2Sn5 Ce2Sn5,oS28,65 Cmmm 0.46385,3.5813,0.46983,90,90,90 close-packed structure - 7.42 X 56873
La-Sn La3Sn lt1 Cu3Au,cP4,221 Pm-3m 0.5102,0.5102,0.5102,90,90,90 close-packed structure - 6.69 X 27429
La-Sn La3Sn4 Er3Ge4,oS28,63 Cmcm 0.45145,1.19044,1.5838,90,90,90 - - 6.96 X 59441
La-Sn La3Sn5 Pu3Pd5,oS32,63 Cmcm 1.0352,0.829,1.0652,90,90,90 - - 7.34 X 38719
La-Sn La3Sn7 Gd3Sn7,oS20,65 Cmmm 0.45783,2.6284,0.46799,90,90,90 close-packed structure - 7.36 X 56873
La-Sn La5Sn3 ht Mn5Si3,hP16,193 P63 /mcm 0.945,0.945,0.6975,90,90,120 - - 6.47 A 16675
La-Sn La5Sn3 rt W5Si3,tI32,140 I4/mcm 1.2755,1.2755,0.6336,90,90,90 - - 6.77 A 23290
La-Sn La5Sn4 Sm5Ge4,oP36,62 Pnma 0.8435,1.6194,0.863,90,90,90 - - 6.59 A 45109
La-Te LaTe NaCl,cF8,225 Fm-3m 0.643,0.643,0.643,90,90,90 rocksalt family purple 6.66 X 31930
Handbook of Inorganic Substances – Edition 2015 : Data 121

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

La-Te LaTe 2 LaTe 2,mP24,7 P1c1 0.919,0.9107,0.907,90,90.04,90 - black 6.90 X 37549


La-Te LaTe 3 NdTe 3,oS16,63 Cmcm 0.4434,2.534,0.441,90,90,90 - golden 6.99 A 30628
La-Te La2Te 5 ht Nd2Te5,oS28,63 Cmcm 0.4465,4.47,0.4465,90,90,90 - brown 6.83 A 3452
La-Te La2.67 Te4 Th3P 4,cI28,220 I-43d 0.9619,0.9619,0.9619,90,90,90 - black gray 6.58 X 3080
La-Te La4Te 7 *,tP22,127 P4/mbm 0.9011,0.9011,0.9172,90,90,90 - black - N 3111
La-Th La0.5 Th0.5 rt Cu,cF4,225 Fm-3m 0.5185,0.5185,0.5185,90,90,90 close-packed structure - 8.84 X 4836
La-Th La0.8 Th0.2 Pr,hP6,152 P3121 0.371,0.371,1.803,90,90,120 close-packed structure - 7.30 X 18439
La-Tl TlLa hp CuTi,tP2,123 P4/mmm 0.371,0.371,0.437,90,90,90 b.c.c. family - 9.48 X 14458
La-Tl TlLa CsCl,cP2,221 Pm-3m 0.3936,0.3936,0.3936,90,90,90 b.c.c. family gray silver 9.35 X 2673
La-Tl TlLa3 rt Cu3Au,cP4,221 Pm-3m 0.506,0.506,0.506,90,90,90 close-packed structure - 7.96 X 11462
La-Tl Tl3La Cu3Au,cP4,221 Pm-3m 0.4803,0.4803,0.4803,90,90,90 close-packed structure - 11.27 X 18700
La-Tl Tl3La5 W5Si3,tI32,140 I4/mcm 1.2798,1.2798,0.6347,90,90,90 - - 8.36 A 18700
La-Tl Tl5La3 rt Pu3Pd5,oS32,63 Cmcm 1.039,0.84,1.078,90,90,90 - - 10.16 A 18700
La-Y La0.3 Y0.7 rt Mg,hP2,194 P63/mmc 0.37021,0.37021,0.58437,90,90,120 close-packed structure - 4.98 X 2237
La-Y La0.5 Y0.5 hp Nd,hP4,194 P63/mmc 0.369,0.369,1.185,90,90,120 close-packed structure - 5.41 X 3218
La-Y La0.5Y0.5 rt Sm,hR9,166 R-3m 0.37,0.37,2.665,90,90,120 close-packed structure - 5.39 A 3218
La-Zn ZnLa CsCl,cP2,221 Pm-3m 0.376,0.376,0.376,90,90,90 b.c.c. family - 6.38 X 57352
La-Zn Zn11 La BaCd11,tI48,141 I41/amd 1.066,1.066,0.686,90,90,90 - - 7.31 A 57352
La-Zn Zn12.37 La rt NaZn13,cF112,226 Fm-3c 1.2094,1.2094,1.2094,90,90,90 - gray 7.12 X 55704
La-Zn Zn16.06 La2 rhom Zn17 Th2,hR57,166 R-3m 0.9125,0.9125,1.333,90,90,120 CaCu5-Zr4Al3 gray 6.88 X 39931
La-Zn Zn17 La2 hex Th2Ni17,hP38,194 P63/mmc 0.9125,0.9125,0.8896,90,90,120 CaCu5-Zr4Al3 - 7.19 A 18518
La-Zn Zn2La KHg2,oI12,74 Imma 0.468,0.763,0.756,90,90,90 AlB2 family - 6.64 A 57352
La-Zn Zn22 La3 Zn22 Ce3,tI100,141 I41/amd 0.893,0.893,2.136,90,90,90 - - 7.23 A 57352
La-Zn Zn4La Zn4La,oS20,63 Cmcm 0.634,1.0312,0.6122,90,90,90 - gray 6.65 X 57581
La-Zn Zn5La CaCu5,hP6,191 P6/mmm 0.54654,0.54654,0.42574,90,90,120 - gray 7.02 X 57598
Li-Mg Li0.13 Mg0.87 Mg,hP2,194 P63/mmc 0.31964,0.31964,0.51555,90,90,120 close-packed structure - 1.61 X 50825
Li-Mg Li0.81 Mg0.19 mart Cu,cF4,225 Fm-3m 0.4378,0.4378,0.4378,90,90,90 close-packed structure - 0.81 X 757
Li-Mg Li0.9 Mg0.1 rt W,cI2,229 Im-3m 0.35007,0.35007,0.35007,90,90,90 b.c.c. family - 0.67 X 4488
Li-N Li[N3] Na[N3],mS8,12 C12/m1 0.5627,0.3319,0.4979,90,107.4,90 - - 1.83 X 3830
Li-N Li2[N2] Li2[N2],oI16,71 Immm 0.31181,0.44372,1.07912,90,90,90 - black 1.86 X 57543
Li-N Li2.91 N Li3N,hP4,191 P6/mmm 0.36576,0.36576,0.38735,90,90,120 - red ruby 1.27 X 39925
Li-N Li3N hp Na3As,hP8,194 P63/mmc 0.3567,0.3567,0.63407,90,90,120 - black 1.66 X 48612
Li-O LiO2 rt FeS2 ,oP6,58 Pnnm 0.494,0.591,0.438,90,90,90 pyrite-marcasite family - 1.01 A 3648
Li-O Li2O hp PbCl2,oP12,62 Pnma 0.4456,0.27865,0.5212,90,90,90 - - 3.07 X 47331
Li-O Li2O rt CaF2 ,cF12,225 Fm-3m 0.46159,0.46159,0.46159,90,90,90 fluorite family - 2.02 X 50791
Li-O Li2[O2] ht *,t*32,* - 0.548,0.548,0.774,90,90,90 - - - N 146
Li-O Li2[O2] rt Li2[O2]-b,hP8,194 P63/mmc 0.3142,0.3142,0.7650,90,90,120 - - 2.33 X 918
Li-O Li3O2 *,o**,* - 1.036,1.084,1.284,90,90,90 - - - N 7495
Li-P LiP LiAs,mP16,14 P121/c1 0.5582,0.494,1.0255,90,118.15,90 - black gray 2.02 X 14750
Li-P LiP 5 LiP 5 ,oP24,33 Pna21 1.0437,0.65892,0.6549,90,90,90 - black 2.39 X 36277
Li-P LiP 7 LiP 7 ,tI128,142 I41/acd 1.3417,1.3417,1.4649,90,90,90 - red ruby 2.25 X 6924
Li-P Li3P Na3As,hP8,194 P63/mmc 0.42286,0.42286,0.75566,90,90,120 - red 1.47 X 47981
Li-P Li3P7 rt Li3P7,oP40,19 P212121 0.7596,0.9742,1.0535,90,90,90 - yellow 2.02 X 19709
Li-Pb LiPb ht CsCl,cP2,221 Pm-3m 0.3586,0.3586,0.3586,90,90,90 b.c.c. family - 7.71 X 888
Li-Pb LiPb rt LiPb,hR6,166 R-3m 0.49872,0.49872,0.61882,90,90,120 b.c.c. family - 8.00 X 888
Li-Pb Li17Pb4 Li17Pb4,cF420,216 F-43m 1.9842,1.9842,1.9842,90,90,90 - black 4.03 X 38919
Li-Pb Li3Pb BiF3 ,cF16,225 Fm-3m 0.6687,0.6687,0.6687,90,90,90 b.c.c. family - 5.07 X 51451
Li-Pb Li7Pb2 Li7Pb2,hP9,164 P-3m1 0.4751,0.4751,0.8589,90,90,120 b.c.c. family - 4.58 X 780
Li-Pb Li8Pb3 Li8Pb3,hR33,166 R-3m 0.476,0.476,3.204,90,90,120 b.c.c. family - 5.37 X 779
Li-Pd LiPd LiRh,hP2,187 P-6m2 0.2751,0.2751,0.4227,90,90,120 close-packed structure - 6.79 X 10741
Li-Pd LiPd7 CuPt7,cF32,225 Fm-3m 0.766,0.766,0.766,90,90,90 close-packed structure - 11.11 X 9919
Li-Pd Li0.06 Pd0.94 Cu,cF4,225 Fm-3m 0.3878,0.3878,0.3878,90,90,90 close-packed structure - 11.44 X 10757
Li-Pd Li1.2Pd0.8 ht CsCl,cP2,221 Pm-3m 0.2971,0.2971,0.2971,90,90,90 b.c.c. family - 5.92 X 10741
Li-Pd Li1.37 Pd2.63 Li(Li0.37Pd0.63)Pd2,mP4,10 P12/m1 0.4635,0.2725,0.4718,90,109.91,90 - - 8.58 X 12435
Li-Pd Li15Pd4 Cu15 Si4,cI76,220 I-43d 1.0676,1.0676,1.0676,90,90,90 - green 2.89 X 9919
Li-Pd Li2Pd Hg2U,hP3,191 P6/mmm 0.42267,0.42267,0.27319,90,90,120 AlB2 family - 4.73 X 9919
Li-Pd Li3Pd ht BiF3 ,cF16,225 Fm-3m 0.6187,0.6187,0.6187,90,90,90 b.c.c. family - 3.57 X 9919
Li-Pt LiPt LiRh,hP2,187 P-6m2 0.2728,0.2728,0.4226,90,90,120 close-packed structure - 12.32 X 9107
Li-Pt LiPt2 MgCu2,cF24,227 Fd-3m 0.76,0.76,0.76,90,90,90 Friauf-Laves phase - 12.02 X 1245
Li-Pt LiPt7 CuPt7,cF32,225 Fm-3m 0.7725,0.7725,0.7725,90,90,90 close-packed structure - 19.78 X 18096
Li-Pt Li2Pt Hg2U,hP3,191 P6/mmm 0.4186,0.4186,0.2661,90,90,120 AlB2 family - 8.59 X 9107
Li-Rh LiRh LiRh,hP2,187 P-6m2 0.2649,0.2649,0.4359,90,90,120 close-packed structure - 6.89 X 2473
Li-Rh LiRh3 LiIr3 ,oI8,44 Imm2 0.26586,0.86023,0.4657,90,90,90 close-packed structure - 9.84 A 9929
Li-S Li2S hp PbCl2,oP12,62 Pnma 0.57353,0.35448,0.66861,90,90,90 - - 2.24 X 37722
Li-S Li2S ht BiF3 ,cF16,225 Fm-3m 0.5859,0.5859,0.5859,90,90,90 b.c.c. family - 1.52 X 24914
Li-S Li2S m Li2S,oP12,33 Pna21 0.59219,0.68977,0.36463,90,90,90 - - 2.05 X 37722
Li-S Li2S rt CaF2 ,cF12,225 Fm-3m 0.57158,0.57158,0.57158,90,90,90 fluorite family black 1.63 X 36734
Li-Sb Li2Sb Mg2 Ga,hP18,190 P-62c 0.7946,0.7946,0.6527,90,90,120 Fe2P family gray silver 3.79 X 11110
Li-Sb Li3Sb ht Na3As,hP8,194 P63/mmc 0.46884,0.46884,0.83258,90,90,120 - - 2.99 X 59409
Li-Sb Li3Sb rt BiF3 ,cF16,225 Fm-3m 0.65709,0.65709,0.65709,90,90,90 b.c.c. family - 3.34 X 59409
Li-Se Li2Se CaF2 ,cF12,225 Fm-3m 0.60014,0.60014,0.60014,90,90,90 fluorite family brown red 2.85 X 6062
Li-Si LiSi LiGe,tI32,88 I41/a 0.9354,0.9354,0.5746,90,90,90 - - 1.85 X 41925
Li-Si Li12 Si7 Li12Si7,oP152,62 Pnma 0.8566,1.9706,1.4299,90,90,90 - black gray 1.54 X 18909
Li-Si Li13 Si4 Li13Si4,oP34,55 Pbam 0.799,1.521,0.443,90,90,90 - gray 1.25 X 9475
Li-Si Li21 Si5 Li21Si5,cF416,216 F-43m 1.8710,1.8710,1.8710,90,90,90 γ-brass gray 1.16 X 20420
Li-Si Li4Si *,o*250,* - 0.449,2.5,3.44,90,90,90 - gray - N 2866
Li-Si Li4.7 Si2 Li5Sn2,hR21,166 R-3m 0.4435,0.4435,1.8134,90,90,120 b.c.c. family purple 1.43 X 13851
Li-Sn LiSn mon LiSn,mP6,10 P12/m1 0.517,0.318,0.774,90,104.5,90 close-packed structure gray 5.08 X 7853
122 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Li-Sn LiSn tet LiGe,tI24,141 I41/amd 0.4387,0.4387,2.5511,90,90,90 - - 5.10 X 24289


Li-Sn Li13Sn5 Li13Sn5,hP18,164 P-3m1 0.470,0.470,1.712,90,90,120 - gray 3.47 X 9481
Li-Sn Li17Sn4 Li17Pb4,cF420,216 F-43m 1.96907,1.96907,1.96907,90,90,90 - gray dark 2.58 X 41534
Li-Sn Li2Sn5 Hg5Mn2,tP14,127 P4/mbm 1.0274,1.0274,0.3125,90,90,90 - gray bright 6.11 X 4410
Li-Sn Li5Sn2 Li5Sn2,hR21,166 R-3m 0.474,0.474,1.983,90,90,120 b.c.c. family gray 3.51 X 9474
Li-Sn Li7Sn2 Li7Ge2,oS36,65 Cmmm 0.98,1.38,0.475,90,90,90 - gray 2.96 X 9484
Li-Sn Li7Sn3 Li7Sn3,mP20,11 P121/m1 0.856,0.472,0.945,90,105.95,90 b.c.c. family gray 3.66 X 8673
Li-Sr LiSr7 ht *,tI*,* - 0.761,0.761,0.65,90,90,90 - - - N 1696
Li-Sr LiSr8 ht *,hP*,* - 0.431,0.431,1.385,90,90,120 - - - N 1696
Li-Sr LiSr8 rt *,tP*,* - 0.616,0.616,0.886,90,90,90 - - - N 1696
Li-Sr Li2Sr3 Li2Sr3,tP20,136 P42 /mnm 0.9628,0.9628,0.855,90,90,90 - - 2.32 X 1697
Li-Sr Li23Sr6 Th6Mn23,cF116,225 Fm-3m 1.505,1.505,1.505,90,90,90 - - 1.34 X 1892
Li-Te LiTe3 LiTe3,hP48,165 P-3c1 0.87144,0.87144,2.135,90,90,120 - gray 5.53 X 10356
Li-Te Li2Te CaF2,cF12,225 Fm-3m 0.6504,0.6504,0.6504,90,90,90 fluorite family - 3.42 X 75
Li-Tl LiTl CsCl,cP2,221 Pm-3m 0.3438,0.3438,0.3438,90,90,90 b.c.c. family - 8.64 X 12653
Li-Tl Li2Tl rt Li2Ga,oS12,63 Cmcm 0.4741,1.0023,0.4786,90,90,90 b.c.c. family - 6.37 A 16562
Li-Tl Li22Tl5 Li22Pb5,cF432,216 F-43m 2.0003,2.0003,2.0003,90,90,90 b.c.c. family - 3.90 A 16562
Li-Tl Li3Tl BiF3,cF16,225 Fm-3m 0.6671,0.6671,0.6671,90,90,90 b.c.c. family - 5.04 X 12896
Li-Tl Li5Tl2 Li5Sn2,hR21,166 R-3m 0.4716,0.4716,2.0399,90,90,120 b.c.c. family - 5.62 X 12896
Li-Zn LiZn rt NaTl,cF16,227 Fd-3m 0.6234,0.6234,0.6234,90,90,90 b.c.c. family pink red 3.97 X 12494
Li-Zn LiZn13 m NaZn13,cF112,226 Fm-3c 1.23492,1.23492,1.23492,90,90,90 - - 6.04 X 55472
Li-Zn Li0.07 Zn0.93 rt Mg,hP2,194 P63 /mmc 0.27704,0.27704,0.43907,90,90,120 close-packed structure - 6.97 X 55472
Li-Zn Li0.2 Zn0.8 ht Mg,hP2,194 P63 /mmc 0.27702,0.27702,0.43785,90,90,120 close-packed structure - 6.13 X 44512
Li-Zn Li2.9 Zn4.1 rt Li5Sn2,hR21,166 R-3m 0.4386,0.4386,1.8738,90,90,120 b.c.c. family gray 4.60 X 57776
Li-Zn Li3.7 Zn5.3 ht Li5Ga4,hP9,164 P-3m1 0.43528,0.43528,0.8003,90,90,120 b.c.c. family gray 4.71 X 57776
Lu-Mg MgLu CsCl,cP2,221 Pm-3m 0.37,0.37,0.37,90,90,90 b.c.c. family - 6.53 X 3765
Lu-Mg Mg0.3 Lu0.7 ht W,cI2,229 Im-3m 0.3797,0.3797,0.3797,90,90,90 b.c.c. family - 7.87 X 2388
Lu-Mg Mg2Lu MgZn2,hP12,194 P63 /mmc 0.596,0.596,0.971,90,90,120 Friauf-Laves phase - 4.97 X 3765
Lu-Mg Mg24Lu5 Ti5Re24,cI58,217 I-43m 1.1185,1.1185,1.1185,90,90,90 - white silver3.46 X 2375
Lu-Mn LuMn2 MgZn2,hP12,194 P63 /mmc 0.522,0.522,0.854,90,90,120 Friauf-Laves phase - 9.39 A 30735
Lu-Mn LuMn5 LuMn5,hP12,186 P63 mc 0.5186,0.5186,0.8566,90,90,120 Friauf-Laves phase - 7.49 X 2929
Lu-Mn Lu6Mn23 Th6Mn23,cF116,225 Fm-3m 1.22,1.22,1.22,90,90,90 - - 8.46 A 2809
Lu-N LuN NaCl,cF8,225 Fm-3m 0.4542,0.4542,0.4542,90,90,90 rocksalt family - 13.40 X 52487
Lu-N Lu2N3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.032,1.032,1.032,90,90,90 - - 9.48 A 6879
Lu-Ni LuNi FeB-b,oP8,62 Pnma 0.6912,0.4073,0.5366,90,90,90 CrB(TlI)-FeB - 10.27 A 15257
Lu-Ni LuNi2 MgCu2,cF24,227 Fd-3m 0.7077,0.7077,0.7077,90,90,90 Friauf-Laves phase - 10.96 X 56512
Lu-Ni LuNi3 PuNi3,hR36,166 R-3m 0.49218,0.49218,2.4087,90,90,120 Laves-CaCu5 - 10.38 X 55919
Lu-Ni LuNi4 LuNi4,hP45,151 P3112 0.4872,0.4872,3.048,90,90,120 - - 9.77 X 17917
Lu-Ni LuNi5 CaCu5,hP6,191 P6/mmm 0.4834,0.4834,0.3969,90,90,120 - - 9.69 X 7425
Lu-Ni Lu2Ni17 Th2Ni17,hP38,194 P63 /mmc 0.834,0.834,0.796,90,90,120 CaCu5-Zr4Al3 - 9.34 A 22847
Lu-Ni Lu3Ni Fe3C-b,oP16,62 Pnma 0.67504,0.92991,0.6163,90,90,90 - - 10.02 X 55919
Lu-Ni Lu3Ni2 Er3Ni2,hR45,148 R-3 0.8372,0.8372,1.55314,90,90,120 - - 10.18 X 55919
Lu-O LuO1.5 tf CaF2,cF12,225 Fm-3m 0.511,0.511,0.511,90,90,90 fluorite family - 9.90 X 11547
Lu-O Lu2O3 hp Sm2O3,mS30,12 C12/m1 1.352,0.3387,0.8289,90,100.24,90 - - 10.61 A 6612
Lu-O Lu2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.0391,1.0391,1.0391,90,90,90 - - 9.42 X 55084
Lu-Os LuOs2 MgZn2,hP12,194 P63 /mmc 0.5254,0.5254,0.8661,90,90,120 Friauf-Laves phase - 17.82 X 1059
Lu-Os Lu3Os Fe3C-b,oP16,62 Pnma 0.7331,0.8798,0.6093,90,90,90 - - 12.09 A 13335
Lu-P LuP NaCl,cF8,225 Fm-3m 0.55291,0.55291,0.55291,90,90,90 rocksalt family - 8.09 X 7788
Lu-P LuP 5 NdP 5,mP12,11 P121/m1 0.4871,0.9283,0.5277,90,102.57,90 - black 4.70 X 35316
Lu-Pb LuPb2 CuZr2,tI6,139 I4/mmm 0.37061,0.37061,1.312,90,90,90 close-packed structure - 10.86 X 4720
Lu-Pb LuPb3 hp Cu3Au,cP4,221 Pm-3m 0.4786,0.4786,0.4786,90,90,90 close-packed structure - 12.07 X 7486
Lu-Pb Lu5Pb3 Mn5Si3,hP16,193 P63 /mcm 0.87452,0.87452,0.64336,90,90,120 - - 11.66 X 54571
Lu-Pb Lu5Pb4 rt *,oP*,* - 0.65,1.655,1.954,90,90,90 - - - N 4720
Lu-Pb Lu6Pb5 V6Si5,oI44,72 Ibam 0.919,2.002,0.642,90,90,90 - - 11.73 A 30196
Lu-Pd LuPd CsCl,cP2,221 Pm-3m 0.3415,0.3415,0.3415,90,90,90 b.c.c. family - 11.73 X 13362
Lu-Pd LuPd3 Cu3Au,cP4,221 Pm-3m 0.4033,0.4033,0.4033,90,90,90 close-packed structure - 12.51 X 36496
Lu-Pd Lu0.1 Pd0.9 Cu,cF4,225 Fm-3m 0.3953,0.3953,0.3953,90,90,90 close-packed structure - 12.18 X 36496
Lu-Pd Lu2.12Pd0.88 Dy2.12Pd0.88 ,cF144,227 Fd-3m 1.3241,1.3241,1.3241,90,90,90 - - 10.63 A 8305
Lu-Pd Lu3Pd4 Pu3Pd4,hR42,148 R-3 1.288,1.288,0.566,90,90,120 b.c.c. family - 11.65 X 20581
Lu-Po LuPo NaCl,cF8,225 Fm-3m 0.6159,0.6159,0.6159,90,90,90 rocksalt family - 10.92 X 3160
Lu-Pt LuPt FeB-b,oP8,62 Pnma 0.681,0.4417,0.5479,90,90,90 CrB(TlI)-FeB - 14.91 A 2469
Lu-Pt LuPt3 Cu3Au,cP4,221 Pm-3m 0.403,0.403,0.403,90,90,90 close-packed structure - 19.29 X 3583
Lu-Pt Lu2Pt Co2Si-b,oP12,62 Pnma 0.6978,0.463,0.8584,90,90,90 - - 13.05 A 11341
Lu-Pt Lu3Pt Fe3C-b,oP16,62 Pnma 0.6926,0.9225,0.6293,90,90,90 - - 11.89 A 12087
Lu-Pt Lu3Pt4 Pu3Pd4,hR42,148 R-3 1.2842,1.2842,0.5622,90,90,120 b.c.c. family - 16.20 A 10744
Lu-Pt Lu5Pt3 Mn5Si3,hP16,193 P63 /mcm 0.8183,0.8183,0.6155,90,90,120 - - 13.59 A 11341
Lu-Pt Lu5Pt4 Sm5Ge4,oP36,62 Pnma 0.7323,1.4261,0.7388,90,90,90 - - 14.25 A 11278
Lu-Re LuRe2 MgZn2,hP12,194 P63 /mmc 0.5342,0.5342,0.8722,90,90,120 Friauf-Laves phase - 16.87 A 14287
Lu-Rh LuRh CsCl,cP2,221 Pm-3m 0.3334,0.3334,0.3334,90,90,90 b.c.c. family - 12.45 X 2764
Lu-Rh LuRh2 MgCu2,cF24,227 Fd-3m 0.7404,0.7404,0.7404,90,90,90 Friauf-Laves phase - 12.46 X 2764
Lu-Rh Lu5Rh3 Mn5Si3,hP16,193 P63 /mcm 0.8002,0.8002,0.6213,90,90,120 - - 11.41 A 15271
Lu-Ru LuRu CsCl,cP2,221 Pm-3m 0.3329,0.3329,0.3329,90,90,90 b.c.c. family - 12.42 X 10149
Lu-Ru LuRu2 MgZn2,hP12,194 P63 /mmc 0.5204,0.5204,0.8725,90,90,120 Friauf-Laves phase - 12.24 X 1059
Lu-Ru Lu3Ru Fe3C-b,oP16,62 Pnma 0.6247,0.8915,0.6131,90,90,90 - - 12.18 A 12457
Lu-Ru Lu3Ru2 Er3Ru2,hP10,176 P63 /m 0.7788,0.7788,0.3894,90,90,120 - - 11.81 A 23566
Lu-Ru Lu5Ru2 Mn5C2,mS28,15 C12/c1 1.5252,0.6109,0.7223,90,97.37,90 - - 10.72 A 12457
Lu-S LuS2 ht-hp1 NdS2,tP24,117 P-4b2 0.76,0.76,0.782,90,90,90 - black gray 7.03 A 11830
Lu-S LuS2 ht-hp2 *,c*24,* - 0.7687,0.7687,0.7687,90,90,90 - black gray - N 5227
Handbook of Inorganic Substances – Edition 2015 : Data 123

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Lu-S Lu0.75 S NaCl,cF8,225 Fm-3m 0.53797,0.53797,0.53797,90,90,90 rocksalt family golden 6.97 X 23491
Lu-S Lu0.757 S Lu0.76 S,oF96,70 Fddd 0.7602,1.0747,2.2813,90,90,90 - - 7.04 X 14364
Lu-S Lu2S3 ht-hp2 Th2S3,oP20,62 Pnma 1.0411,0.3773,1.032,90,90,90 - - 7.31 A 9490
Lu-S Lu2S3 Al2O3,hR30,167 R-3c 0.67286,0.67286,1.81684,90,90,120 - colorless 6.24 X 26831
Lu-S Lu2.67 S4 hp Th3P 4,cI28,220 I-43d 0.79957,0.79957,0.79957,90,90,90 - - 7.74 A 37317
Lu-Sb LuSb rt NaCl,cF8,225 Fm-3m 0.606,0.606,0.606,90,90,90 rocksalt family - 8.86 X 23590
Lu-Sb LuSb2 *,oP*,* - 0.3244,0.5835,0.7885,90,90,90 - - - N 5249
Lu-Sb Lu5Sb3 rt Y5Bi3,oP32,62 Pnma 0.78847,0.9077,1.15055,90,90,90 - - 10.00 X 52282
Lu-Sb Lu5Sb3 stab? Mn5 Si3,hP16,193 P63/mcm 0.89,0.89,0.633,90,90,120 - - 9.48 A 23591
Lu-Sb Lu7Sb3 Lu7Sb3,tI80,140 I4/mcm 1.55974,1.55974,0.8813,90,90,90 - - 9.85 X 48402
Lu-Se LuSe NaCl,cF8,225 Fm-3m 0.5575,0.5575,0.5575,90,90,90 rocksalt family - 9.73 X 3930
Lu-Se LuSe 2 hp UAs2,tP6,129 P4/nmm 0.3936,0.3936,0.8147,90,90,90 - - 8.76 A 5254
Lu-Se Lu0.67 Se ht NaCl,cF8,225 Fm-3m 0.562,0.562,0.562,90,90,90 rocksalt family brown 7.34 X 2138
Lu-Se Lu0.67 Se rt Lu0.68 S,oF96,70 Fddd 0.79806,1.1251,2.3877,90,90,90 - orange 7.29 X 43934
Lu-Se Lu0.75 Se ht Sc0.685 S,hR12,166 R-3m 0.39632,0.39632,1.93696,90,90,120 - - 7.95 A 3930
Lu-Se Lu2.67 Se4 hp Th3P 4,cI28,220 I-43d 0.857,0.857,0.857,90,90,90 - - 8.26 A 5250
Lu-Si LuSi TlI,oS8,63 Cmcm 0.4095,1.0129,0.3712,90,90,90 CrB(TlI)-FeB gray 8.76 A 28718
Lu-Si LuSi1.67 AlB2 ,hP3,191 P6/mmm 0.3756,0.3756,0.405,90,90,120 AlB2 family - 7.45 X 28718
Lu-Si LuSi3 YbSi3,tI32,139 I4/mmm 0.71835,0.71835,1.0471,90,90,90 - - 6.37 X 58432
Lu-Si Lu5Si3 Mn5 Si3,hP16,193 P63/mcm 0.824,0.824,0.613,90,90,120 - gray silver 8.84 X 4619
Lu-Si Lu5Si4 *,mP36,14 P121/c1 1.411,0.746,0.72,90,92.1,90 - - - N 3355
Lu-Sn LuSn2 ZrSi2,oS12,63 Cmcm 0.4343,1.5997,0.4273,90,90,90 close-packed structure - 9.23 X 2883
Lu-Sn Lu2Sn5 Er2Ge5,oP14,59 Pmmn 0.4292,0.4359,1.8748,90,90,90 - - 8.93 A 27463
Lu-Sn Lu5Sn3 Mn5 Si3,hP16,193 P63/mcm 0.87,0.87,0.6355,90,90,120 - - 9.81 A 3333
Lu-Tb Tb0.233 Lu0.767 Mg,hP2,194 P63/mmc 0.3537,0.3537,0.5587,90,90,120 close-packed structure - 9.39 X 1948
Lu-Tc LuTc 2 MgZn2,hP12,194 P63/mmc 0.531,0.531,0.8736,90,90,120 Friauf-Laves phase - 11.55 A 14287
Lu-Te LuTe NaCl,cF8,225 Fm-3m 0.592,0.592,0.592,90,90,90 rocksalt family - 9.69 X 12410
Lu-Te LuTe 2 UAs2,tP6,129 P4/nmm 0.4222,0.4222,0.8807,90,90,90 - - 9.10 A 5233
Lu-Te LuTe 3 NdTe 3,oS16,63 Cmcm 0.4286,2.5188,0.4286,90,90,90 - - 8.01 A 18466
Lu-Te Lu11 Te4 Lu11 Te4,mS90,12 C12/m1 3.0412,0.39504,2.1073,90,102.96,90 - black 9.83 X 44677
Lu-Te Lu2Te 3 Sc2S3,oF80,70 Fddd 0.8499,1.2022,2.5497,90,90,90 - - 7.47 X 2549
Lu-Te Lu7Te Lu7Te,oS32,63 Cmcm 0.37418,1.2278,1.977,90,90,90 - - 9.89 X 41612
Lu-Te Lu8Te Lu8Te,hP9,189 P-62m 0.9,0.9,0.3687,90,90,120 Fe2P family - 9.81 X 41612
Lu-Th Th0.2 Lu0.8 Mg,hP2,194 P63/mmc 0.3542,0.3542,0.5593,90,90,120 close-packed structure - 10.19 X 6933
Lu-Th Th0.6 Lu0.4 rt Cu,cF4,225 Fm-3m 0.503,0.503,0.503,90,90,90 close-packed structure - 10.92 X 4836
Lu-Tl TlLu rt CuAu,tP2,123 P4/mmm 0.386,0.386,0.544,90,90,90 close-packed structure - 7.77 X 22842
Lu-Tl Tl3Lu Cu3Au,cP4,221 Pm-3m 0.4638,0.4638,0.4638,90,90,90 close-packed structure - 13.12 X 22842
Lu-Tl Tl3Lu5 Mn5 Si3,hP16,193 P63/mcm 0.8726,0.8726,0.6572,90,90,120 - - 11.40 A 22842
Lu-Tl Tl5Lu3 Pu3Pd5,oS32,63 Cmcm 0.986,0.8053,1.0307,90,90,90 - - 12.55 A 22842
Lu-Zn ZnLu CsCl,cP2,221 Pm-3m 0.3491,0.3491,0.3491,90,90,90 b.c.c. family gray silver 9.38 X 2673
Lu-Zn Zn12 Lu ThMn12,tI26,139 I4/mmm 0.8831,0.8831,0.5179,90,90,90 CaCu5-Zr4Al3 - 7.89 A 3117
Lu-Zn Zn17 Lu2 ht Zn17 Th2,hR57,166 R-3m 0.89223,0.89223,1.31016,90,90,120 CaCu5-Zr4Al3 gray 8.06 X 20156
Lu-Zn Zn17 Lu2 rt Th2Ni17,hP38,194 P63/mmc 0.8899,0.8899,0.872,90,90,120 CaCu5-Zr4Al3 - 8.12 A 3117
Lu-Zn Zn2Lu KHg2,oI12,74 Imma 0.4416,0.6866,0.76,90,90,90 AlB2 family - 8.81 A 3312
Lu-Zn Zn23 Lu6 Th6Mn23,cF116,225 Fm-3m 1.253,1.253,1.253,90,90,90 - - 8.62 A 3117
Lu-Zn Zn3Lu Zn3Y,oP16,62 Pnma 0.665,0.43,0.9974,90,90,90 - - 8.64 A 5331
Lu-Zn Zn5Lu Zn5Er,hP36,194 P63/mmc 0.8811,0.8811,0.9139,90,90,120 - - 8.14 A 6030
Lu-Zn Zn58 Lu13 Zn58 Gd13,hP142,194 P63/mmc 1.409,1.409,1.389,90,90,120 - - 8.44 A 5331
Lu-Zn Zn58.54 Lu12.71 Zn58.54 Lu12.71 ,oP304,33 Pna21 1.3919,2.4428,1.4112,90,90,90 - - 8.38 X 48452
Lu-Zr Lu0.5 Zr0.5 m Mg,hP2,194 P63/mmc 0.3335,0.3335,0.529,90,90,120 close-packed structure - 8.68 X 6916
Mg-Mn Mg0.977 Mn0.023 Mg,hP2,194 P63/mmc 0.32005,0.32005,0.5198,90,90,120 close-packed structure - 1.80 X 1981
Mg-N Mg3 N2 hp Sm2 O3,mS30,12 C12/m1 1.2229,0.3157,0.7618,90,99.03,90 - - 3.46 X 52349
Mg-N Mg3 N2 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 0.99726,0.99726,0.99726,90,90,90 - orange 2.71 X 39530
Mg-Nd MgNd lt CuTi,tP2,123 P4/mmm 0.3847,0.3847,0.387,90,90,90 b.c.c. family - 4.89 X 9066
Mg-Nd MgNd rt CsCl,cP2,221 Pm-3m 0.38677,0.38677,0.38677,90,90,90 b.c.c. family gray silver 4.84 X 9066
Mg-Nd Mg12 Nd ThMn12,tI26,139 I4/mmm 1.031,1.031,0.593,90,90,90 CaCu5-Zr4Al3 - 2.30 X 2009
Mg-Nd Mg2 Nd ht MgCu2,cF24,227 Fd-3m 0.8663,0.8663,0.8663,90,90,90 Friauf-Laves phase - 3.94 X 14223
Mg-Nd Mg3 Nd BiF3 ,cF16,225 Fm-3m 0.7399,0.7399,0.7399,90,90,90 b.c.c. family - 3.56 X 23882
Mg-Nd Mg41 Nd5 Mg41 Ce5,tI92,87 I4/m 1.4741,1.4741,1.0396,90,90,90 - - 2.53 A 23882
Mg-Ni MgNi ht-hp CuTi,tP2,123 P4/mmm 0.2997,0.2997,0.3166,90,90,90 b.c.c. family - 4.85 X 51163
Mg-Ni MgNi2 MgNi2,hP24,194 P63/mmc 0.4824,0.4824,1.5826,90,90,120 Friauf-Laves phase - 5.90 X 12968
Mg-Ni MgNi3 rt Cu3Au,cP4,221 Pm-3m 0.3717,0.3717,0.3717,90,90,90 close-packed structure - 6.48 X 50552
Mg-Ni Mg0.04 Ni0.96 Cu,cF4,225 Fm-3m 0.3533,0.3533,0.3533,90,90,90 close-packed structure - 8.63 X 48633
Mg-Ni Mg0.992 Ni0.008 Mg,hP2,194 P63/mmc 0.32144,0.32144,0.52163,90,90,120 close-packed structure - 1.75 X 50376
Mg-Ni Mg2 Ni Mg2 Ni,hP18,180 P6222 0.5205,0.5205,1.2236,90,90,120 - - 3.72 X 17347
Mg-Ni Mg84.8 Ni14.2 m Mg83 (Mg0.51Pd0.49)4Pd12,cF396,216 F-43m 2.0037,2.0037,2.0037,90,90,90 - - 2.39 X 52463
Mg-O MgO rt NaCl,cF8,225 Fm-3m 0.42121,0.42121,0.42121,90,90,90 periclase colorless 3.59 X 9690
Mg-O MgO2 FeS2 ,cP12,205 Pa-3 0.48441,0.48441,0.48441,90,90,90 pyrite-marcasite family white 3.29 X 12051
Mg-P MgP 4 CdP 4,mP10,14 P121/c1 0.5144,0.5085,0.7526,90,98.66,90 - black 2.53 X 10235
Mg-P Mg3 P 2 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.203,1.203,1.203,90,90,90 - - 2.06 X 67
Mg-Pb Mg0.95Pb0.05 Mg,hP2,194 P63/mmc 0.32132,0.32132,0.52337,90,90,120 close-packed structure - 2.38 X 1086
Mg-Pb Mg2 Pb ht Pb+ PbCl2,oP12,62 Pnma 0.75,0.445,0.882,90,90,90 - - 5.77 A 2816
Mg-Pb Mg2 Pb rt CaF2 ,cF12,225 Fm-3m 0.6815,0.6815,0.6815,90,90,90 fluorite family gray silver 5.37 X 36755
Mg-Pd MgPd rt CsCl,cP2,221 Pm-3m 0.3157,0.3157,0.3157,90,90,90 b.c.c. family - 6.90 X 52461
Mg-Pd MgPd2 Co2Si-b,oP12,62 Pnma 0.54421,0.41673,0.80129,90,90,90 - gray 8.67 X 39138
Mg-Pd MgPd3 cub Cu3Au,cP4,221 Pm-3m 0.39178,0.39178,0.39178,90,90,90 close-packed structure - 9.49 X 45118
Mg-Pd MgPd3 tet ZrAl3,tI16,139 I4/mmm 0.39226,0.39226,1.56527,90,90,90 close-packed structure gray 9.47 X 39138
Mg-Pd Mg0.25Pd0.75 Cu,cF4,225 Fm-3m 0.392,0.392,0.392,90,90,90 close-packed structure - 9.47 X 1109
124 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Mg-Pd Mg0.9Pd1.1 lt CuTi,tP2,123 P4/mmm 0.303,0.303,0.342,90,90,90 b.c.c. family - 7.35 X 1318


Mg-Pd Mg2Pd stab Ti2Ni,cF96,227 Fd-3m 1.20535,1.20535,1.20535,90,90,90 - - 4.71 X 45803
Mg-Pd Mg3Pd Cu3P,hP24,185 P63 cm 0.7987,0.7987,0.8422,90,90,120 - - 3.84 X 45802
Mg-Pd Mg3Pd5 Rh5Ge3,oP16,55 Pbam 0.5427,1.0588,0.41304,90,90,90 - gray 8.47 A 39138
Mg-Pd Mg4Pd *,oS1532,67 Cmme 2.8054,2.8062,3.8387,90,90,90 - - - N 35267
Mg-Pd Mg5Pd2 rt Co2Al5,hP28,194 P63 /mmc 0.8671,0.8671,0.8164,90,90,120 - - 4.18 X 42937
Mg-Pd Mg85Pd14 Mg83(Mg0.51 Pd0.49)4Pd12,cF396,216 F-43m 2.0108,2.0108,2.0108,90,90,90 - - 2.90 X 6493
Mg-Po MgPo NiAs,hP4,194 P63 /mmc 0.4345,0.4345,0.7077,90,90,120 AlB2 family black 6.70 X 1261
Mg-Pr MgPr lt CuTi,tP2,123 P4/mmm 0.388,0.388,0.383,90,90,90 b.c.c. family - 4.76 X 11916
Mg-Pr MgPr rt CsCl,cP2,221 Pm-3m 0.3891,0.3891,0.3891,90,90,90 b.c.c. family gray silver 4.66 X 7425
Mg-Pr Mg12Pr ThMn12,tI26,139 I4/mmm 1.034,1.034,0.598,90,90,90 CaCu5-Zr4Al3 - 2.25 X 2801
Mg-Pr Mg2Pr ht MgCu2,cF24,227 Fd-3m 0.8688,0.8688,0.8688,90,90,90 Friauf-Laves phase - 3.84 X 14223
Mg-Pr Mg3Pr BiF3,cF16,225 Fm-3m 0.7416,0.7416,0.7416,90,90,90 b.c.c. family - 3.48 X 21342
Mg-Pr Mg41Pr5 Mg41Ce5,tI92,87 I4/m 1.475,1.475,1.041,90,90,90 - - 2.50 A 21787
Mg-Pt MgPt cub FeSi,cP8,198 P213 0.4863,0.4863,0.4863,90,90,90 - - 12.67 A 1560
Mg-Pt MgPt tet CuAu,tP2,123 P4/mmm 0.2945,0.2945,0.3495,90,90,90 close-packed structure - 12.02 X 56491
Mg-Pt MgPt3 cub Cu3Au,cP4,221 Pm-3m 0.3906,0.3906,0.3906,90,90,90 close-packed structure - 16.99 X 1780
Mg-Pt MgPt3 tet SrPb3,tP4,123 P4/mmm 0.388,0.388,0.372,90,90,90 close-packed structure - 18.08 X 1560
Mg-Pt MgPt7 CuPt7,cF32,225 Fm-3m 0.7824,0.7824,0.7824,90,90,90 close-packed structure - 19.28 X 1780
Mg-Pt Mg2Pt CuAl2,tI12,140 I4/mcm 0.6334,0.6334,0.5621,90,90,90 - - 7.18 X 47641
Mg-Pt Mg3Pt Cu3P,hP24,185 P63 cm 0.79103,0.79103,0.83223,90,90,120 - - 5.92 X 26100
Mg-Pu Mg0.86Pu0.14 rt Cu,cF4,225 Fm-3m 0.475,0.475,0.475,90,90,90 close-packed structure - 3.42 X 22506
Mg-Pu Mg4Pu rt *,h**,* - 1.38,1.38,0.97,90,90,120 - - - N 22506
Mg-Rh MgRh rt CuTi,tP2,123 P4/mmm 0.31636,0.31636,0.31222,90,90,90 b.c.c. family - 6.76 X 26028
Mg-Rh MgRh stab CsCl,cP2,221 Pm-3m 0.30992,0.30992,0.30992,90,90,90 b.c.c. family - 7.10 X 26141
Mg-Rh Mg2Rh CuZr2,tI6,139 I4/mmm 0.3188,0.3188,1.00667,90,90,90 close-packed structure - 4.92 X 26028
Mg-Rh Mg3Rh Cu3P,hP24,185 P63 cm 0.7905,0.7905,0.8256,90,90,120 - gray light 3.92 X 44104
Mg-Rh Mg44Rh7 Mg44Rh7,cF408,216 F-43m 2.0148,2.0148,2.0148,90,90,90 - - 2.91 X 5725
Mg-Rh Mg5Rh2 Co2Al5,hP28,194 P63 /mmc 0.8536,0.8536,0.8025,90,90,120 - - 4.30 X 1174
Mg-Ru Mg3Ru2 Mg3Ru2,cP20,213 P4132 0.69352,0.69352,0.69352,90,90,90 - - 5.48 X 50446
Mg-Ru Mg44.5 Ru6.5 Mg44Rh7,cF408,216 F-43m 2.019,2.019,2.019,90,90,90 - - 2.81 X 7352
Mg-S MgS tf *,hP*,* - 0.3972,0.3972,0.6307,90,90,120 - - - N 2868
Mg-S MgS NaCl,cF8,225 Fm-3m 0.52,0.52,0.52,90,90,90 niningerite - 2.66 X 27546
Mg-Sb Mg3Sb2 rt La2O3,hP5,164 P-3m1 0.4559,0.4559,0.7243,90,90,120 - - 4.03 X 27309
Mg-Sc Mg0.04 Sc0.96 rt Mg,hP2,194 P63 /mmc 0.33015,0.33015,0.5268,90,90,120 close-packed structure - 2.95 X 13619
Mg-Sc Mg1.3 Sc0.7 rt CsCl,cP2,221 Pm-3m 0.36013,0.36013,0.36013,90,90,90 b.c.c. family - 2.24 X 50880
Mg-Se MgSe rt NaCl,cF8,225 Fm-3m 0.5462,0.5462,0.5462,90,90,90 rocksalt family - 4.21 X 10003
Mg-Se MgSe tf *,hP*,* - 0.4145,0.4145,0.6723,90,90,120 adamantane structure - - N 2868
Mg-Se MgSe2 FeS2,cP12,205 Pa-3 0.65,0.65,0.65,90,90,90 pyrite-marcasite family - 4.41 A 12051
Mg-Si Mg0.002 Si0.998 C,cF8,227 Fd-3m 0.5429,0.5429,0.5429,90,90,90 - - 2.33 X 51926
Mg-Si Mg2Si hp1 Co2P,oP12,62 Pnma 0.60354,0.45911,0.67839,90,90,90 - - 2.71 A 53316
Mg-Si Mg2Si hp2 Co1.75 Ge,hP6,194 P63 /mmc 0.41658,0.41658,0.52866,90,90,120 AlB2 family - 3.21 X 53316
Mg-Si Mg2Si ht CaF2,cF12,225 Fm-3m 0.63703,0.63703,0.63703,90,90,90 fluorite family - 1.97 X 52503
Mg-Si Mg2Si rt MgCu2,cF24,227 Fd-3m 0.63515,0.63515,0.63515,90,90,90 Friauf-Laves phase - 3.98 X 56056
Mg-Si Mg3Si1.67 Mg3Si1.67 ,hP18,176 P63 /m 0.715,0.715,0.405,90,90,120 - - 2.22 X 47834
Mg-Si Mg5Si6 prec Mg5Si6-a,mS22,12 C12/m1 1.516,0.405,0.674,90,105.3,90 - - 2.41 X 34028
Mg-Sm MgSm CsCl,cP2,221 Pm-3m 0.381,0.381,0.381,90,90,90 b.c.c. family gray silver 5.25 X 7425
Mg-Sm Mg0.02 Sm0.98 rt Sm,hR9,166 R-3m 0.3618,0.3618,2.6142,90,90,120 close-packed structure - 7.46 A 22421
Mg-Sm Mg0.08 Sm0.92 ht1 Mg,hP2,194 P63 /mmc 0.3626,0.3626,0.577,90,90,120 close-packed structure - 7.09 X 22421
Mg-Sm Mg0.991 Sm0.009 Mg,hP2,194 P63 /mmc 0.3213,0.3213,0.521,90,90,120 close-packed structure - 1.81 X 49228
Mg-Sm Mg2Sm MgCu2,cF24,227 Fd-3m 0.8639,0.8639,0.8639,90,90,90 Friauf-Laves phase - 4.10 X 22421
Mg-Sm Mg3Sm BiF3,cF16,225 Fm-3m 0.736,0.736,0.736,90,90,90 b.c.c. family - 3.72 X 21342
Mg-Sm Mg41Sm5 Mg41Ce5,tI92,87 I4/m 1.48,1.48,1.036,90,90,90 - - 2.56 A 22421
Mg-Sm Mg45Sm9 Mg43(Mg0.32 Gd0.68 )6Gd5,cF448,216 F-43m 2.246,2.246,2.246,90,90,90 - - 2.87 A 22421
Mg-Sn Mg0.15 Sn0.85 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3186,0.3186,0.3011,90,90,120 - - 6.56 X 2985
Mg-Sn Mg0.974 Sn0.026 Mg,hP2,194 P63 /mmc 0.32068,0.32068,0.52149,90,90,120 close-packed structure - 1.92 X 1131
Mg-Sn Mg2Sn ht1 MgNi2,hP24,194 P63 /mmc 0.455,0.455,1.5,90,90,120 Friauf-Laves phase - 8.26 A 56056
Mg-Sn Mg2Sn ht2 CaF2,cF12,225 Fm-3m 0.67594,0.67594,0.67594,90,90,90 fluorite family white silver3.60 X 31729
Mg-Sn Mg2Sn rt MgCu2,cF24,227 Fd-3m 0.67607,0.67607,0.67607,90,90,90 Friauf-Laves phase - 7.19 X 56056
Mg-Sn Mg9Sn5 hp Mg9Sn5,hR84,146 R3 1.3222,1.3222,1.315,90,90,120 - gray 4.06 X 31802
Mg-Sr SrMg CsCl,cP2,221 Pm-3m 0.39,0.39,0.39,90,90,90 b.c.c. family - 3.13 X 228
Mg-Sr SrMg2 MgZn2,hP12,194 P63 /mmc 0.64838,0.64838,1.04514,90,90,120 Friauf-Laves phase gray silver 2.38 X 42995
Mg-Sr SrMg5.2 SrMg5.2 ,hP46,194 P63 /mmc 1.0463,1.0463,1.0834,90,90,120 - - 2.08 X 21305
Mg-Sr Sr2Mg17 Th2Ni17,hP38,194 P63 /mmc 1.0535,1.0535,1.0356,90,90,120 CaCu5-Zr4Al3 white silver1.97 X 7493
Mg-Sr Sr6Mg23 Th6Mn23,cF116,225 Fm-3m 1.4914,1.4914,1.4914,90,90,90 - - 2.17 X 2452
Mg-Sr Sr9Mg38 rt Sr9Mg38,hP94,194 P63 /mmc 1.0500,1.0500,2.8251,90,90,120 - - 2.11 X 14893
Mg-Tb MgTb CsCl,cP2,221 Pm-3m 0.3778,0.3778,0.3778,90,90,90 b.c.c. family gray silver 5.64 X 10779
Mg-Tb MgTb2 hp CuZr2,tI6,139 I4/mmm 0.38356,0.38356,1.2436,90,90,90 close-packed structure gray silver 6.21 X 31740
Mg-Tb Mg0.3 Tb0.7 ht W,cI2,229 Im-3m 0.3902,0.3902,0.3902,90,90,90 b.c.c. family - 6.63 X 2388
Mg-Tb Mg2Tb MgZn2,hP12,194 P63 /mmc 0.609,0.609,0.981,90,90,120 Friauf-Laves phase - 4.38 X 2180
Mg-Tb Mg24Tb5 Ti5Re24,cI58,217 I-43m 1.1283,1.1283,1.1283,90,90,90 - white silver3.19 X 2375
Mg-Tb Mg3Tb BiF3,cF16,225 Fm-3m 0.73,0.73,0.73,90,90,90 b.c.c. family - 3.96 X 10783
Mg-Te MgTe hex ZnO,hP4,186 P63 mc 0.453,0.453,0.738,90,90,120 adamantane structure - 3.85 A 405
Mg-Te MgTe rt tf ZnS,cF8,216 F-43m 0.6419,0.6419,0.6419,90,90,90 adamantane structure - 3.82 X 35860
Mg-Te MgTe2 FeS2,cP12,205 Pa-3 0.70212,0.70212,0.70212,90,90,90 pyrite-marcasite family gray 5.36 X 12051
Mg-Th Mg2Th ht MgCu2,cF24,227 Fd-3m 0.857,0.857,0.857,90,90,90 Friauf-Laves phase - 5.93 X 12767
Mg-Th Mg2Th rt MgNi2,hP24,194 P63 /mmc 0.6086,0.6086,1.964,90,90,120 Friauf-Laves phase - 5.92 A 732
Mg-Th Mg23Th6 Th6Mn23,cF116,225 Fm-3m 1.427,1.427,1.427,90,90,90 - - 4.46 A 1744
Handbook of Inorganic Substances – Edition 2015 : Data 125

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Mg-Ti Mg0.26 Ti0.74 m2 W,cI2,229 Im-3m 0.333,0.333,0.333,90,90,90 b.c.c. family - 3.76 X 52676
Mg-Ti Mg0.32 Ti0.68 m3 Cu,cF4,225 Fm-3m 0.442,0.442,0.442,90,90,90 close-packed structure - 3.10 X 52676
Mg-Ti Mg0.5 Ti0.5 m1 Mg,hP2,194 P63/mmc 0.303,0.303,0.484,90,90,120 close-packed structure - 3.12 X 50865
Mg-Tl MgTl CsCl,cP2,221 Pm-3m 0.3628,0.3628,0.3628,90,90,90 b.c.c. family - 7.95 X 66
Mg-Tl Mg0.955 Tl0.045 Mg,hP2,194 P63/mmc 0.32057,0.32057,0.52122,90,90,120 close-packed structure - 2.32 X 351
Mg-Tl Mg2 Tl Mg2 In,hP9,189 P-62m 0.80828,0.80828,0.36796,90,90,120 Fe2P family - 6.06 A 5313
Mg-Tl Mg5 Tl2 Mg5 Ga2,oI28,72 Ibam 0.7328,1.4285,0.6197,90,90,90 - - 5.43 A 5313
Mg-Tm MgTm CsCl,cP2,221 Pm-3m 0.3744,0.3744,0.3744,90,90,90 b.c.c. family gray silver 6.12 X 2673
Mg-Tm Mg0.3 Tm0.7 ht W,cI2,229 Im-3m 0.3815,0.3815,0.3815,90,90,90 b.c.c. family - 7.51 X 2388
Mg-Tm Mg2 Tm MgZn2,hP12,194 P63/mmc 0.59808,0.59808,0.9695,90,90,120 Friauf-Laves phase gray silver 4.81 X 31742
Mg-Tm Mg24 Tm5 Ti5Re24,cI58,217 I-43m 1.1215,1.1215,1.1215,90,90,90 - white silver3.36 X 43654
Mg-Y MgY CsCl,cP2,221 Pm-3m 0.379,0.379,0.379,90,90,90 b.c.c. family - 3.45 X 52223
Mg-Y Mg0.99 Y0.01 Mg,hP2,194 P63/mmc 0.3228,0.3228,0.5221,90,90,120 close-packed structure - 1.76 X 57053
Mg-Y Mg2 Y0.7 MgZn2,hP12,194 P63/mmc 0.6024,0.6024,0.9748,90,90,120 Friauf-Laves phase - 2.40 X 33566
Mg-Y Mg24.25 Y4.75 Ti5Re24,cI58,217 I-43m 1.128,1.128,1.128,90,90,90 - white silver2.34 X 2528
Mg-Yb Mg0.04 Yb0.96 rt Cu,cF4,225 Fm-3m 0.54261,0.54261,0.54261,90,90,90 close-packed structure - 6.95 X 2671
Mg-Yb Mg0.995 Yb0.005 Mg,hP2,194 P63/mmc 0.32475,0.32475,0.5178,90,90,120 close-packed structure - 1.76 X 48326
Mg-Yb Mg2 Yb MgZn2,hP12,194 P63/mmc 0.62551,0.62551,1.012,90,90,120 Friauf-Laves phase - 4.30 X 31742
Mg-Zn MgZn *,h**,* - 1.81632,2.5465,2.5465,120.,90.,90. - - - N 55866
Mg-Zn MgZn2 MgZn2,hP12,194 P63/mmc 0.5223,0.5223,0.8566,90,90,120 Friauf-Laves phase - 5.09 X 16806
Mg-Zn Mg0.997 Zn0.003 Mg,hP2,194 P63/mmc 0.32076,0.32076,0.52091,90,90,120 close-packed structure - 1.75 X 50825
Mg-Zn Mg2 Zn11 Mg2 Zn11,cP39,200 Pm-3 0.85398,0.85398,0.85398,90,90,90 - - 6.14 X 57146
Mg-Zn Mg2 Zn3 mon *,mS*,12 C12/m1 1.72041,0.52028,1.44018,90,102.5,90 - - - N 55866
Mg-Zn Mg2 Zn3 prec *,aP*,* - 0.53,1.16515,1.445,81.918,84.,84.041 - - - N 3014
Mg-Zn Mg21 Zn25 Zr21 Re25,hR276,167 R-3c 2.57758,2.57758,0.87624,90,90,120 - gray dark 4.24 X 39741
Mg-Zn Mg4 Zn7 Mg4 Zn7,mS110,12 C12/m1 2.596,0.524,1.428,90,102.5,90 Frank-Kasper phase - 4.86 X 9355
Mg-Zn Mg51Zn20 ht Mg51 Zn20,oI158,71 Immm 1.4025,1.4083,1.4486,90,90,90 - - 2.96 X 14370
Mg-Zr Mg0.9975Zr0.0025 Mg,hP2,194 P63/mmc 0.3204,0.3204,0.5207,90,90,120 close-packed structure - 1.76 X 1981
Mn-Mo Mo0.36Mn0.64 ht (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.91,0.91,0.474,90,90,90 Frank-Kasper phase - 8.85 A 534
Mn-Mo Mo0.85Mn0.15 W,cI2,229 Im-3m 0.3122,0.3122,0.3122,90,90,90 b.c.c. family - 9.80 X 718
Mn-N MnN0.421 ht ZrO0.37 ,hP12,182 P6322 0.48859,0.48859,0.45396,90,90,120 - - 6.46 X 43118
Mn-N MnN0.43 rt MnN0.43 ,oS24,20 C222 1 0.48552,0.84088,0.45327,90,90,90 - - 6.56 X 11018
Mn-N MnN0.457 MoC0.5 ,oP16,60 Pbcn 0.45401,0.5663,0.4904,90,90,90 - - 6.46 X 43118
Mn-N MnN0.5 ht NiAs,hP4,194 P63/mmc 0.28185,0.28185,0.45371,90,90,120 AlB2 family black 6.59 X 43645
Mn-N MnN0.88 ht NaCl,cF8,225 Fm-3m 0.42153,0.42153,0.42153,90,90,90 rocksalt family - 5.97 X 37495
Mn-N MnN0.88 rt CoO,tI4,139 I4/mmm 0.29835,0.29835,0.41287,90,90,90 rocksalt family - 6.08 X 37495
Mn-N Mn2 N Fe2N0.94 ,oP12,60 Pbcn 0.4537,0.5668,0.4909,90,90,90 - - 6.52 X 4169
Mn-N Mn2 N0.97 (Ti0.11 V0.89 )2C,oP8,58 Pnnm 0.46451,0.49114,0.29369,90,90,90 - - 6.12 X 43118
Mn-N Mn3 N2 ht1 Mn3 N2,tI10,139 I4/mmm 0.29731,0.29731,1.2124,90,90,90 - black 5.98 X 37495
Mn-N Mn4 N rt Fe4N,cP5,221 Pm-3m 0.3871,0.3871,0.3871,90,90,90 - - 6.69 X 12585
Mn-Nb NbMn2 MgZn2,hP12,194 P63/mmc 0.487,0.487,0.7404,90,90,120 Friauf-Laves phase - 8.86 A 56407
Mn-Nb Nb0.02 Mn0.98 ht1 Mn,cP20,213 P4132 0.6303,0.6303,0.6303,90,90,90 - - 7.39 A 1298
Mn-Nb Nb0.02 Mn0.98 rt Mn,cI58,217 I-43m 0.891,0.891,0.891,90,90,90 - - 7.58 A 1298
Mn-Nd NdMn12 ThMn12,tI26,139 I4/mmm 0.866,0.866,0.481,90,90,90 CaCu5-Zr4Al3 - 7.40 X 3779
Mn-Nd NdMn2 lt NdMn2,mS24,12 C12/m1 0.9694,0.55225,0.8981,90,90.03,90 Friauf-Laves phase - 7.02 X 58521
Mn-Nd NdMn2 rt MgZn2,hP12,194 P63/mmc 0.55672,0.55672,0.90633,90,90,120 Friauf-Laves phase - 6.94 X 58521
Mn-Nd Nd6 Mn23 ht Th6Mn23,cF116,225 Fm-3m 1.27017,1.27017,1.27017,90,90,90 - - 6.90 A 27624
Mn-Ni MnNi ht1 CuAu,tP2,123 P4/mmm 0.26446,0.26446,0.352,90,90,90 close-packed structure - 7.67 X 4152
Mn-Ni MnNi ht2 CsCl,cP2,221 Pm-3m 0.298,0.298,0.298,90,90,90 b.c.c. family - 7.13 X 4152
Mn-Ni MnNi3 rt Cu3Au,cP4,221 Pm-3m 0.3598,0.3598,0.3598,90,90,90 close-packed structure - 8.24 X 55186
Mn-Ni Mn0.7 Ni0.3 rt Cu,cF4,225 Fm-3m 0.3698,0.3698,0.3698,90,90,90 close-packed structure - 7.36 X 10039
Mn-Ni Mn0.861 Ni0.139 lt In,tI2,139 I4/mmm 0.26361,0.26361,0.366,90,90,90 close-packed structure - 7.24 X 10039
Mn-Ni Mn0.87 Ni0.13 ht1 Mn,cP20,213 P4132 0.6354,0.6354,0.6354,90,90,90 - - 7.18 A 1736
Mn-Np NpMn2 MgCu2,cF24,227 Fd-3m 0.723,0.723,0.723,90,90,90 Friauf-Laves phase - 12.19 X 9263
Mn-O MnO hex ZnO,hP4,186 P63mc 0.33718,0.33718,0.53854,90,90,120 adamantane structure - 4.44 X 58468
Mn-O MnO lt NiO,hR6,166 R-3m 0.31536,0.31536,0.76028,90,90,120 rocksalt family - 5.40 X 21452
Mn-O MnO rt NaCl,cF8,225 Fm-3m 0.4446,0.4446,0.4446,90,90,90 manganosite green olive 5.36 X 12920
Mn-O MnO2 cub Ti2C,cF48,227 Fd-3m 0.80407,0.80407,0.80407,90,90,90 - brown dark 4.44 X 34238
Mn-O MnO2 hp1 CaCl2,oP6,58 Pnnm 0.4312,0.4437,0.2862,90,90,90 - - 5.27 X 30483
Mn-O MnO2 hp2 *,c**,* - 0.4484,0.4484,0.4484,90,90,90 - - - N 30483
Mn-O MnO2 ram MnO2,oP12,62 Pnma 0.93229,0.28482,0.44533,90,90,90 ramsdellite - 4.88 X 29665
Mn-O MnO2 rt tet1 TiO2 ,tP6,136 P42/mnm 0.44041,0.44041,0.28765,90,90,90 pyrolusite - 5.18 X 27070
Mn-O MnO2 rt tet2 MnO2,tI24,87 I4/m 0.97876,0.97876,0.2865,90,90,90 - - 4.21 X 26514
Mn-O Mn0.5 O hp NiAs,hP4,194 P63/mmc 0.2786,0.2786,0.4412,90,90,120 AlB2 family - 4.87 X 382
Mn-O Mn2 O3 rhom Al2O3,hR30,167 R-3c 0.504,0.504,1.412,90,90,120 - - 5.06 A 13437
Mn-O Mn2 O3 rt cub (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 0.94173,0.94173,0.94173,90,90,90 - - 5.02 X 49149
Mn-O Mn2 O3 rt orth Mn2 O3,oP80,61 Pbca 0.94047,0.94233,0.94157,90,90,90 bixbyite - 5.03 X 5712
Mn-O Mn2 O7 Mn2 O7,mP72,14 P121/c1 0.67956,1.6687,0.9454,90,100.20,90 - green 2.79 X 21925
Mn-O Mn3 O4 hp Mn3 O4,oP28,57 Pbcm 0.3024,0.97996,0.95564,90,90,90 - - 5.37 X 23230
Mn-O Mn3 O4 ht Fe3O4,cF56,227 Fd-3m 0.8524,0.8524,0.8524,90,90,90 spinel family - 4.91 A 57318
Mn-O Mn3 O4 rt Mn3 O4,tI28,141 I41/amd 0.5765,0.5765,0.9442,90,90,90 hausmannite - 4.84 X 20493
Mn-O Mn5 O8 rt Mn5 O8,mS26,12 C12/m1 1.0347,0.5724,0.4852,90,109.42,90 - black 4.93 X 3522
Mn-Os Mn0.87 Os0.13 ht1 Mn,cP20,213 P4132 0.64,0.64,0.64,90,90,90 - - 9.19 A 37408
Mn-P MnP FeAs,oP8,62 Pnma 0.5259,0.3173,0.592,90,90,90 AlB2 family - 5.78 X 18763
Mn-P MnP 4 2-lay MnP 4,aP10,2 P-1 0.5104,0.5836,0.5861,69.17,64.19,86.18 - - 4.07 X 13567
Mn-P MnP 4 6-lay MnP 4,aP30,2 P-1 0.5108,0.5847,1.6347,89.21,84.85,64.34 - black 4.07 X 14019
Mn-P MnP 4 hp 8-lay MnP 4,mS80,15 C12/c1 1.0513,0.50944,2.1804,90,94.71,90 - black 4.08 X 8845
Mn-P Mn2 P Fe2P,hP9,189 P-62m 0.6081,0.6081,0.346,90,90,120 Fe2P family - 6.33 X 1635
126 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Mn-P Mn3P Ni3P,tI32,82 I-4 0.9181,0.9181,0.4568,90,90,90 - - 6.76 X 1635


Mn-Pd MnPd ht cub CsCl,cP2,221 Pm-3m 0.3156,0.3156,0.3156,90,90,90 b.c.c. family - 8.52 X 3700
Mn-Pd MnPd3 rt ZrAl3,tI16,139 I4/mmm 0.39036,0.39036,1.5624,90,90,90 close-packed structure - 10.44 X 25453
Mn-Pd Mn0.3Pd0.7 ht Cu,cF4,225 Fm-3m 0.3912,0.3912,0.3912,90,90,90 close-packed structure - 10.09 X 26050
Mn-Pd Mn0.916Pd1.084 ht tet CuAu,tP2,123 P4/mmm 0.28765,0.28765,0.3625,90,90,90 close-packed structure - 9.17 X 57061
Mn-Pd Mn0.92Pd3.08 ht1 Cu3Au,cP4,221 Pm-3m 0.3902,0.3902,0.3902,90,90,90 close-packed structure - 10.57 X 46651
Mn-Pd Mn3Pd5 rt Pt5Ga3,oS16,65 Cmmm 0.7263,0.8107,0.4053,90,90,90 close-packed structure - 9.70 X 57061
Mn-Pd Mn7Pd9 rt Mn7Pd9,tI32,139 I4/mmm 0.8112,0.8112,0.724,90,90,90 close-packed structure - 9.36 X 3700
Mn-Pr PrMn2 lt *,m**,* - 0.5543,0.9011,0.9788,90,90.2,90 - - - N 18302
Mn-Pr PrMn2 rt MgZn2,hP12,194 P63 /mmc 0.559,0.559,0.9106,90,90,120 Friauf-Laves phase - 6.76 A 18302
Mn-Pr Pr0.33 Mn0.67 rt Mn,cI58,217 I-43m 0.8902,0.8902,0.8902,90,90,90 - - 11.37 A 6009
Mn-Pr Pr6Mn23 ht Th6Mn23,cF116,225 Fm-3m 1.2725,1.2725,1.2725,90,90,90 - - 6.80 A 18082
Mn-Pt MnPt rt CuAu,tP2,123 P4/mmm 0.28249,0.28249,0.3675,90,90,90 close-packed structure - 14.16 X 20265
Mn-Pt MnPt3 rt Cu3Au,cP4,221 Pm-3m 0.387,0.387,0.387,90,90,90 close-packed structure - 18.34 X 31909
Mn-Pt Mn0.25Pt0.75 Cu,cF4,225 Fm-3m 0.3908,0.3908,0.3908,90,90,90 close-packed structure - 17.81 X 19197
Mn-Pt Mn0.5Pt0.5 ht Cu,cF4,225 Fm-3m 0.387,0.387,0.387,90,90,90 close-packed structure - 14.33 X 2233
Mn-Pt Mn3.07Pt0.93 rt Cu3Au,cP4,221 Pm-3m 0.3872,0.3872,0.3872,90,90,90 close-packed structure - 10.01 X 4077
Mn-Pu PuMn2 MgCu2,cF24,227 Fd-3m 0.729,0.729,0.729,90,90,90 Friauf-Laves phase - 12.13 X 765
Mn-Re Mn0.47 Re0.53 Mg,hP2,194 P63 /mmc 0.2753,0.2753,0.4447,90,90,120 close-packed structure - 14.17 X 4178
Mn-Re Mn0.55 Re0.45 rt Mn,cI58,217 I-43m 0.9152,0.9152,0.9152,90,90,90 - - 14.32 A 4189
Mn-Re Mn0.55 Re0.45 tet (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9201,0.9201,0.4802,90,90,90 Frank-Kasper phase - 13.97 A 4178
Mn-Re Mn0.95 Re0.05 rt Mn,cI58,217 I-43m 0.8938,0.8938,0.8938,90,90,90 - - 8.30 A 4189
Mn-Rh MnRh lt CuAu,tP2,123 P4/mmm 0.278,0.278,0.356,90,90,90 close-packed structure - 9.53 X 1910
Mn-Rh MnRh rt CsCl,cP2,221 Pm-3m 0.3044,0.3044,0.3044,90,90,90 b.c.c. family - 9.29 X 1910
Mn-Rh Mn0.3 Rh0.7 Cu,cF4,225 Fm-3m 0.383,0.383,0.383,90,90,90 close-packed structure - 10.47 X 721
Mn-Rh Mn3Rh rt Cu3Au,cP4,221 Pm-3m 0.3813,0.3813,0.3813,90,90,90 close-packed structure - 8.02 X 20473
Mn-Ru Mn0.5 Ru0.5 Mg,hP2,194 P63 /mmc 0.2666,0.2666,0.4267,90,90,120 close-packed structure - 9.86 X 721
Mn-Ru Mn0.88 Ru0.12 ht1 Mn,cP20,213 P4132 0.6425,0.6425,0.6425,90,90,90 - - 7.57 A 38886
Mn-S MnS ht1 ZnS,cF8,216 F-43m 0.5601,0.5601,0.5601,90,90,90 browneite orange 3.29 X 13431
Mn-S MnS ht2 ZnO,hP4,186 P63 mc 0.3986,0.3986,0.64457,90,90,120 adamantane structure red 3.26 A 36584
Mn-S MnS rt NaCl,cF8,225 Fm-3m 0.52245,0.52245,0.52245,90,90,90 alabandite green dark 4.05 X 25229
Mn-S MnS2 hp FeS2,oP6,58 Pnnm 0.443,0.55,0.342,90,90,90 pyrite-marcasite family - 4.75 A 18191
Mn-S MnS2 FeS2,cP12,205 Pa-3 0.6104,0.6104,0.6104,90,90,90 hauerite green 3.48 X 26895
Mn-Sb MnSb NiAs,hP4,194 P63 /mmc 0.413,0.413,0.577,90,90,120 AlB2 family - 6.88 X 6217
Mn-Sb MnSb2 hp FeAs2,oP6,58 Pnnm 0.603,0.688,0.331,90,90,90 pyrite-marcasite family - 7.22 A 54415
Mn-Sb Mn0.2 Sb0.8 m Po,hR3,166 R-3m 0.42603,0.42603,0.56899,90,90,120 - - 6.04 X 6915
Mn-Sb Mn1.09 Sb Co1.75 Ge,hP6,194 P63 /mmc 0.417,0.417,0.5755,90,90,120 AlB2 family - 6.96 X 16238
Mn-Sb Mn2Sb Cu2Sb,tP6,129 P4/nmm 0.4082,0.4082,0.6558,90,90,90 - - 7.04 X 47707
Mn-Sb Mn3Sb hp Cu3Au,cP4,221 Pm-3m 0.40017,0.40017,0.40017,90,90,90 close-packed structure gray 7.43 X 41625
Mn-Sc ScMn2 MgZn2,hP12,194 P63 /mmc 0.503,0.503,0.819,90,90,120 Friauf-Laves phase - 5.73 X 2178
Mn-Se MnSe lt NiAs,hP4,194 P63 /mmc 0.3827,0.3827,0.6342,90,90,120 AlB2 family - 5.53 X 13384
Mn-Se MnSe m cub ZnS,cF8,216 F-43m 0.582,0.582,0.582,90,90,90 adamantane structure - 4.51 X 160
Mn-Se MnSe m hex ZnO,hP4,186 P63 mc 0.412,0.412,0.672,90,90,120 adamantane structure - 4.50 A 160
Mn-Se MnSe rt NaCl,cF8,225 Fm-3m 0.5462,0.5462,0.5462,90,90,90 rocksalt family black gray 5.46 X 6883
Mn-Se MnSe2 rt FeS2,cP12,205 Pa-3 0.6417,0.6417,0.6417,90,90,90 pyrite-marcasite family - 5.35 X 1133
Mn-Si MnSi rt FeSi,cP8,198 P213 0.45559,0.45559,0.45559,90,90,90 brownleeite - 5.83 X 25267
Mn-Si MnSix Mn,cP20,213 P4132 0.62869,0.62869,0.62869,90,90,90 - - 7.34 A 20406
Mn-Si Mn0.855 Si0.145 rt (Cr0.16Mo0.38 Co0.46 ),hR159,148 R-3 1.08705,1.08705,1.91799,90,90,120 Frank-Kasper phase - 6.87 X 11329
Mn-Si Mn11Si19 Mn11Si19,tP120,118 P-4n2 0.552,0.552,4.82,90,90,90 chimney-ladder structure - 5.15 X 2306
Mn-Si Mn11.15 Si1.85 rt W6Fe7,hR39,166 R-3m 0.47,0.47,2.561,90,90,120 Frank-Kasper phase - 6.76 X 2656
Mn-Si Mn15Si26 Mn15Si26,tI164,122 I-42d 0.5531,0.5531,6.5311,90,90,90 chimney-ladder structure - 5.17 X 3374
Mn-Si Mn25.18 Si5.82 Mn19(Mn0.62 Si0.38)10Si2,oI186,71 Immm 0.46556,1.6992,2.8634,90,90,90 Frank-Kasper phase - 6.80 X 5680
Mn-Si Mn27Si47 Mn27Si47,tP296,118 P-4n2 0.553,0.553,11.79,90,90,90 chimney-ladder structure - 5.16 X 7667
Mn-Si Mn3Si ht BiF3,cF16,225 Fm-3m 0.542,0.542,0.542,90,90,90 b.c.c. family - 8.05 X 58511
Mn-Si Mn4Si7 Mn4Si7,tP44,116 P-4c2 0.55259,0.55259,1.75156,90,90,90 chimney-ladder structure - 5.17 X 41730
Mn-Si Mn44.5 Si10.5 (Fe) Mn40(Mn0.5 Si0.5)9Si6,mS220,5 C121 1.3362,1.1645,1.7468,90,90.53,90 Frank-Kasper phase - 6.70 X 10495
Mn-Si Mn5Si2 rt Mn5Si2,tP56,92 P41212 0.89097,0.89097,0.87153,90,90,90 - - 6.35 X 9591
Mn-Si Mn5Si3 lt1 Mn5Si3,oS32,63 Cmcm 1.18956,0.6904,0.47959,90,90,90 - - 6.05 X 58700
Mn-Si Mn5Si3 lt2 Mn5Si3,mP16,11 P121/m1 0.68726,0.48048,0.68924,90,119.895,90 - - 6.04 X 58700
Mn-Si Mn5Si3 rt Mn5Si3,hP16,193 P63 /mcm 0.68971,0.68971,0.48075,90,90,120 mavlyanovite gray 6.02 X 53052
Mn-Sm SmMn2 lt *,o**,* - 0.5461,0.8842,0.9533,90,90,90 - - - N 18302
Mn-Sm SmMn2 rt MgZn2,hP12,194 P63 /mmc 0.5493,0.5493,0.8945,90,90,120 Friauf-Laves phase - 7.40 A 18302
Mn-Sm Sm6Mn23 Th6Mn23,cF116,225 Fm-3m 1.257,1.257,1.257,90,90,90 - - 7.24 X 13400
Mn-Sn MnSn2 CuAl2,tI12,140 I4/mcm 0.6671,0.6671,0.5443,90,90,90 - black 8.02 X 53903
Mn-Sn Mn0.9 Sn0.1 ht1 Mn,cP20,213 P4132 0.6511,0.6511,0.6511,90,90,90 - - 7.38 A 4276
Mn-Sn Mn1.64 Sn0.94 ht Co1.75 Ge,hP6,194 P63 /mmc 0.4398,0.4398,0.5519,90,90,120 AlB2 family - 7.24 X 33237
Mn-Sn Mn3Sn2 rt Ni3Sn2,oP20,62 Pnma 0.75578,0.55007,0.8584,90,90,90 AlB2 family - 7.49 X 33237
Mn-Sn Mn3.078 Sn0.922 Mg3Cd,hP8,194 P63 /mmc 0.5665,0.5665,0.4531,90,90,120 close-packed structure - 7.35 X 15405
Mn-Sn Mn8Sn5 rt Mn8Sn5,oP52,62 Pnma 0.76003,0.55247,2.19114,90,90,90 - gray 7.46 X 32856
Mn-Ta TaMn2 MgZn2,hP12,194 P63 /mmc 0.4864,0.4864,0.7943,90,90,120 Friauf-Laves phase - 11.87 A 22428
Mn-Tb TbMn12 ThMn12,tI26,139 I4/mmm 0.8551,0.8551,0.473,90,90,90 CaCu5-Zr4Al3 - 7.86 X 49345
Mn-Tb TbMn2 hp MgZn2,hP12,194 P63 /mmc 0.54,0.54,0.88,90,90,120 Friauf-Laves phase - 8.03 A 30735
Mn-Tb TbMn2 ht TbFe2,hR18,166 R-3m 0.54096,0.54096,1.32214,90,90,120 Friauf-Laves phase - 7.99 A 57356
Mn-Tb TbMn2 rt MgCu2,cF24,227 Fd-3m 0.7643,0.7643,0.7643,90,90,90 Friauf-Laves phase - 8.00 X 26212
Mn-Tb Tb6Mn23 Th6Mn23,cF116,225 Fm-3m 1.2447,1.2447,1.2447,90,90,90 - - 7.64 A 8687
Mn-Tc Mn0.4 Tc0.6 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.915,0.915,0.48,90,90,90 Frank-Kasper phase - 10.01 A 1682
Mn-Te MnTe hp FeAs,oP8,62 Pnma 0.5773,0.3763,0.6119,90,90,90 AlB2 family - 9.12 X 20322
Mn-Te MnTe ht NaCl,cF8,225 Fm-3m 0.5875,0.5875,0.5875,90,90,90 rocksalt family - 5.98 X 12395
Handbook of Inorganic Substances – Edition 2015 : Data 127

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Mn-Te MnTe rt NiAs,hP4,194 P63/mmc 0.4126,0.4126,0.6724,90,90,120 AlB2 family gray 6.12 X 31677
Mn-Te MnTe 2 hp cub FeS2 ,cP12,205 Pa-3 0.6176,0.6176,0.6176,90,90,90 pyrite-marcasite family - 8.74 A 30439
Mn-Te MnTe 2 hp orth FeS2 ,oP6,58 Pnnm 0.5272,0.6144,0.3795,90,90,90 pyrite-marcasite family - 8.38 A 30439
Mn-Te MnTe 2 FeS2 ,cP12,205 Pa-3 0.6943,0.6943,0.6943,90,90,90 pyrite-marcasite family - 6.16 X 1133
Mn-Th ThMn12 ThMn12,tI26,139 I4/mmm 0.874,0.874,0.495,90,90,90 CaCu5-Zr4Al3 - 7.83 X 422
Mn-Th ThMn2 MgZn2,hP12,194 P63/mmc 0.5464,0.5464,0.8842,90,90,120 Friauf-Laves phase - 9.93 X 20285
Mn-Th Th6Mn23 Th6Mn23,cF116,225 Fm-3m 1.2523,1.2523,1.2523,90,90,90 - - 8.98 X 422
Mn-Ti TiMn2 MgZn2,hP12,194 P63/mmc 0.48333,0.48333,0.79384,90,90,120 Friauf-Laves phase - 6.53 X 19461
Mn-Ti Ti0.08 Mn0.92 Mn,cI58,217 I-43m 0.8926,0.8926,0.8926,90,90,90 - - 7.36 A 52472
Mn-Ti Ti0.17 Mn0.83 ht (Cr0.16Mo0.38 Co0.46 ),hR159,148 R-3 1.1007,1.1007,1.94411,90,90,120 Frank-Kasper phase - 6.96 X 59649
Mn-Ti Ti0.47 Mn0.53 *,t**,* - 0.8159,0.8159,1.2767,90,90,90 - - - N 52472
Mn-Ti Ti0.5 Mn0.5 rt (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.887,0.887,0.455,90,90,90 Frank-Kasper phase - 7.16 A 38845
Mn-Ti Ti0.85 Mn0.15 ht W,cI2,229 Im-3m 0.3211,0.3211,0.3211,90,90,90 b.c.c. family - 4.91 X 52472
Mn-Ti Ti21 Mn25 rt Zr21 Re25,hR276,167 R-3c 2.3596,2.3596,0.8035,90,90,120 - - 6.12 A 18808
Mn-Ti Ti5Mn3 Mn5 Si3,hP16,193 P63/mcm 0.741,0.741,0.5131,90,90,120 - - 5.50 A 48562
Mn-Tm TmMn12 ThMn12,tI26,139 I4/mmm 0.854,0.854,0.473,90,90,90 CaCu5-Zr4Al3 - 7.97 A 2929
Mn-Tm TmMn2 MgZn2,hP12,194 P63/mmc 0.524,0.524,0.856,90,90,120 Friauf-Laves phase - 9.10 A 39328
Mn-Tm Tm6 Mn23 Th6Mn23,cF116,225 Fm-3m 1.2242,1.2242,1.2242,90,90,90 - - 8.24 A 18197
Mn-U UMn2 lt1 TbFe 2,hR18,166 R-3m 0.5078,0.5078,1.2246,90,90,120 Friauf-Laves phase - 12.68 A 20202
Mn-U UMn2 lt2 UMn2,oI12,74 Imma 0.48163,0.52478,0.71820,90,90,90 Friauf-Laves phase - 12.73 X 18065
Mn-U UMn2 rt MgCu2,cF24,227 Fd-3m 0.71595,0.71595,0.71595,90,90,90 Friauf-Laves phase - 12.59 X 18065
Mn-U U6Mn U6Mn,tI28,140 I4/mcm 1.029,1.029,0.524,90,90,90 - - 17.76 X 332
Mn-V VMn rt CsCl,cP2,221 Pm-3m 0.291,0.291,0.291,90,90,90 b.c.c. family - 7.14 X 9390
Mn-V V0.02 Mn0.98 ht1 Mn,cP20,213 P4132 0.6326,0.6326,0.6326,90,90,90 - - 7.20 A 53401
Mn-V V0.05 Mn0.95 rt Mn,cI58,217 I-43m 0.8937,0.8937,0.8937,90,90,90 - - 7.39 A 53401
Mn-V V0.1 Mn0.9 ht1 Mn,cI58,217 I-43m 0.9058,0.9058,0.9058,90,90,90 - - 7.07 A 6160
Mn-V V0.1 Mn0.9 ht2 Mn,cP20,213 P4132 0.6453,0.6453,0.6453,90,90,90 - - 6.74 A 6160
Mn-V V0.204 Mn0.796 rt (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.896,0.896,0.4621,90,90,90 Frank-Kasper phase - 7.27 A 6160
Mn-V V0.5 Mn0.5 W,cI2,229 Im-3m 0.292,0.292,0.292,90,90,90 b.c.c. family - 7.06 X 9390
Mn-Y YMn12 ThMn12,tI26,139 I4/mmm 0.8597,0.8597,0.47637,90,90,90 CaCu5-Zr4Al3 - 7.06 X 16931
Mn-Y YMn2 hp-ht MgZn2,hP12,194 P63/mmc 0.54086,0.54086,0.88341,90,90,120 Friauf-Laves phase - 5.90 X 56245
Mn-Y YMn2 lt1 YMn2,tI12,141 I41/amd 0.5473,0.5473,0.77001,90,90,90 - - 5.72 X 24916
Mn-Y YMn2 rt MgCu2,cF24,227 Fd-3m 0.76806,0.76806,0.76806,90,90,90 Friauf-Laves phase - 5.83 X 56245
Mn-Y YMn4 lt *,tI60,139 I4/mmm 0.8808,0.8808,1.2521,90,90,90 - - - N 1766
Mn-Y YMn5 *,o**,* - 0.305,0.434,0.712,90,90,90 - - - N 1291
Mn-Y Y6Mn23 Th6Mn23,cF116,225 Fm-3m 1.2403,1.2403,1.2403,90,90,90 - - 6.26 X 16175
Mn-Yb YbMn2 hp MgZn2,hP12,194 P63/mmc 0.5242,0.5242,0.8582,90,90,120 Friauf-Laves phase - 9.20 A 30745
Mn-Yb Yb0.03 Mn0.97 rt Mn,cI58,217 I-43m 0.896,0.896,0.896,90,90,90 - - 7.83 X 7746
Mn-Yb Yb2Mn17 hp Th2Ni17,hP38,194 P63/mmc 0.848,0.848,0.789,90,90,120 CaCu5-Zr4Al3 - 8.65 A 16139
Mn-Yb Yb6Mn23 hp Th6Mn23,cF116,225 Fm-3m 1.2189,1.2189,1.2189,90,90,90 - - 8.44 A 16139
Mn-Yb Yb6Mn4.5 hp Ho6Co 4.5 ,hP22,176 P63/m 1.1336,1.1336,0.4029,90,90,120 - - 9.52 A 16139
Mn-Zn ZnMn rt CsCl,cP2,221 Pm-3m 0.3071,0.3071,0.3071,90,90,90 b.c.c. family - 6.90 X 7022
Mn-Zn Zn0.15 Mn0.85 rt Cu,cF4,225 Fm-3m 0.377,0.377,0.377,90,90,90 close-packed structure - 7.00 X 6144
Mn-Zn Zn0.4 Mn0.6 ht1 Mn,cP20,213 P4132 0.648,0.648,0.648,90,90,90 - - 7.22 A 7022
Mn-Zn Zn0.6 Mn3.4 rt SrPb3,tP4,123 P4/mmm 0.381,0.381,0.364,90,90,90 close-packed structure - 7.10 X 6144
Mn-Zn Zn0.7 Mn0.3 ht Mg,hP2,194 P63/mmc 0.27584,0.27584,0.44456,90,90,120 close-packed structure - 7.06 X 5459
Mn-Zn Zn0.988Mn0.012 Mg,hP2,194 P63/mmc 0.26681,0.26681,0.49561,90,90,120 close-packed structure - 7.09 X 5459
Mn-Zn Zn10.5 Mn2.5 Zn9(Zn0.5 Fe0.5)2Fe2,cI52,217 I-43m 0.91605,0.91605,0.91605,90,90,90 γ-brass - 7.12 A 54500
Mn-Zn Zn13 Mn Zn13 Co,mS28,12 C12/m1 1.08441,0.76626,0.5134,90,100.67,90 - - 7.17 X 1606
Mn-Zn Zn2.92 Mn1.08 lt SrPb3,tP4,123 P4/mmm 0.392,0.392,0.371,90,90,90 close-packed structure - 7.29 X 2290
Mn-Zn Zn2.92 Mn1.08 rt Cu3Au,cP4,221 Pm-3m 0.386,0.386,0.386,90,90,90 close-packed structure - 7.23 X 2290
Mn-Zr ZrMn stab? *,c**,* - 1.1295,1.1295,1.1295,90,90,90 - - - N 40282
Mn-Zr ZrMn2 rt MgZn2,hP12,194 P63/mmc 0.50293,0.50293,0.82669,90,90,120 Friauf-Laves phase - 7.38 X 47375
Mn-Zr Zr2Mn stab Ti2Ni,cF96,227 Fd-3m 1.1999,1.1999,1.1999,90,90,90 - - 7.30 A 3743
Mo-N MoN hex1 WC,hP2,187 P-6m2 0.287,0.287,0.282,90,90,120 AlB2 family - 9.08 X 45788
Mo-N MoN hex2 NiAs,hP4,194 P63/mmc 0.287,0.287,0.562,90,90,120 AlB2 family - 9.11 X 45788
Mo-N MoN ht2 Nb0.92 S,hP16,186 P63mc 0.57366,0.57366,0.56188,90,90,120 AlB2 family - 9.12 X 43356
Mo-N MoN trig MoN-b,hP16,164 P-3m1 0.5665,0.5665,0.552,90,90,120 - - 9.52 X 1521
Mo-N MoN0.5 ht1 NaCl,cF8,225 Fm-3m 0.41613,0.41613,0.41613,90,90,90 rocksalt family - 9.49 X 49279
Mo-N Mo0.75 N0.50 tf Mo0.75 N0.50 ,cP8,221 Pm-3m 0.4165,0.4165,0.4165,90,90,90 rocksalt family - 7.26 X 1303
Mo-N Mo1.67 N2 tf Nb1.35 S2,hP8,194 P63/mmc 0.286,0.286,1.12,90,90,120 AlB2 family - 7.88 X 2358
Mo-N Mo2 N *,o**,* - 0.404,0.4131,0.4208,90,90,90 - - - N 47383
Mo-N Mo2 N0.75 rt Mo2 N0.75 ,tI12,141 I41/amd 0.4200,0.4200,0.8010,90,90,90 - - 9.51 X 864
Mo-N Mo5 N6 Mo5 N6,hP24,176 P63/m 0.48924,0.48924,1.10643,90,90,120 - - 8.16 X 47009
Mo-Nb Nb0.484 Mo0.516 W,cI2,229 Im-3m 0.32,0.32,0.32,90,90,90 b.c.c. family - 9.58 X 6716
Mo-Ni MoNi3 rt Cu3Ti,oP8,59 Pmmn 0.4224,0.5064,0.4448,90,90,90 close-packed structure - 9.50 X 1151
Mo-Ni MoNi4 rt MoNi4,tI10,87 I4/m 0.5720,0.5720,0.3564,90,90,90 close-packed structure - 9.42 X 244
Mo-Ni Mo0.09 Ni0.91 Cu,cF4,225 Fm-3m 0.3565,0.3565,0.3565,90,90,90 close-packed structure - 9.10 X 17833
Mo-Ni Mo0.35 Ni0.65 tf Mg,hP2,194 P63/mmc 0.325,0.325,0.521,90,90,120 close-packed structure - 5.00 X 16444
Mo-Ni Mo0.84 Ni0.16 m1 Mg,hP2,194 P63/mmc 0.294,0.294,0.479,90,90,120 close-packed structure - 8.33 X 30358
Mo-Ni Mo0.84 Ni0.16 m2 Cu,cF4,225 Fm-3m 0.422,0.422,0.422,90,90,90 close-packed structure - 7.95 X 30358
Mo-Ni Mo0.98 Ni0.02 W,cI2,229 Im-3m 0.31441,0.31441,0.31441,90,90,90 b.c.c. family - 10.17 X 2240
Mo-Ni Mo7 Ni7 Mo3(Mo0.8 Ni0.2)5Ni6 ,oP56,19 P212121 0.8852,0.9108,0.9108,90,90,90 Frank-Kasper phase - 9.79 X 1840
Mo-O MoO2 mon VO2 ,mP12,14 P121/c1 0.55385,0.486,0.5628,90,119.701,90 tugarinovite black 6.46 X 18255
Mo-O MoO2 tet TiO2 ,tP6,136 P42/mnm 0.48473,0.48473,0.28136,90,90,90 - black 6.43 X 43605
Mo-O MoO3 hp-ht MoO3,mP8,11 P121/m1 0.3954,0.3687,0.7095,90,103.75,90 - white 4.76 X 25015
Mo-O MoO3 hp2 MoO3,mP16,14 P121/c1 0.5749,0.4804,0.6095,90,116.73,90 - - 6.36 X 52569
Mo-O MoO3 m1 MoO3,mP22,14 P121/c1 0.71228,0.5366,0.55665,90,92.01,90 - green 4.50 X 25068
128 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Mo-O MoO3 m2 WO3,mP32,14 P121/c1 0.7415,0.7433,1.06484,90,134.045,90 - yellow 4.53 X 21653


Mo-O MoO3 m3 *,hP*,176 P63 /m 1.0619,1.0619,0.3719,90,90,120 - - - N 30629
Mo-O MoO3 MoO3,oP16,62 Pnma 1.386,0.36971,0.39624,90,90,90 molybdite white 4.71 X 53164
Mo-O Mo10O29 *,aP156,2 P-1 0.8097,1.1744,2.20325,96.369,92.796,109.962 - - - N 6364
Mo-O Mo11O32 *,aP172,2 P-1 0.8097,1.1744,2.43905,95.194,95.401,109.962 - - - N 6364
Mo-O Mo17O47 Mo17O47,oP128,32 Pba2 1.9632,2.1615,0.39515,90,90,90 - black blue 4.72 X 1211
Mo-O Mo19O55 *,aP148,2 P-1 0.8097,1.1744,2.13064,101.454,93.488,109.962 - - - N 6364
Mo-O Mo2O3 tf *,c**,* - 0.684,0.684,0.684,90,90,90 - - - N 7417
Mo-O Mo2.25 O0.75 BiF3,cF16,225 Fm-3m 0.5549,0.5549,0.5549,90,90,90 b.c.c. family - 8.86 X 594
Mo-O Mo21O61 *,aP164,2 P-1 0.8097,1.1744,2.2941,89.724,88.474,70.038 - - - N 6364
Mo-O Mo4O11 ht Mo4O11,oP60,33 Pna21 2.40723,0.66483,0.53569,90,90,90 - black 4.34 X 35489
Mo-O Mo4O11 rt Mo4O11,mP60,14 P121/c1 0.6695,0.544,2.4573,90,94.31,90 - black red 4.17 X 31088
Mo-O Mo5O14 rt Mo5O14,tP192,127 P4/mbm 2.300,2.300,0.3937,90,90,90 - - 4.49 X 2140
Mo-O Mo8O23 ht Mo8O23,mP62,13 P12/c1 1.3384,0.40616,1.6883,90,106.27,90 - black blue 4.28 X 20334
Mo-O Mo8O23 lt Mo8O23,mP124,7 P1c1 1.339,0.8062,1.682,90,106.02,90 - - 4.32 X 20334
Mo-O Mo8O23 rt Mo8O23,mP62,13 P12/c1 1.3382,0.40519,1.6877,90,106.197,90 - - 4.29 X 23612
Mo-O Mo9O26 ht1 Mo9O26,mS280,15 C12/c1 2.9194,0.8083,1.6816,90,95.47,90 - - 4.30 X 20323
Mo-O Mo9O26 ht2 Mo9O26,mP70,13 P12/c1 1.445,0.403,1.675,90,95.,90 - black blue 4.37 X 290
Mo-O Mo9O26 rt Mo9O26,aP140,2 P-1 0.8145,1.1890,1.9659,95.47,90.38,109.97 - black 4.78 X 2141
Mo-Os Mo0.4Os0.6 Mg,hP2,194 P63 /mmc 0.2735,0.2735,0.4322,90,90,120 close-packed structure - 18.09 X 1680
Mo-Os Mo0.65 Os0.35 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9631,0.9631,0.4957,90,90,90 Frank-Kasper phase - 13.97 X 2081
Mo-Os Mo0.86 Os0.14 W,cI2,229 Im-3m 0.3136,0.3136,0.3136,90,90,90 b.c.c. family - 11.75 X 1680
Mo-Os Mo3Os rt Cr3Si,cP8,223 Pm-3n 0.49689,0.49689,0.49689,90,90,90 Frank-Kasper phase gray silver 12.94 X 3823
Mo-P MoP WC,hP2,187 P-6m2 0.3223,0.3223,0.31915,90,90,120 AlB2 family black 7.34 X 27436
Mo-P MoP 2 MoP 2,oS12,36 Cmc21 0.31442,1.11801,0.49816,90,90,90 - - 5.99 X 16363
Mo-P MoP 4 hp-ht CrP4,mS20,15 C12/c1 0.5313,1.1139,0.582,90,110.64,90 - - 4.53 A 6404
Mo-P Mo3P V3S,tI32,121 I-42m 0.9794,0.9794,0.4827,90,90,90 - black 9.15 X 2522
Mo-P Mo4P 3 ht Mo4P 3,oP56,62 Pnma 1.24316,0.31581,2.04468,90,90,90 - - 7.89 X 22099
Mo-P Mo8P 5 ht Mo8P 5,mP13,6 P1m1 0.65369,0.32088,0.93992,90,109.592,90 - - 8.25 X 6511
Mo-Pd MoPd2 rt MoPt2,oI6,71 Immm 0.275,0.389,0.825,90,90,90 close-packed structure - 11.62 A 2430
Mo-Pd Mo0.31Pd0.69 Cu,cF4,225 Fm-3m 0.358,0.358,0.358,90,90,90 close-packed structure - 14.93 X 57009
Mo-Pd Mo0.33Pd0.67 rt W,cI2,229 Im-3m 0.413,0.413,0.413,90,90,90 b.c.c. family - 4.85 X 57009
Mo-Pd Mo0.5Pd0.5 ht Mg,hP2,194 P63 /mmc 0.2777,0.2777,0.449,90,90,120 close-packed structure - 11.21 X 2236
Mo-Pd Mo0.95Pd0.05 W,cI2,229 Im-3m 0.3144,0.3144,0.3144,90,90,90 b.c.c. family - 10.31 X 984
Mo-Pt MoPt rt AuCd,oP4,51 Pmma 0.448,0.2735,0.491,90,90,90 close-packed structure - 16.07 A 7484
Mo-Pt MoPt2 rt MoPt2,oI6,71 Immm 0.2766,0.3938,0.8297,90,90,90 close-packed structure - 17.86 X 794
Mo-Pt Mo0.25Pt0.75 Cu,cF4,225 Fm-3m 0.3912,0.3912,0.3912,90,90,90 close-packed structure - 18.90 X 51464
Mo-Pt Mo0.25Pt0.75 In,tI2,139 I4/mmm 0.27521,0.27521,0.3936,90,90,90 close-packed structure - 18.97 X 2232
Mo-Pt Mo0.6Pt0.4 ht2 Mg,hP2,194 P63 /mmc 0.2795,0.2795,0.4488,90,90,120 close-packed structure - 14.83 X 7484
Mo-Pt Mo0.98Pt0.02 W,cI2,229 Im-3m 0.3144,0.3144,0.3144,90,90,90 b.c.c. family - 10.46 X 51464
Mo-Pt Mo2.4Pt1.6 ht1 Mg3Cd,hP8,194 P63 /mmc 0.556,0.556,0.449,90,90,120 close-packed structure - 14.99 A 51464
Mo-Pt Mo3.2Pt0.8 ht Cr3Si,cP8,223 Pm-3n 0.49878,0.49878,0.49878,90,90,90 Frank-Kasper phase - 12.39 X 3823
Mo-Re Mo0.08 Re0.92 Mg,hP2,194 P63 /mmc 0.27572,0.27572,0.4456,90,90,120 close-packed structure - 20.26 X 4835
Mo-Re Mo0.249 Re0.751 rt Mn,cI58,217 I-43m 0.959,0.959,0.959,90,90,90 - - 17.88 A 51928
Mo-Re Mo0.45 Re0.55 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9601,0.9601,0.4985,90,90,90 Frank-Kasper phase - 15.78 X 1831
Mo-Re Mo0.85 Re0.15 Cu,cF4,225 Fm-3m 0.37,0.37,0.37,90,90,90 close-packed structure - 14.36 X 533
Mo-Re Mo0.92 Re0.08 W,cI2,229 Im-3m 0.3134,0.3134,0.3134,90,90,90 b.c.c. family - 11.13 X 5969
Mo-Re Mo2.8Re1.2 m Cr3Si,cP8,223 Pm-3n 0.4982,0.4982,0.4982,90,90,90 Frank-Kasper phase - 13.22 X 10896
Mo-Rh MoRh rt AuCd,oP4,51 Pmma 0.4413,0.2745,0.4785,90,90,90 close-packed structure - 11.39 A 3134
Mo-Rh MoRh3 rt Mg3Cd,hP8,194 P63 /mmc 0.5456,0.5456,0.435,90,90,120 close-packed structure - 11.98 A 3134
Mo-Rh Mo0.1Rh0.9 Cu,cF4,225 Fm-3m 0.38141,0.38141,0.38141,90,90,90 close-packed structure - 12.24 X 24773
Mo-Rh Mo0.5Rh0.5 ht Mg,hP2,194 P63 /mmc 0.27554,0.27554,0.44238,90,90,120 close-packed structure - 11.35 X 24773
Mo-Rh Mo0.65 Rh0.35 W,cI2,229 Im-3m 0.31449,0.31449,0.31449,90,90,90 b.c.c. family - 10.50 X 24773
Mo-Ru Mo0.5Ru0.5 Mg,hP2,194 P63 /mmc 0.276,0.276,0.4462,90,90,120 close-packed structure - 11.11 X 21292
Mo-Ru Mo0.7Ru0.3 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.95569,0.95569,0.49418,90,90,90 Frank-Kasper phase - 10.76 A 20579
Mo-Ru Mo0.7Ru0.3 W,cI2,229 Im-3m 0.3128,0.3128,0.3128,90,90,90 b.c.c. family - 10.58 X 21292
Mo-S MoS2 1T MoS2,hP12,143 P3 0.65,0.65,0.614,90,90,120 - - 4.73 X 34228
Mo-S MoS2 2H MoS2,hP6,194 P63 /mmc 0.3161,0.3161,1.2295,90,90,120 molybdenite 2H gray dark 5.00 X 15948
Mo-S MoS2 3R MoS2,hR9,160 R3m 0.3163,0.3163,1.837,90,90,120 molybdenite 3R - 5.01 X 15948
Mo-S Mo0.98 S0.02 W,cI2,229 Im-3m 0.31471,0.31471,0.31471,90,90,90 b.c.c. family - 10.09 X 4312
Mo-S Mo14S5 *,o**,* - 0.337,1.848,1.979,90,90,90 - - - N 20370
Mo-S Mo15S19 Mo15Se19,hP68,176 P63 /m 0.91838,0.91838,1.90483,90,90,120 Chevrel phase black 4.89 X 43368
Mo-S Mo2S3 ht Mo2S3,mP10,11 P121/m1 0.6087,0.3214,0.8627,90,102.43,90 - - 5.80 X 19532
Mo-S Mo2S3 rt mon Mo2S3,mP10,11 P121/m1 0.6092,0.3208,0.86335,90,102.43,90 - - 5.81 X 5422
Mo-S Mo2S3 rt tricl Mo2S3,mP10,11 P121/m1 0.6079,0.32,0.8616,90,102.33,90 - - 5.84 X 16448
Mo-S Mo21S8 Nb21S8,tI58,87 I4/m 1.676,1.676,0.335,90,90,90 - - 8.02 A 20370
Mo-S Mo3S4 m Mo3S4,hP98,176 P63 /m 0.92473,0.92473,1.75943,90,90,120 Chevrel phase black 5.30 X 46169
Mo-S Mo3S4 Mo3Se4,hR42,148 R-3 0.9202,0.9202,1.08769,90,90,120 Chevrel phase - 5.20 X 8442
Mo-S Mo3.58 S4 ht Mo3.58 S4,hR60,148 R-3 0.90788,0.90788,1.12709,90,90,120 - - 5.84 X 34975
Mo-S Mo9S11 Mo9S11,hR120,148 R-3 0.91996,0.91996,3.51028,90,90,120 - - 4.71 X 17477
Mo-Sb Mo3Sb7 lt Mo3Sb7,tI40,139 I4/mmm 0.9555,0.9555,0.9536,90,90,90 - - 8.70 X 52805
Mo-Sb Mo3Sb7 rt Ru3Sn7,cI40,229 Im-3m 0.95715,0.95715,0.95715,90,90,90 - - 8.64 X 52289
Mo-Se MoSe2 2H MoS2,hP6,194 P63 /mmc 0.3289,0.3289,1.2927,90,90,120 - gray 6.96 X 19711
Mo-Se MoSe2 hp 3R MoS2,hR9,160 R3m 0.3292,0.3292,1.9392,90,90,120 - - 6.95 X 3234
Mo-Se Mo0.98 Se0.02 W,cI2,229 Im-3m 0.31471,0.31471,0.31471,90,90,90 b.c.c. family - 10.19 X 4312
Mo-Se Mo15Se19 hex Mo15Se19,hP68,176 P63 /m 0.9450,0.9450,1.9600,90,90,120 Chevrel phase black 6.44 X 23725
Mo-Se Mo15Se19 rhom Mo15Se19,hR204,167 R-3c 0.94993,0.94993,5.88222,90,90,120 Chevrel phase - 6.37 X 24391
Mo-Se Mo3Se tf Cr3Si,cP8,223 Pm-3n 0.5092,0.5092,0.5092,90,90,90 Frank-Kasper phase - 9.23 X 33060
Handbook of Inorganic Substances – Edition 2015 : Data 129

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Mo-Se Mo3 Se4 Mo3 Se4,hR42,148 R-3 0.9545,0.9545,1.1210,90,90,120 Chevrel phase black 6.80 X 7565
Mo-Se Mo9 Se11 m1 Mo9 Se11,oS80,63 Cmcm 1.1963,1.3065,1.1046,90,90,90 Chevrel phase - 6.66 X 20453
Mo-Se Mo9 Se11 m2 Mo9 Se11,hP40,176 P63/m 0.94204,0.94204,1.21226,90,90,120 - black 6.17 X 42944
Mo-Si MoSi2 ht CrSi2,hP9,180 P6222 0.46016,0.46016,0.657,90,90,120 - - 6.29 X 56237
Mo-Si MoSi2 rt MoSi2,tI6,139 I4/mmm 0.32112,0.32112,0.78249,90,90,90 b.c.c. family - 6.26 X 27543
Mo-Si Mo3 Si Cr3Si,cP8,223 Pm-3n 0.4897,0.4897,0.4897,90,90,90 Frank-Kasper phase - 8.93 X 15792
Mo-Si Mo5 Si3 rt W5Si3,tI32,140 I4/mcm 0.965,0.965,0.4911,90,90,90 - - 8.19 X 15792
Mo-Si Mo5 Si3 stab Mn5 Si3,hP16,193 P63/mcm 0.7286,0.7286,0.5002,90,90,120 - - 8.14 A 632
Mo-Sn MoSn2 Mg2 Ni,hP18,180 P6222 0.5488,0.5488,1.4171,90,90,120 - black 8.99 X 29570
Mo-Sn Mo0.75 Sn0.25 ht-hp2 W,cI2,229 Im-3m 0.3165,0.3165,0.3165,90,90,90 b.c.c. family - 10.65 X 2274
Mo-Sn Mo3 Sn ht-hp1 Cr3Si,cP8,223 Pm-3n 0.5094,0.5094,0.5094,90,90,90 Frank-Kasper phase - 10.21 X 2274
Mo-Ta Ta0.04 Mo0.96 W,cI2,229 Im-3m 0.3146,0.3146,0.3146,90,90,90 b.c.c. family - 10.60 X 5969
Mo-Tc Mo0.25 Tc0.75 Mg,hP2,194 P63/mmc 0.265,0.265,0.4446,90,90,120 close-packed structure - 11.97 X 9260
Mo-Tc Mo0.33 Tc0.67 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9515,0.9515,0.495,90,90,90 Frank-Kasper phase - 10.82 A 1860
Mo-Tc Mo0.5 Tc0.5 W,cI2,229 Im-3m 0.3107,0.3107,0.3107,90,90,90 b.c.c. family - 10.74 X 12647
Mo-Tc Mo1.6 Tc2.4 rt Cr3Si,cP8,223 Pm-3n 0.4935,0.4935,0.4935,90,90,90 Frank-Kasper phase - 10.74 X 6955
Mo-Te MoTe 2 ht MoTe 2,mP12,11 P121/m1 0.633,0.3469,1.386,90,93.92,90 - - 7.68 X 2890
Mo-Te MoTe 2 rt MoS2,hP6,194 P63/mmc 0.35182,0.35182,1.39736,90,90,120 - black 7.79 X 1422
Mo-Te Mo0.98 Te0.02 W,cI2,229 Im-3m 0.31472,0.31472,0.31472,90,90,90 b.c.c. family - 10.29 X 4312
Mo-Te Mo3 Te4 Mo3 Se4,hR42,148 R-3 1.0179,1.0179,1.1674,90,90,120 Chevrel phase black 7.59 X 34082
Mo-Ti Ti0.75 Mo0.25 ht W,cI2,229 Im-3m 0.3225,0.3225,0.3225,90,90,90 b.c.c. family - 5.93 X 47268
Mo-Ti Ti0.99 Mo0.01 rt Mg,hP2,194 P63/mmc 0.29405,0.29405,0.4651,90,90,120 close-packed structure - 4.61 X 38859
Mo-U U0.65 Mo0.35 ht W,cI2,229 Im-3m 0.3347,0.3347,0.3347,90,90,90 b.c.c. family - 16.68 X 58011
Mo-U U0.88 Mo0.12 Pa,tI2,139 I4/mmm 0.34451,0.34451,0.33966,90,90,90 b.c.c. family - 18.21 X 58537
Mo-U U2Mo rt MoSi2,tI6,139 I4/mmm 0.3427,0.3427,0.9834,90,90,90 b.c.c. family - 16.45 X 832
Mo-U U3.5 Mo0.5 m U3(U0.5 Mo0.5 ),tP4,123 P4/mmm 0.49019,0.49019,0.33916,90,90,90 b.c.c. family - 17.95 X 1487
Mo-V V0.5 Mo0.5 W,cI2,229 Im-3m 0.308,0.308,0.308,90,90,90 b.c.c. family - 8.35 X 20676
Mo-W W0.5Mo0.5 W,cI2,229 Im-3m 0.3156,0.3156,0.3156,90,90,90 b.c.c. family gray silver 14.78 X 17552
Mo-Zn Zn7Mo CuPt7,cF32,225 Fm-3m 0.7732,0.7732,0.7732,90,90,90 close-packed structure - 7.96 X 4916
Mo-Zn Zn93.44Mo4.57 Zn93 (Zn0.43 Mo0.57)Mo 4,cF420,216 F-43m 1.8464,1.8464,1.8464,90,90,90 - gray silver 6.91 X 36163
Mo-Zr ZrMo2 rt MgCu2,cF24,227 Fd-3m 0.7598,0.7598,0.7598,90,90,90 Friauf-Laves phase - 8.57 X 19413
Mo-Zr ZrMo3 Cr3Si,cP8,223 Pm-3n 0.4942,0.4942,0.4942,90,90,90 Frank-Kasper phase - 10.43 X 220
Mo-Zr Zr0.15 Mo0.85 W,cI2,229 Im-3m 0.3185,0.3185,0.3185,90,90,90 b.c.c. family - 9.79 X 4592
Mo-Zr Zr0.47 Mo0.53 ht W,cI2,229 Im-3m 0.333,0.333,0.333,90,90,90 b.c.c. family - 8.43 X 5320
Mo-Zr Zr0.87 Mo0.13 ht W,cI2,229 Im-3m 0.3531,0.3531,0.3531,90,90,90 b.c.c. family - 6.93 X 8404
N-Na Na[N3] lt Na[N3],mS8,12 C12/m1 0.62233,0.36510,0.53359,90,108.444,90 - - 1.88 X 16901
N-Na Na[N3] rt Na[N3],hR12,166 R-3m 0.3646,0.3646,1.5223,90,90,120 - - 1.85 X 10320
N-Na Na3N hp1 Li3N,hP4,191 P6/mmm 0.44414,0.44414,0.46133,90,90,120 - - 1.75 X 53217
N-Na Na3N hp2 Fe3C-b,oP16,62 Pnma 0.709,0.7518,0.4794,90,90,90 - - 2.16 X 53217
N-Na Na3N hp3 Cu3P,hP24,185 P63cm 0.70356,0.70356,0.71661,90,90,120 - - 2.69 X 53217
N-Na Na3N hp4 BiF3 ,cF16,225 Fm-3m 0.54322,0.54322,0.54322,90,90,90 b.c.c. family - 3.44 X 53217
N-Na Na3N ReO3,cP4,221 Pm-3m 0.4725,0.4725,0.4725,90,90,90 - blue 1.31 X 48438
N-Nb NbN cub NbO,cP6,221 Pm-3m 0.4378,0.4378,0.4378,90,90,90 - - 6.35 X 30902
N-Nb NbN rt TiP,hP8,194 P63/mmc 0.2952,0.2952,1.125,90,90,120 - gray 8.36 X 587
N-Nb NbN0.0125 W,cI2,229 Im-3m 0.3305,0.3305,0.3305,90,90,90 b.c.c. family - 8.56 F 3167
N-Nb NbN0.48 ht1 NiAs,hP4,194 P63/mmc 0.3056,0.3056,0.4961,90,90,120 AlB2 family gray 8.25 X 1545
N-Nb NbN0.80 NbN0.75 ,tI16,139 I4/mmm 0.4377,0.4377,0.8719,90,90,90 rocksalt family gray 8.28 X 13932
N-Nb NbN0.9 hex WC,hP2,187 P-6m2 0.2958,0.2958,0.2779,90,90,120 AlB2 family - 8.32 X 587
N-Nb NbN0.9 ht2 NaCl,cF8,225 Fm-3m 0.4377,0.4377,0.4377,90,90,90 rocksalt family gray 8.36 X 11170
N-Nb Nb0.84 N TiS,hR18,166 R-3m 0.2985,0.2985,2.3843,90,90,120 - gray 7.48 X 57487
N-Nb Nb1.54 N0.71 Fe2N,hP9,162 P-31m 0.5267,0.5267,0.4988,90,90,120 - - 6.36 X 9504
N-Nb Nb4 N5 tf Ti4O5,tI18,87 I4/m 0.6853,0.6853,0.427,90,90,90 - - 7.31 X 36057
N-Nb Nb5 N6 tf Ta5N6,hP22,193 P63/mcm 0.5193,0.5193,1.038,90,90,120 - - 7.52 X 6001
N-Nd NdN NaCl,cF8,225 Fm-3m 0.5132,0.5132,0.5132,90,90,90 rocksalt family gray 7.78 X 12495
N-Nd Nd1.5 N3 La2O3,hP5,164 P-3m1 0.379,0.379,0.599,90,90,120 - - 5.76 A 6879
N-Ni Ni3N Fe3N,hP8,182 P6322 0.4594,0.4594,0.4325,90,90,120 - - 7.99 X 44937
N-Ni Ni4N rt Fe4N,cP5,221 Pm-3m 0.374,0.374,0.374,90,90,90 - - 7.90 X 7635
N-Ni Ni4N tf *,tP10,* - 0.372,0.372,0.728,90,90,90 - - - N 3490
N-Np NpN NaCl,cF8,225 Fm-3m 0.48999,0.48999,0.48999,90,90,90 rocksalt family - 14.18 X 58453
N-Np NpN2 CaF2 ,cF12,225 Fm-3m 0.53236,0.53236,0.53236,90,90,90 fluorite family - 11.67 X 58453
N-Np Np2 N3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.06513,1.06513,1.06513,90,90,90 - - 11.35 X 58453
N-O N0.5 O0.5 (N0.5 O0.5 ),mP8,14 P121/c1 0.581,0.396,0.668,90,117.2,90 - - 1.46 X 492
N-O N2O3 lt1 N2O3,tI192,88 I41/a 1.62557,1.62557,0.88049,90,90,90 - blue 1.74 X 29932
N-O N2O3 lt2 N2O3,oP20,19 P212121 0.50686,0.64796,0.86326,90,90,90 - blue indigo 1.78 X 29932
N-O N2O4 m N2O4,mP12,14 P121/c1 0.5917,0.4758,0.6533,90,117.92,90 - white 1.88 X 25615
N-O [NO2][NO3] [NO2][NO3],hP14,194 P63/mmc 0.54019,0.54019,0.65268,90,90,120 - colorless 2.17 X 25845
N-O [N2O] hp *,oS12,64 Cmce 0.4954,0.4497,0.6201,90,90,90 - - - N 24924
N-O [N2O] rt [OCO],cP12,205 Pa-3 0.567,0.567,0.567,90,90,90 - - 1.60 X 1464
N-O [N2O4] N2O4-b,cI36,204 Im-3 0.77529,0.77529,0.77529,90,90,90 - colorless 1.97 X 51879
N-O [N2]0.05 [O2]0.95 hp1 [O2],hR6,166 R-3m 0.2758,0.2758,1.02,90,90,120 - - 2.36 A 43774
N-O [N2]0.05 [O2]0.95 hp2 [O2],oF8,69 Fmmm 0.2958,0.4248,0.6704,90,90,90 - - 2.51 A 43774
N-O [N2]0.05 [O2]0.95 hp3 [O2],mS16,12 C12/m1 0.8096,0.5724,0.3776,90,117.26,90 - - 2.72 A 43774
N-O [N2]0.48 [O2]0.52 hp *,hP28,* - 0.563,0.563,1.2358,90,90,120 - - 2.06 N 43774
N-O [N2]0.90 [O2]0.10 hp1 Mg,hP2,194 P63/mmc 0.3537,0.3537,0.5844,90,90,120 close-packed structure - 1.49 X 43774
N-O [N2]0.90 [O2]0.10 hp2 [F2],cP8,223 Pm-3n 0.601,0.601,0.601,90,90,90 - - 1.74 X 43774
N-O [N2]0.90 [O2]0.10 hp3 *,tP32,138 P42/ncm 0.8075,0.8075,0.5694,90,90,90 - - 2.03 N 43774
N-P PN[N3]2 PN[N3]2,aP48,2 P-1 0.71953,0.73718,1.2994,87.41,78.95,89.59 - colorless 1.90 X 45900
N-P P 3N5 hp1 P 3N5 ,oI16,44 Imm2 0.26131,1.28721,0.44003,90,90,90 - colorless 3.66 X 40851
130 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

N-P P 3N5 mon1 P 3N5,mS32,15 C12/c1 0.81208,0.58343,0.91601,90,115.809,90 - beige 2.77 X 35209


N-P P 3N5 mon2 *,mP144,* - 0.7936,0.5886,0.9263,90,113.36,90 - - - N 19357
N-Pb Pb[N3]2 lt *,mS56,* - 0.512,0.888,1.831,90,90.,90 - - - N 758
N-Pb Pb[N3]2 rt Pb[N3]2,oP84,62 Pnma 0.663,1.625,1.131,90,90,90 - - 4.76 X 10460
N-Pd Pd2N CaCl2,oP6,58 Pnnm 0.44869,0.4863,0.2808,90,90,90 - - 12.29 X 41885
N-Pr PrN hp BaO,tP4,129 P4/nmm 0.4052,0.4052,0.3001,90,90,90 b.c.c. family - 10.44 X 54853
N-Pr PrN NaCl,cF8,225 Fm-3m 0.4781,0.4781,0.4781,90,90,90 rocksalt family black 9.42 X 54853
N-Pr Pr1.5 N3 La2O3,hP5,164 P-3m1 0.3848,0.3848,0.6001,90,90,120 - - 5.47 A 6879
N-Pu PuN NaCl,cF8,225 Fm-3m 0.4918,0.4918,0.4918,90,90,90 rocksalt family - 14.41 X 17543
N-Rb Rb[N3] ht CsCl,cP2,221 Pm-3m 0.435,0.435,0.435,90,90,90 b.c.c. family - 2.57 X 2876
N-Rb Rb[N3] rt K[N3],tI16,140 I4/mcm 0.63098,0.63098,0.75188,90,90,90 - - 2.83 X 7055
N-Re ReN0.43 *,cF*,* - 0.392,0.392,0.392,90,90,90 - - - N 400
N-Re ReN2 MoS2,hP6,194 P63 /mmc 0.2806,0.2806,1.0747,90,90,120 - - 9.71 X 57762
N-Re Re2N MoS2,hP6,194 P63 /mmc 0.27692,0.27692,0.9644,90,90,120 - - 20.04 X 55303
N-Re Re3N Re3N,hP4,187 P-6m2 0.27776,0.27776,0.70972,90,90,120 - - 20.05 X 55303
N-S SN ht SN,oP32,60 Pbcn 0.8839,0.8755,0.72581,90,90,90 - - 2.18 X 39523
N-S SN poly SN-b,mP8,14 P121/c1 0.4153,0.4439,0.7637,90,109.7,90 - golden 2.31 X 9883
N-S SN ring SN-c,mP8,14 P121/c1 0.4518,0.3845,0.8495,90,106.43,90 - colorless 2.16 X 33025
N-S SN rt cage SN,mP32,14 P121/c1 0.8629,0.7084,1.1890,90,132.73,90 - orange 2.29 X 11508
N-S S11N2 *,mP52,14 P121/c1 0.851,1.418,1.092,90,115.,90 - - - N 9742
N-S S16N2 *,oP144,61 Pbca 1.0593,1.5373,2.1558,90,90,90 - - - N 9742
N-S S17N2 *,mS76,15 C12/c1 1.4542,1.6029,0.8303,90,110.,90 - - - N 9742
N-S S2N S2N,tP24,102 P42nm 1.1146,1.1146,0.3773,90,90,90 - red dark 2.21 X 16101
N-S S5N6 S5N6,mS44,15 C12/c1 0.8787,1.1190,0.7427,90,106.46,90 - red 2.32 X 12279
N-Sb Sb[N3]3 rhom Sb[N3]3,hR60,148 R-3 0.72047,0.72047,1.94385,90,90,120 - colorless 2.83 X 42775
N-Sb Sb[N3]3 tricl Sb[N3]3,aP20,2 P-1 0.66694,0.69045,0.70314,83.651,65.85,83.595 - colorless 2.81 X 55903
N-Sc ScN0.87 cub1 NaCl,cF8,225 Fm-3m 0.45,0.45,0.45,90,90,90 rocksalt family - 4.17 X 10660
N-Se SeN mon1 SeN,mS32,15 C12/c1 0.965,0.973,0.647,90,104.9,90 - - 4.21 X 2930
N-Se SeN mon2 SN,mP32,14 P121/c1 0.8818,0.7387,1.21975,90,132.601,90 - brown red 4.22 X 29484
N-Se SeN poly *,aP16,* - 0.647,0.685,0.685,90.5,100.4,100.4 - red - N 1351
N-Si Si3N4 stab Si3N4,hP28,159 P31c 0.77545,0.77545,0.56214,90,90,120 - colorless 3.18 X 48880
N-Si Si3N4 Si3N4,hP14,173 P63 0.76044,0.76044,0.29063,90,90,120 nierite colorless 3.20 X 42716
N-Sm SmN NaCl,cF8,225 Fm-3m 0.504,0.504,0.504,90,90,90 rocksalt family black gray 8.53 X 13540
N-Sn Sn3N4 Fe3O4,cF56,227 Fd-3m 0.9037,0.9037,0.9037,90,90,90 spinel family black 7.42 X 36573
N-Sr Sr[N2] CaC2,tI6,139 I4/mmm 0.38054,0.38054,0.62961,90,90,90 - brown 4.21 X 58275
N-Sr Sr[N3]2 Sr[N3]2,oF56,70 Fddd 0.61202,1.1546,1.18262,90,90,90 - colorless 2.73 X 42494
N-Sr Sr2N CdCl2,hR9,166 R-3m 0.38625,0.38625,2.0694,90,90,120 - black 3.53 X 40790
N-Sr Sr4N2[N2] Sr4N2[N2],mS16,12 C12/m1 1.3472,0.38121,0.67284,90,94.72,90 - black gray 3.92 X 38367
N-Sr Sr4N3 Sr4N3,mS16,12 C12/m1 0.6707,0.3828,1.37625,90,96.519,90 - gray dark 3.71 X 39712
N-Ta TaN rt TaN,hP6,189 P-62m 0.517,0.517,0.289,90,90,120 - gray 14.52 X 15169
N-Ta TaN0.07 W,cI2,229 Im-3m 0.3328,0.3328,0.3328,90,90,90 b.c.c. family gray 16.39 F 7703
N-Ta TaN0.5 NiAs,hP4,194 P63 /mmc 0.3054,0.3054,0.4996,90,90,120 AlB2 family gray 15.47 X 48771
N-Ta TaN0.83 hp WC,hP2,187 P-6m2 0.29438,0.29438,0.2893,90,90,120 AlB2 family - 14.73 X 59118
N-Ta Ta0.83 N ht NaCl,cF8,225 Fm-3m 0.433,0.433,0.433,90,90,90 rocksalt family brown dark 13.43 X 9259
N-Ta Ta2N tf Ni2H,hP3,156 P3m1 0.305,0.305,0.493,90,90,120 close-packed structure - 15.72 A 25158
N-Ta Ta2N3 Th2S3,oP20,62 Pnma 0.8183,0.29823,0.81911,90,90,90 - - 13.42 X 51801
N-Ta Ta3N5 Ta3N5,oS32,63 Cmcm 0.38862,1.02118,1.02624,90,90,90 - red 10.00 X 24408
N-Ta Ta4N5 Ti4O5,tI18,87 I4/m 0.6842,0.6842,0.4266,90,90,90 - brown dark 13.20 A 28933
N-Ta Ta5N6 Ta5N6,hP22,193 P63 /mcm 0.51818,0.51818,1.03611,90,90,120 - gray dark 13.63 X 32138
N-Ta Ta9N2 lt *,c**,* - 1.01,1.01,1.01,90,90,90 - - - N 7703
N-Tb TbN NaCl,cF8,225 Fm-3m 0.4931,0.4931,0.4931,90,90,90 rocksalt family - 9.58 X 18040
N-Tb Tb2N3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.066,1.066,1.066,90,90,90 - - 7.89 A 6879
N-Tc TcN NaCl,cF8,225 Fm-3m 0.3945,0.3945,0.3945,90,90,90 rocksalt family - 12.12 X 20623
N-Th ThN NaCl,cF8,225 Fm-3m 0.51666,0.51666,0.51666,90,90,90 rocksalt family - 11.85 X 17996
N-Th Th2N3 La2O3,hP5,164 P-3m1 0.3883,0.3883,0.6187,90,90,120 - - 10.40 X 309
N-Th Th3N4 Th3N4,hR21,166 R-3m 0.3875,0.3875,2.739,90,90,120 - - 10.52 X 5689
N-Ti TiN0.26 m Cr0.88 S,hP4,164 P-3m1 0.2956,0.2956,0.4765,90,90,120 - - 4.75 X 23403
N-Ti TiN0.28 rt Mg,hP2,194 P63 /mmc 0.2973,0.2973,0.4788,90,90,120 close-packed structure - 4.70 F 16397
N-Ti TiN0.43 ht TiS,hR18,166 R-3m 0.29809,0.29809,2.16642,90,90,120 - - 4.83 X 19169
N-Ti TiN0.5 rt TiN0.5 ,tI16,141 I41/amd 0.415,0.415,0.8801,90,90,90 rocksalt family - 4.81 X 57274
N-Ti TiN0.58 ht Sc0.67 Te,hR24,166 R-3m 0.29795,0.29795,2.89649,90,90,120 - - 5.01 X 19116
N-Ti TiN0.9 ht NaCl,cF8,225 Fm-3m 0.4239,0.4239,0.4239,90,90,90 osbornite golden 5.28 X 11170
N-Ti Ti2N0.80 rt TiO2,tP6,136 P42 /mnm 0.4945,0.4945,0.3034,90,90,90 - - 4.79 X 57274
N-Tl TlN ZnO,hP4,186 P63 mc 0.368,0.368,0.601,90,90,120 adamantane structure - 10.29 A 8091
N-Tl Tl[N3] lt *,o*24,* - 0.73659,0.87178,0.87655,90,90,90 - - - N 7507
N-Tl Tl[N3] rt K[N3],tI16,140 I4/mcm 0.61896,0.61896,0.73271,90,90,90 - yellow pale 5.83 X 42494
N-Tm TmN NaCl,cF8,225 Fm-3m 0.4802,0.4802,0.4802,90,90,90 rocksalt family - 10.97 X 18040
N-Tm Tm2N3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.045,1.045,1.045,90,90,90 - - 8.84 A 6879
N-U UN hp NiO,hR6,166 R-3m 0.31701,0.31701,0.86367,90,90,120 - - 16.70 X 17997
N-U UN NaCl,cF8,225 Fm-3m 0.48887,0.48887,0.48887,90,90,90 rocksalt family gray dark 14.33 X 17997
N-U UN1.6 rt UN1.6 ,cI96,206 Ia-3 1.0676,1.0676,1.0676,90,90,90 - gray 11.37 X 9128
N-U UN2 CaF2,cF12,225 Fm-3m 0.521,0.521,0.521,90,90,90 fluorite family - 12.50 X 8315
N-U U2N3 ht La2O3,hP5,164 P-3m1 0.37,0.37,0.5825,90,90,120 - - 12.46 X 9129
N-U U7N12 Pr7O12,hR57,148 R-3 0.99367,0.99367,0.91672,90,90,120 - - 11.66 A 9128
N-V VN lt VN,tP8,111 P-42m 0.41272,0.41272,0.41238,90,90,90 - - 6.14 X 21701
N-V VN0.06 W,cI2,229 Im-3m 0.3055,0.3055,0.3055,90,90,90 b.c.c. family - 6.03 F 8283
N-V VN0.81 rt VN0.81 ,tP64,137 P42 /nmc 0.8174,0.8174,0.8174,90,90,90 rocksalt family - 6.06 X 11561
N-V VN0.83 rt NaCl,cF8,225 Fm-3m 0.41189,0.41189,0.41189,90,90,90 rocksalt family - 5.95 X 59730
Handbook of Inorganic Substances – Edition 2015 : Data 131

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

N-V V2N Fe2N,hP9,162 P-31m 0.4917,0.4917,0.4568,90,90,120 - - 6.04 X 12163


N-V V8N tricl1 *,aP*,* - 0.2994,0.3114,0.3114,90.,90.5,90.5 - - - N 8441
N-V V8N tricl2 *,aP*,* - 0.3114,0.5988,0.8807,90.5,90.,90.5 - - - N 8441
N-V V8N0.75 m V8O,tP18,136 P42/mnm 0.8801,0.8801,0.2985,90,90,90 - - 6.00 X 13209
N-W WN WC,hP2,187 P-6m2 0.2895,0.2895,0.283,90,90,120 AlB2 family - 16.00 X 57933
N-W WN0.67 ht NaCl,cF8,225 Fm-3m 0.413,0.413,0.413,90,90,90 rocksalt family - 18.22 X 1307
N-W WN2 tf WN2,hR9,166 R-3m 0.289,0.289,1.640,90,90,120 - - 8.90 X 1743
N-W W[N3]6 W[N3]6,hP38,147 P-3 0.93962,0.93962,0.72225,90,90,120 - red ruby 2.62 X 44160
N-W W1.2 N tf W1.2 N,hP6,186 P63mc 0.289,0.289,1.08,90,90,120 - - 9.98 X 2364
N-W W1.28 N2 Nb1.35 S2,hP8,194 P63/mmc 0.289,0.289,1.1,90,90,120 AlB2 family - 10.99 X 2014
N-W W1.33 N2 W1.33 N2,hR12,160 R3m 0.2889,0.2889,1.5291,90,90,120 - - 12.28 X 57933
N-W W2N tf W2N,hP9,164 P-3m1 0.289,0.289,2.285,90,90,120 - - 11.51 X 1512
N-W W2N3 W2N3,hP10,194 P63/mmc 0.289,0.289,1.5286,90,90,120 - - 12.31 X 57933
N-W W2.3 N2 tf W2.3 N2,hP10,194 P63/mmc 0.289,0.289,1.530,90,90,120 - - 13.53 X 1146
N-W W2.36 N2 W2.36 N2,hR15,166 R-3m 0.289,0.289,2.335,90,90,120 - - 13.62 X 1756
N-W W3N4 U4S3 ,cP7,221 Pm-3m 0.4125,0.4125,0.4125,90,90,90 - - 14.37 X 57933
N-W W5N6 *,hP*,* - 0.5014,0.5014,1.526,90,90,120 - - - N 33295
N-Y YN NaCl,cF8,225 Fm-3m 0.48715,0.48715,0.48715,90,90,90 rocksalt family gray dark 5.91 X 18093
N-Yb YbN0.975 NaCl,cF8,225 Fm-3m 0.4775,0.4775,0.4775,90,90,90 rocksalt family - 11.39 X 24332
N-Zn ZnNx Mg,hP2,194 P63/mmc 0.26686,0.26686,0.49459,90,90,120 close-packed structure - 7.12 X 54034
N-Zn Zn[N3]2 Pb[N3]2,oP84,62 Pnma 0.692,1.633,1.098,90,90,90 - colorless 2.40 A 8998
N-Zn Zn3N2 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 0.97797,0.97797,0.97797,90,90,90 - black gray 6.37 X 50897
N-Zr ZrN NaCl,cF8,225 Fm-3m 0.45593,0.45593,0.45593,90,90,90 rocksalt family yellow 7.37 X 52245
N-Zr ZrN0.29 rt Mg,hP2,194 P63/mmc 0.32584,0.32584,0.5226,90,90,120 close-packed structure - 6.59 F 16050
N-Zr Zr3N4 ht Th3P 4,cI28,220 I-43d 0.674,0.674,0.674,90,90,90 - - 7.15 X 42125
N-Zr Zr3N4 rt Zr3N4,oP28,62 Pnma 0.97294,0.32810,1.08175,90,90,90 - brown red 6.34 X 32452
Na-O Na[O2] lt1 FeS2 ,cP12,205 Pa-3 0.53,0.53,0.53,90,90,90 pyrite-marcasite family - 2.45 X 9820
Na-O Na[O2] lt2 FeS2 ,oP6,58 Pnnm 0.4332,0.554,0.3364,90,90,90 pyrite-marcasite family - 2.26 X 9820
Na-O Na[O2] lt3 FeS2 ,oP6,58 Pnnm 0.4313,0.5508,0.3337,90,90,90 pyrite-marcasite family - 2.30 X 9820
Na-O Na[O2] rt NaCl,cF8,225 Fm-3m 0.5512,0.5512,0.5512,90,90,90 rocksalt family - 2.18 X 9820
Na-O Na[O3] Na[O3],oI8,44 Imm2 0.3507,0.52708,0.57703,90,90,90 - red bright 2.21 X 38133
Na-O Na2O rt CaF2 ,cF12,225 Fm-3m 0.55476,0.55476,0.55476,90,90,90 fluorite family - 2.41 X 36209
Na-O Na2[O2] rt Na2[O2],hP12,189 P-62m 0.622,0.622,0.447,90,90,120 - white 2.59 X 878
Na-O Na3O *,tI56,139 I4/mmm 1.159,1.159,0.766,90,90,90 - - - N 2280
Na-P NaP NaP,oP16,19 P212121 0.5643,0.6038,1.0142,90,90,90 - black 2.07 X 12818
Na-P NaP 15 *,m**,* - 0.6521,0.9704,2.2706,90,96.51,90 - - - N 18400
Na-P NaP 5 NaP 5,oP24,62 Pnma 1.0993,0.6524,0.6903,90,90,90 - red dark 2.39 X 43126
Na-P Na3P Na3As,hP8,194 P63/mmc 0.49512,0.49512,0.87874,90,90,120 - red 1.78 X 44270
Na-P Na3P 11 Na3P 11,oP56,60 Pbcn 0.9828,1.2466,1.0410,90,90,90 - orange 2.13 X 7709
Na-Pb NaPb rt NaPb,tI64,142 I41/acd 1.0580,1.0580,1.7746,90,90,90 - - 6.16 X 481
Na-Pb NaPb3 Cu3Au,cP4,221 Pm-3m 0.4888,0.4888,0.4888,90,90,90 close-packed structure - 9.17 X 5391
Na-Pb Na13 Pb5 rt *,hP10,194 P63/mmc 0.551,0.551,4.039,90,90,120 - - - P 856
Na-Pb Na15 Pb4 Cu15 Si4,cI76,220 I-43d 1.329,1.329,1.329,90,90,90 - - 3.32 X 125
Na-Pb Na5Pb *,hP*,* - 1.06,1.06,1.15,90,90,120 - - - N 4150
Na-Pb Na5Pb2 *,hR6,166 R-3m 0.554,0.554,2.315,90,90,120 - - - P 856
Na-Pb Na9Pb4 ht *,hP8,194 P63/mmc 0.547,0.547,3.041,90,90,120 - - - P 856
Na-Pt NaPt2 MgCu2,cF24,227 Fd-3m 0.7482,0.7482,0.7482,90,90,90 Friauf-Laves phase - 13.10 X 22047
Na-S NaS2 NaS2,tI48,122 I-42d 0.95965,0.95965,1.17885,90,90,90 - green olive 2.13 X 7111
Na-S Na2S hp1 Cs2S,oP12,62 Pnma 0.6707,0.412,0.8025,90,90,90 - - 2.34 X 38485
Na-S Na2S hp2 Co1.75 Ge,hP6,194 P63/mmc 0.4376,0.4376,0.5856,90,90,120 AlB2 family - 2.67 X 38485
Na-S Na2S CaF2 ,cF12,225 Fm-3m 0.65373,0.65373,0.65373,90,90,90 fluorite family colorless 1.86 X 33375
Na-S Na2S Li2[O2]-b,hP8,194 P63/mmc 0.4489,0.4489,1.0227,90,90,120 - yellow 1.45 X 28184
Na-S Na2S2 m Na2[O2],hP12,189 P-62m 0.7629,0.7629,0.5394,90,90,120 - - 2.02 X 1768
Na-S Na2S5 rt Na2S5,oP28,62 Pnma 0.7654,1.451,0.5846,90,90,90 - orange red 2.11 X 17721
Na-Sb NaSb LiAs,mP16,14 P121/c1 0.68,0.634,1.248,90,117.6,90 - - 4.03 X 1050
Na-Sb Na3Sb Na3As,hP8,194 P63/mmc 0.5355,0.5355,0.9496,90,90,120 - - 2.69 X 145
Na-Se NaSe 2 NaS2,tI48,122 I-42d 1.01926,1.01926,1.22177,90,90,90 - red dark 3.79 X 33938
Na-Se Na2Se CaF2 ,cF12,225 Fm-3m 0.6825,0.6825,0.6825,90,90,90 fluorite family - 2.61 X 25969
Na-Se Na2Se 2 Li2[O2]-b,hP8,194 P63/mmc 0.4685,0.4685,1.053,90,90,120 - - 3.38 X 1768
Na-Si NaSi hp NaSi-b,mS32,15 C12/c1 0.96227,0.60823,0.96227,90,105.764,90 - - 2.50 X 52914
Na-Si NaSi NaSi-a,mS32,15 C12/c1 1.21536,0.65452,1.11323,90,118.9,90 - gray silver 1.75 X 51606
Na-Si Na3Si17 Na1.5 Si17,cF160,227 Fd-3m 1.47157,1.47157,1.47157,90,90,90 clathrate gray 2.28 X 52413
Na-Si Na3Si17 Na3Si17,cF200,227 Fd-3m 1.47121,1.47121,1.47121,90,90,90 clathrate black 2.28 X 55938
Na-Si Na4Si23 Na4Si23,cP54,223 Pm-3n 1.01973,1.01973,1.01973,90,90,90 clathrate black 2.31 X 55938
Na-Sn NaSn rt NaPb,tI64,142 I41/acd 1.0475,1.0475,1.7412,90,90,90 - gray silver 3.94 X 36761
Na-Sn NaSn2 NaSn2,mS48,12 C12/m1 1.33916,0.68854,1.54889,90,102.529,90 - - 4.96 X 44696
Na-Sn NaSn5 NaSn5,tP12,113 P-421m 0.62992,0.62992,0.88172,90,90,90 - gray silver 5.85 X 34123
Na-Sn Na15 Sn4 Cu15 Si4,cI76,220 I-43d 1.314,1.314,1.314,90,90,90 - gray silver 2.40 X 12017
Na-Sn Na3.7 Sn rt Na3.7 Sn,oP40,62 Pnma 0.982,0.557,2.279,90,90,90 - - 2.17 X 9483
Na-Sn Na5Sn13 Na5Sn13,oS288,63 Cmcm 0.8979,1.9448,5.043,90,90,90 - gray silver 5.00 X 33047
Na-Sn Na7Sn12 Na7Sn12,mP78,13 P12/c1 1.3375,0.9329,2.23779,90,126.554,90 - - 4.69 X 41554
Na-Sn Na9Sn4 Li9Ge4,oS52,63 Cmcm 0.542,0.939,2.962,90,90,90 - bluish 3.00 X 12017
Na-Te NaTe NaTe,oP48,60 Pbcn 1.5892,0.9947,0.9179,90,90,90 - bronze 4.14 X 18091
Na-Te NaTe 3 NaTe 3,hP48,165 P-3c1 0.9033,0.9033,2.193,90,90,120 - gray 5.22 X 19716
Na-Te Na2Te CaF2 ,cF12,225 Fm-3m 0.73,0.73,0.73,90,90,90 fluorite family white 2.96 X 25969
Na-Tl Na0.85 Tl rt NaTl,cF16,227 Fd-3m 0.7448,0.7448,0.7448,90,90,90 b.c.c. family gray silver 7.20 X 21652
Na-Tl Na2Tl Na2Tl,oS48,20 C222 1 0.88797,1.39350,1.16927,90,90,90 - - 4.60 X 3348
Na-Tl Na44 Tl7 Mg44 Rh7,cF408,216 F-43m 2.4154,2.4154,2.4154,90,90,90 - - 2.30 X 6492
132 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Na-Zn NaZn13 NaZn13,cF112,226 Fm-3c 1.2273,1.2273,1.2273,90,90,90 - - 6.27 X 46673


Nb-Ni NbNi3 prec TiAl3,tI8,139 I4/mmm 0.3556,0.3556,0.7422,90,90,90 close-packed structure - 9.52 X 44760
Nb-Ni NbNi3 rt Cu3Ti,oP8,59 Pmmn 0.4244,0.5114,0.453,90,90,90 close-packed structure - 9.09 X 26214
Nb-Ni Nb0.06 Ni0.94 Cu,cF4,225 Fm-3m 0.3562,0.3562,0.3562,90,90,90 close-packed structure - 8.93 X 17833
Nb-Ni Nb0.2 Ni0.8 m Mg,hP2,194 P63 /mmc 0.2581,0.2581,0.4221,90,90,120 close-packed structure - 8.94 X 3598
Nb-Ni Nb0.35 Ni0.65 m Mg,hP2,194 P63 /mmc 0.328,0.328,0.522,90,90,120 - - 4.83 X 16444
Nb-Ni Nb0.8 Ni0.2 m Cu,cF4,225 Fm-3m 0.418,0.418,0.418,90,90,90 close-packed structure - 7.83 X 28846
Nb-Ni Nb5Ni rt Nb5Ni,cF96,227 Fd-3m 1.1642,1.1642,1.1642,90,90,90 - - 8.81 X 3737
Nb-Ni Nb7.2 Ni5.8 W6Fe7,hR39,166 R-3m 0.4954,0.4954,2.6978,90,90,120 Frank-Kasper phase - 8.77 X 45139
Nb-O NbO tf NaCl,cF8,225 Fm-3m 0.439,0.439,0.439,90,90,90 rocksalt family - 8.55 X 5556
Nb-O NbO NbO,cP6,221 Pm-3m 0.4211,0.4211,0.4211,90,90,90 - gray silver 7.27 X 22870
Nb-O NbO0.15 VH0.5 ,cI14,229 Im-3m 0.33082,0.33082,0.33082,90,90,90 - - 8.74 X 40607
Nb-O NbO0.76 ht BiF3,cF16,225 Fm-3m 0.511,0.511,0.511,90,90,90 b.c.c. family - 5.23 X 12755
Nb-O NbO2 ht1 NbO2,tI48,80 I41 0.9693,0.9693,0.5985,90,90,90 - black 5.90 X 15752
Nb-O NbO2 ht2 TiO2,tP6,136 P42 /mnm 0.47997,0.47997,0.30274,90,90,90 - - 5.95 A 33545
Nb-O NbO2 rt NbO2,tI96,88 I41/a 1.3695,1.3695,0.5981,90,90,90 - gray 5.92 X 12172
Nb-O NbO2.464 ht *,mS322,* - 2.118,0.3823,5.60025,90,96.073,90 - - - N 4894
Nb-O NbO2.483 *,mS*,* - 6.55053,0.3827,2.115,90,104.707,90 - - - N 3766
Nb-O Nb0.91 O1.5 Nb0.91 O1.5 ,cP112,221 Pm-3m 0.78,0.78,0.78,90,90,90 - - 3.04 X 2795
Nb-O Nb1.25 O0.9 tf Ta1.1 O0.84 ,cP5,221 Pm-3m 0.388,0.388,0.388,90,90,90 - - 3.71 X 5556
Nb-O Nb11O27 Nb11O27,mP81,10 P12/m1 1.57491,0.38236,1.78521,90,102.029,90 - - 4.59 X 49044
Nb-O Nb12O29 ht (Ti0.17 Nb0.83)12O29,oS164,63 Cmcm 0.3832,2.074,2.88901,90,90,90 - - 4.57 X 49044
Nb-O Nb12O29 lt Nb12O29,mS82,8 C1m1 2.07171,0.38303,1.5692,90,113.112,90 - - 4.58 X 43328
Nb-O Nb12O29 rt (Ti0.17 Nb0.83)12O29,mS82,12 C12/m1 2.071,0.38307,1.56856,90,113.056,90 - - 4.58 X 43328
Nb-O Nb2O m *,t**,* - 0.6645,0.6645,0.9229,90,90,90 - - - N 3549
Nb-O Nb2O5 M (V0.65 W0.35 )2O5,tI112,139 I4/mmm 2.044,2.044,0.3832,90,90,90 - blue 4.41 X 5408
Nb-O Nb2O5 R Nb2O5,mS14,12 C12/m1 1.279,0.3826,0.3983,90,90.75,90 - - 4.53 X 3139
Nb-O Nb2O5 TT *,mS56,* - 0.7182,1.579,0.7238,90,119.08,90 - - - N 6790
Nb-O Nb2O5 Z Nb2O5,mS14,5 C121 0.52193,0.46995,0.59285,90,108.559,90 - white 6.40 X 34873
Nb-O Nb2O5 hp-ht Nb2O5,mS28,15 C12/c1 1.2740,0.48830,0.55609,90,105.02,90 - colorless 5.28 X 25174
Nb-O Nb2O5 ht mon1 Nb2O5,mP99,10 P12/m1 1.9356,0.38233,2.0375,90,115.72,90 - white 4.55 X 9672
Nb-O Nb2O5 ht mon2 Nb2O5,mS112,12 C12/m1 2.851,0.3830,1.748,90,120.80,90 - colorless 4.31 X 3758
Nb-O Nb2O5 rt *,o**,* - 0.7268,2.8677,6.2328,90,90,90 - - - N 15625
Nb-O Nb2O5 α *,oS14,65 Cmmm 0.3663,0.6171,0.3928,90,90,90 - - - N 21252
Nb-O Nb2O5 γ Ta2O5,oP84,25 Pmm2 0.392,4.379,0.624,90,90,90 - - 4.95 A 1299
Nb-O Nb2O5 δ *,hP*,* - 0.3604,0.3604,0.3923,90,90,120 - - - N 21252
Nb-O Nb4O *,t**,* - 1.33,1.33,0.664,90,90,90 - - - N 3549
Nb-O Nb4O5 Nb4O5,tP18,137 P42 /nmc 0.6651,0.6651,0.4814,90,90,90 - violet deep 7.04 X 26705
Nb-O Nb6O m *,tP56,132 P42 /mcm 1.011,1.011,0.981,90,90,90 - - - N 5289
Nb-O Nb8O m *,tP*,* - 0.338,0.338,0.327,90,90,90 - - - N 7722
Nb-O Nb8.4 O21 hp Nb8.4 O21,oP86,55 Pbam 0.6175,2.9175,0.3930,90,90,90 - colorless 5.24 X 8852
Nb-Os Nb0.2 Os0.8 Mg,hP2,194 P63 /mmc 0.2762,0.2762,0.4415,90,90,120 close-packed structure - 19.44 X 10734
Nb-Os Nb0.33 Os0.67 Mn,cI58,217 I-43m 0.9661,0.9661,0.9661,90,90,90 - - 16.89 A 10734
Nb-Os Nb0.6 Os0.4 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9858,0.9858,0.5063,90,90,90 Frank-Kasper phase - 13.35 X 2081
Nb-Os Nb0.83 Os0.17 W,cI2,229 Im-3m 0.3233,0.3233,0.3233,90,90,90 b.c.c. family - 10.76 X 10734
Nb-Os Nb3Os rt Cr3Si,cP8,223 Pm-3n 0.5128,0.5128,0.5128,90,90,90 Frank-Kasper phase - 11.55 X 16230
Nb-P NbP NbAs,tI8,109 I41md 0.33324,0.33324,1.13705,90,90,90 - gray silver 6.52 X 31658
Nb-P NbP 1.7 hp *,t**,* - 0.7468,0.7468,0.7649,90,90,90 - - - N 9545
Nb-P NbP 2 OsGe2,mS12,12 C12/m1 0.88715,0.32663,0.75101,90,119.097,90 - - 5.41 A 3213
Nb-P Nb0.5 P0.5 m In,tI2,139 I4/mmm 0.332,0.332,0.569,90,90,90 - - 3.28 X 590
Nb-P Nb2P Nb2P,oP54,51 Pmma 1.8079,0.3425,1.3858,90,90,90 - - 7.55 X 21121
Nb-P Nb2P 5 hp Nb2P 5,oP28,62 Pnma 1.6742,0.33499,0.7912,90,90,90 - - 5.10 X 13002
Nb-P Nb3P Ti3P,tP32,86 P42 /n 1.01282,1.01282,0.50891,90,90,90 - - 7.88 X 2975
Nb-P Nb5P 3 Nb5P 3,oP64,62 Pnma 2.53843,0.34329,1.14834,90,90,90 - - 7.40 X 5722
Nb-P Nb7P 4 Nb7P 4,mS44,12 C12/m1 1.49503,0.34398,1.38478,90,104.743,90 - - 7.47 X 2973
Nb-P Nb8P 5 Nb8P 5,oP54,55 Pbam 0.94652,2.61998,0.34641,90,90,90 - - 6.94 X 7218
Nb-Pb Nb3Pb hp-ht Cu3Au,cP4,221 Pm-3m 0.4208,0.4208,0.4208,90,90,90 close-packed structure - 10.83 X 8278
Nb-Pb Nb3Pb m Cr3Si,cP8,223 Pm-3n 0.5333,0.5333,0.5333,90,90,90 Frank-Kasper phase - 10.64 X 8266
Nb-Pd NbPd2 MoPt2,oI6,71 Immm 0.2839,0.3886,0.8376,90,90,90 close-packed structure - 10.99 X 2667
Nb-Pd NbPd3 orth NbPd3,oP24,59 Pmmn 0.5486,1.3602,0.4845,90,90,90 close-packed structure - 11.36 X 2099
Nb-Pd NbPd3 tet TiAl3,tI8,139 I4/mmm 0.3895,0.3895,0.7913,90,90,90 close-packed structure - 11.40 X 13593
Nb-Pd Nb0.18Pd0.82 Cu,cF4,225 Fm-3m 0.3905,0.3905,0.3905,90,90,90 close-packed structure - 11.60 X 13593
Nb-Pd Nb0.5 Pd0.5 ht Cu,cF4,225 Fm-3m 0.402,0.402,0.402,90,90,90 close-packed structure - 10.19 X 13593
Nb-Pd Nb0.6 Pd0.4 cub Mn,cI58,217 I-43m 0.977,0.977,0.977,90,90,90 - - 10.15 A 1439
Nb-Pd Nb0.6 Pd0.4 tet (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.989,0.989,0.511,90,90,90 Frank-Kasper phase - 9.80 A 807
Nb-Pd Nb0.75Pd0.25 W,cI2,229 Im-3m 0.3242,0.3242,0.3242,90,90,90 b.c.c. family - 9.38 X 13593
Nb-Pt NbPt AuCd,oP4,51 Pmma 0.46,0.275,0.477,90,90,90 close-packed structure - 15.85 A 8474
Nb-Pt NbPt2 MoPt2,oI6,71 Immm 0.2801,0.3951,0.8459,90,90,90 close-packed structure - 17.14 X 2667
Nb-Pt NbPt3 ht NbPt3,mP16,11 P121/m1 0.4879,0.5537,0.9269,90,100.64,90 close-packed structure - 18.30 X 2099
Nb-Pt NbPt3 rt Cu3Ti,oP8,59 Pmmn 0.4873,0.5534,0.4564,90,90,90 close-packed structure - 18.30 A 18365
Nb-Pt Nb0.18Pt0.82 Cu,cF4,225 Fm-3m 0.394,0.394,0.394,90,90,90 close-packed structure - 19.19 X 18365
Nb-Pt Nb0.62Pt0.38 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9902,0.9902,0.5132,90,90,90 Frank-Kasper phase - 13.04 A 18365
Nb-Pt Nb0.9 Pt0.1 W,cI2,229 Im-3m 0.326,0.326,0.326,90,90,90 b.c.c. family - 9.89 X 18365
Nb-Pt Nb3Pt Cr3Si,cP8,223 Pm-3n 0.51524,0.51524,0.51524,90,90,90 Frank-Kasper phase - 11.50 X 3823
Nb-Re Nb0.01 Re0.99 Mg,hP2,194 P63 /mmc 0.27554,0.27554,0.4446,90,90,120 close-packed structure - 21.05 X 4835
Nb-Re Nb0.25 Re0.75 Mn,cI58,217 I-43m 0.9691,0.9691,0.9691,90,90,90 - - 17.24 A 1527
Nb-Re Nb0.45 Re0.55 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9789,0.9789,0.5099,90,90,90 Frank-Kasper phase - 14.70 X 2081
Nb-Re Nb0.553 Re0.447 rt W,cI2,229 Im-3m 0.314,0.314,0.314,90,90,90 b.c.c. family - 14.44 X 24686
Handbook of Inorganic Substances – Edition 2015 : Data 133

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Nb-Rh NbRh3 Cu3Au,cP4,221 Pm-3m 0.3857,0.3857,0.3857,90,90,90 close-packed structure - 11.62 X 2383


Nb-Rh NbRh3 PuAl3,hP24,194 P63/mmc 0.5483,0.5483,1.3405,90,90,120 close-packed structure - 11.47 A 2383
Nb-Rh Nb0.1 Rh0.9 Cu,cF4,225 Fm-3m 0.3835,0.3835,0.3835,90,90,90 close-packed structure - 12.00 X 2383
Nb-Rh Nb0.7 Rh0.3 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9869,0.9869,0.5106,90,90,90 Frank-Kasper phase - 9.61 A 2383
Nb-Rh Nb0.75 Rh1.25 (Nb0.75 Rh0.25 )Rh,mP18,10 P12/m1 0.4772,0.2806,2.025,90,90.51,90 - - 10.93 X 2384
Nb-Rh Nb0.8 Rh0.2 W,cI2,229 Im-3m 0.3241,0.3241,0.3241,90,90,90 b.c.c. family - 9.26 X 9986
Nb-Rh Nb0.85 Rh1.15 ht AuCd,oP4,51 Pmma 0.451,0.2813,0.4808,90,90,90 close-packed structure - 10.74 X 2384
Nb-Rh Nb0.88 Rh1.12 rt TaIr,oP12,51 Pmma 1.3587,0.2827,0.477,90,90,90 close-packed structure - 10.71 A 2383
Nb-Rh Nb0.96 Rh1.04 rt CuAu,tP2,123 P4/mmm 0.2842,0.2842,0.3809,90,90,90 close-packed structure - 10.59 X 2099
Nb-Rh Nb3 Rh rt Cr3Si,cP8,223 Pm-3n 0.51317,0.51317,0.51317,90,90,90 Frank-Kasper phase - 9.38 X 2765
Nb-Ru NbRu rt hex CuTi,tP2,123 P4/mmm 0.305,0.305,0.341,90,90,90 AlB2 family - 10.15 X 21109
Nb-Ru NbRu3 ht-hp Cu3Au,cP4,221 Pm-3m 0.388,0.388,0.388,90,90,90 close-packed structure - 11.26 X 8696
Nb-Ru Nb0.24 Ru0.76 stab *,hP*,* - 0.834,0.834,1.344,90,90,120 - - - N 2823
Nb-Ru Nb0.25 Ru0.75 rt Mg,hP2,194 P63/mmc 0.275,0.275,0.4418,90,90,120 close-packed structure - 11.37 X 2242
Nb-Ru Nb0.29 Ru0.71 Mg,hP2,194 P63/mmc 0.2762,0.2762,0.4432,90,90,120 close-packed structure - 11.20 X 2242
Nb-Ru Nb0.65 Ru0.35 W,cI2,229 Im-3m 0.3188,0.3188,0.3188,90,90,90 b.c.c. family - 9.82 X 2242
Nb-Ru Nb0.97 Ru1.03 rt orth *,o**,* - 0.3401,0.4228,0.4373,90,90,90 - - - N 5485
Nb-Ru Nb1.24 Ru0.76 ht cub CsCl,cP2,221 Pm-3m 0.321,0.321,0.321,90,90,90 b.c.c. family - 9.64 X 21109
Nb-S NbS hex1 WC,hP2,187 P-6m2 0.332,0.332,0.3225,90,90,120 AlB2 family - 6.74 X 17987
Nb-S NbS hex2 NiAs,hP4,194 P63/mmc 0.325,0.325,0.64,90,90,120 AlB2 family - 7.09 X 17411
Nb-S NbS2 ht NbS2,hP6,194 P63/mmc 0.331,0.331,1.189,90,90,120 - - 4.62 X 1280
Nb-S NbS2 rt MoS2,hR9,160 R3m 0.33303,0.33303,1.7918,90,90,120 - black 4.55 X 8004
Nb-S NbS3 rt mon NbSe3,mP24,11 P121/m1 0.968,0.337,1.46937,90,108.376,90 - black 4.14 A 15336
Nb-S NbS3 rt tricl NbS3,aP16,2 P-1 0.4963,0.6730,0.9144,90,97.17,90 - black 4.14 X 11722
Nb-S Nb0.90 S ht FeAs,oP8,62 Pnma 0.6396,0.3334,0.5845,90,90,90 AlB2 family black 6.16 X 4721
Nb-S Nb0.92 S rt Nb0.92 S,hP16,186 P63mc 0.6702,0.6702,0.6405,90,90,120 AlB2 family - 6.27 X 4721
Nb-S Nb1.88 S3 Nb1.88 S3,hP20,182 P6322 0.5785,0.5785,1.2229,90,90,120 - black 5.08 X 18125
Nb-S Nb14 S5 Nb14 S5,oP76,62 Pnma 1.8480,0.3374,1.9797,90,90,90 - - 7.86 X 7390
Nb-S Nb21 S8 Nb21 S8,tI58,87 I4/m 1.6794,1.6794,0.3359,90,90,90 - - 7.74 X 3837
Nb-S Nb3 S4 Nb3Te4,hP14,176 P63/m 0.95806,0.95806,0.33747,90,90,120 - - 5.04 X 3819
Nb-Sb NbSb NiAs,hP4,194 P63/mmc 0.427,0.427,0.5447,90,90,120 AlB2 family - 8.29 X 3227
Nb-Sb NbSb2 OsGe 2,mS12,12 C12/m1 1.02395,0.36318,0.83322,90,120.035,90 - - 8.33 X 44760
Nb-Sb Nb3 Sb Cr3Si,cP8,223 Pm-3n 0.5261,0.5261,0.5261,90,90,90 Frank-Kasper phase - 9.13 X 44760
Nb-Sb Nb5 Sb4 Ti5 Te4,tI18,87 I4/m 1.03184,1.03184,0.35581,90,90,90 Chevrel phase black 8.34 X 46612
Nb-Se NbSe rt *,hP*,194 P63/mmc 0.3437,0.3437,1.303,90,90,120 - - - N 1693
Nb-Se NbSe 2 3R Nb+ MoS2,hR9,160 R3m 0.345,0.345,1.888,90,90,120 - - 6.42 X 2454
Nb-Se NbSe 2 ht1 4H NbSe2-a,hP12,187 P-6m2 0.344,0.344,2.524,90,90,120 - - 6.44 X 2454
Nb-Se NbSe 2 ht2 4H NbSe2-b,hP12,187 P-6m2 0.348,0.348,2.545,90,90,120 - - 6.24 X 6007
Nb-Se NbSe 2 ht3 1T CdI2 ,hP3,164 P-3m1 0.353,0.353,0.629,90,90,120 CdI2-PbI2 polytype - 6.14 X 6007
Nb-Se NbSe 2 lt 2H NbSe2,hP24,194 P63/mmc 0.688,0.688,1.2482,90,90,120 - - 6.51 X 6823
Nb-Se NbSe 2 rt hex1 MoS2,hP6,194 P63/mmc 0.34449,0.34449,1.2554,90,90,120 - - 6.46 A 24732
Nb-Se NbSe 2 rt hex2 NbS2,hP6,194 P63/mmc 0.34425,0.34425,1.2547,90,90,120 - - 6.47 X 39278
Nb-Se NbSe 3 lt2 NbSe3,mP24,11 P121/m1 1.00086,0.348,1.563,90,109.473,90 - - 6.40 X 26595
Nb-Se NbSe 3 rt NbSe3,mP24,11 P121/m1 1.0009,0.34805,1.5497,90,108.042,90 - black 6.40 X 11677
Nb-Se NbSe 4 tet1 *,t**,* - 2.857,2.857,0.3836,90,90,90 - - - N 2507
Nb-Se NbSe 4 tet2 NbTe 4-b,tP60,75 P4 0.9503,0.9503,1.915,90,90,90 - - 4.71 A 2507
Nb-Se Nb1.1 Se2 Nb1.1 Se2,hP8,187 P-6m2 0.3454,0.3454,1.258,90,90,120 - - 6.65 X 3581
Nb-Se Nb2 Se Nb2Se,mS24,12 C12/m1 1.3992,0.3422,0.9283,90,91.76,90 - - 7.92 X 4384
Nb-Se Nb2 Se3 Mo2 S3,mP10,11 P121/m1 0.6503,0.3434,0.9215,90,103.39,90 - - 7.01 X 3803
Nb-Se Nb2 Se9 Nb2Se9,aP22,2 P-1 0.8160,0.8284,0.8386,98.69,94.14,91.74 - - 5.33 X 19816
Nb-Se Nb3 Se4 Nb3Te4,hP14,176 P63/m 1.00074,1.00074,0.34667,90,90,120 - - 6.57 X 6106
Nb-Se Nb5 Se4 Ti5 Te4,tI18,87 I4/m 0.9871,0.9871,0.34529,90,90,90 Chevrel phase - 7.70 X 1844
Nb-Si NbSi1.9 CrSi2,hP9,180 P6222 0.48011,0.48011,0.65808,90,90,120 - - 5.55 X 58172
Nb-Si Nb0.75 Si0.25 tf W,cI2,229 Im-3m 0.317,0.317,0.317,90,90,90 b.c.c. family - 8.00 X 11572
Nb-Si Nb0.999 Si0.001 W,cI2,229 Im-3m 0.3377,0.3377,0.3377,90,90,90 b.c.c. family - 8.01 X 7482
Nb-Si Nb3 Si hp tf *,tP*,* - 0.698,0.698,1.272,90,90,90 - - - N 11572
Nb-Si Nb3 Si hp Ni3P,tI32,82 I-4 1.039,1.039,0.517,90,90,90 - - 7.30 A 11572
Nb-Si Nb3 Si ht Ti3P,tP32,86 P42/n 1.0224,1.0224,0.5189,90,90,90 - - 7.51 X 8823
Nb-Si Nb3 Si rt Cu3Au,cP4,221 Pm-3m 0.422,0.422,0.422,90,90,90 close-packed structure - 6.78 X 1976
Nb-Si Nb3.61 Si0.39 m Cr3Si,cP8,223 Pm-3n 0.5213,0.5213,0.5213,90,90,90 Frank-Kasper phase - 8.12 X 13621
Nb-Si Nb5 Si3 ht W5Si3,tI32,140 I4/mcm 1.0076,1.0076,0.5096,90,90,90 - - 7.05 A 54418
Nb-Si Nb5 Si3 rt Cr5B3,tI32,140 I4/mcm 0.65767,0.65767,1.18967,90,90,90 - - 7.08 X 58903
Nb-Si Nb5 Si3 stab Mn5 Si3,hP16,193 P63/mcm 0.756,0.756,0.526,90,90,120 - - 7.00 A 790
Nb-Sn NbSn2 Mg2 Cu,oF48,70 Fddd 0.5626,0.9874,1.9116,90,90,90 - - 8.26 X 28807
Nb-Sn Nb0.75 Sn0.25 hp-ht Cu,cF4,225 Fm-3m 0.4412,0.4412,0.4412,90,90,90 close-packed structure - 7.68 X 8278
Nb-Sn Nb0.973 Sn0.027 W,cI2,229 Im-3m 0.3306,0.3306,0.3306,90,90,90 b.c.c. family - 8.60 X 2769
Nb-Sn Nb3 Sn hp *,t*16,* - 0.5169,0.5169,1.0539,90,90,90 - - - N 8278
Nb-Sn Nb3 Sn lt Nb3Sn,tP8,131 P42/mmc 0.5293,0.5293,0.526,90,90,90 - - 8.96 X 6209
Nb-Sn Nb3 Sn rt Cr3Si,cP8,223 Pm-3n 0.527,0.527,0.527,90,90,90 Frank-Kasper phase - 9.02 X 52634
Nb-Sn Nb6 Sn5 ht Ti6Sn5,oI44,71 Immm 0.5656,0.9199,1.6843,90,90,90 AlB2 family - 8.72 X 2474
Nb-T NbT0.18 W,cI2,229 Im-3m 0.3335,0.3335,0.3335,90,90,90 b.c.c. family - 8.37 F 18182
Nb-Ta Ta0.5 Nb0.5 W,cI2,229 Im-3m 0.3306,0.3306,0.3306,90,90,90 b.c.c. family - 12.59 X 4589
Nb-Tc Nb0.06 Tc0.94 Mg,hP2,194 P63/mmc 0.2757,0.2757,0.4432,90,90,120 close-packed structure - 11.12 X 5312
Nb-Tc Nb0.25 Tc0.75 Mn,cI58,217 I-43m 0.9592,0.9592,0.9592,90,90,90 - - 10.56 A 5312
Nb-Tc Nb0.5 Tc0.5 W,cI2,229 Im-3m 0.317,0.317,0.317,90,90,90 b.c.c. family - 9.95 X 1957
Nb-Te NbTe *,hR*,166 R-3m 1.0904,1.0904,2.0119,90,90,120 - - - N 1693
Nb-Te NbTe 1.86 *,h**,* - 1.091,1.091,2.014,90,90,120 - - - N 6957
Nb-Te NbTe 2 ht2 *,o**,* - 0.598,0.678,0.686,90,90,90 - - - N 21753
134 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Nb-Te NbTe2 rt NbTe2,mS18,12 C12/m1 1.474,0.3642,0.9375,90,110.41,90 - - 7.35 X 2889


Nb-Te NbTe4 hp *,oS16,63 Cmcm 0.3611,1.3265,0.8681,90,90,90 - - - N 3880
Nb-Te NbTe4 ht NbTe4,tP10,124 P4/mcc 0.6551,0.6551,0.6847,90,90,90 - - 6.82 X 20876
Nb-Te NbTe4 lt1 NbTe4,tP120,75 P4 1.2967,1.2967,2.0465,90,90,90 - - 6.99 X 28522
Nb-Te NbTe4 rt NbTe4,tP10,124 P4/mcc 0.6499,0.6499,0.6837,90,90,90 - - 6.94 X 18895
Nb-Te Nb3Te hp Cr3Si,cP8,223 Pm-3n 0.5261,0.5261,0.5261,90,90,90 Frank-Kasper phase - 9.27 X 8339
Nb-Te Nb3Te4 rt Nb3Te4,hP14,176 P63 /m 1.06338,1.06338,0.36371,90,90,120 - - 7.36 X 38493
Nb-Te Nb3Te7 rt *,tP*,* - 0.6469,0.6469,0.682,90,90,90 - - - N 6732
Nb-Te Nb3Te8 rt *,tP*,* - 0.6486,0.6486,0.682,90,90,90 - - - N 6732
Nb-Te Nb4.7 Te4 Nb4.7 Te4,mS18,12 C12/m1 1.4443,0.3696,1.0132,90,134.47,90 Chevrel phase - 8.15 X 26876
Nb-Te Nb5Te4 Ti5 Te4,tI18,87 I4/m 1.0231,1.0231,0.37194,90,90,90 Chevrel phase - 8.32 X 1844
Nb-Th Th0.997 Nb0.003 rt Cu,cF4,225 Fm-3m 0.5086,0.5086,0.5086,90,90,90 close-packed structure - 11.69 X 806
Nb-Ti Ti0.75 Nb0.25 ht W,cI2,229 Im-3m 0.32888,0.32888,0.32888,90,90,90 b.c.c. family - 5.52 X 52549
Nb-Ti Ti0.92 Nb0.08 rt (Cu0.75 Ti0.25),oS4,63 Cmcm 0.298,0.50761,0.46949,90,90,90 close-packed structure - 4.82 X 52594
Nb-Ti Ti0.97 Nb0.03 rt Mg,hP2,194 P63 /mmc 0.2946,0.2946,0.4683,90,90,120 close-packed structure - 4.65 X 532
Nb-Tl TlNb3 m Cr3Si,cP8,223 Pm-3n 0.5297,0.5297,0.5297,90,90,90 Frank-Kasper phase - 10.80 X 8266
Nb-U U0.5 Nb0.5 W,cI2,229 Im-3m 0.3402,0.3402,0.3402,90,90,90 b.c.c. family - 13.96 X 1488
Nb-U U0.8 Nb0.2 *,t**,* - 0.346,0.346,0.341,90,90,90 - - - N 1798
Nb-V Nb0.0625 V0.9375 W,cI2,229 Im-3m 0.3051,0.3051,0.3051,90,90,90 b.c.c. family - 6.26 X 51255
Nb-W Nb0.5 W0.5 W,cI2,229 Im-3m 0.32224,0.32224,0.32224,90,90,90 b.c.c. family - 13.73 X 3593
Nb-Y Y0.001 Nb0.999 W,cI2,229 Im-3m 0.33018,0.33018,0.33018,90,90,90 b.c.c. family - 8.57 X 9090
Nb-Zn Zn2Nb MgNi2,hP24,194 P63 /mmc 0.505,0.505,1.632,90,90,120 Friauf-Laves phase - 8.24 X 1361
Nb-Zn Zn3Nb Cu3Au,cP4,221 Pm-3m 0.3934,0.3934,0.3934,90,90,90 close-packed structure gray faint 7.88 X 15750
Nb-Zn Zn3Nb2 *,h**,* - 0.506,0.506,2.643,90,90,120 - - - N 2821
Nb-Zn Zn7Nb6 W6Fe7,hR39,166 R-3m 0.507,0.507,2.749,90,90,120 Frank-Kasper phase - 8.26 A 4196
Nb-Zr Zr0.19 Nb0.81 tf Cu,cF4,225 Fm-3m 0.435,0.435,0.435,90,90,90 close-packed structure - 7.47 X 28922
Nb-Zr Zr0.686 Nb0.314 ht W,cI2,229 Im-3m 0.3497,0.3497,0.3497,90,90,90 b.c.c. family - 7.13 X 37319
Nb-Zr Zr0.903 Nb0.097 m (Ti0.95 Cr0.05),hP3,164 P-3m1 0.5023,0.5023,0.3095,90,90,120 - - 6.73 X 37319
Nb-Zr Zr0.95 Nb0.05 tf Cu,cF4,225 Fm-3m 0.4554,0.4554,0.4554,90,90,90 close-packed structure - 6.42 X 51157
Nb-Zr Zr0.953 Nb0.047 rt Mg,hP2,194 P63 /mmc 0.3216,0.3216,0.5134,90,90,120 close-packed structure - 6.59 X 37319
Nd-Ni NdNi TlI,oS8,63 Cmcm 0.38059,1.0462,0.43345,90,90,90 CrB(TlI)-FeB - 7.81 X 37411
Nd-Ni NdNi2 rt MgCu2,cF24,227 Fd-3m 0.727,0.727,0.727,90,90,90 Friauf-Laves phase - 9.05 X 7591
Nd-Ni NdNi3 PuNi3,hR36,166 R-3m 0.5015,0.5015,2.467,90,90,120 Laves-CaCu5 - 8.91 A 4708
Nd-Ni NdNi5 CaCu5,hP6,191 P6/mmm 0.4973,0.4973,0.40124,90,90,120 - - 8.46 X 37411
Nd-Ni Nd0.947 Ni2 TmNi2,cF192,216 F-43m 1.4532,1.4532,1.4532,90,90,90 Friauf-Laves phase - 8.80 X 28375
Nd-Ni Nd2Ni17 ht Th2Ni17,hP38,194 P63 /mmc 0.8402,0.8402,0.8048,90,90,120 CaCu5-Zr4Al3 - 8.68 X 4708
Nd-Ni Nd2Ni7 hex Ce2Ni7,hP36,194 P63 /mmc 0.4981,0.4981,2.438,90,90,120 Laves-CaCu5 - 8.87 A 4708
Nd-Ni Nd2Ni7 ht1 *,hP144,* - 0.4981,0.4981,9.697,90,90,120 - - - N 4708
Nd-Ni Nd2Ni7 ht2 *,hP144,* - 0.4986,0.4986,7.263,90,90,120 - - - N 4708
Nd-Ni Nd2Ni7 rhom Gd2Co7,hR54,166 R-3m 0.4983,0.4983,3.66,90,90,120 Laves-CaCu5 - 8.85 A 5333
Nd-Ni Nd3Ni Fe3C-b,oP16,62 Pnma 0.704,0.986,0.643,90,90,90 - - 7.31 A 3471
Nd-Ni Nd7Ni3 Th7Fe3,hP20,186 P63 mc 0.98732,0.98732,0.62977,90,90,120 - - 7.41 X 46599
Nd-O NdO hp-ht NaCl,cF8,225 Fm-3m 0.4994,0.4994,0.4994,90,90,90 rocksalt family golden 8.55 X 14372
Nd-O NdO[O2]0.5 NdO2,mS12,12 C12/m1 0.66495,0.40173,0.65174,90,98.11,90 - blue light 6.79 X 19952
Nd-O NdO1.5 ht NdO1.5 ,cI26,229 Im-3m 0.441,0.441,0.441,90,90,90 - - 6.51 X 12610
Nd-O Nd2O3 ht1 La2O3,hP10,194 P63 /mmc 0.384,0.384,0.601,90,90,120 - blue pale 7.28 X 3272
Nd-O Nd2O3 rt La2O3,hP5,164 P-3m1 0.38277,0.38277,0.59908,90,90,120 - blue 7.35 X 14971
Nd-O Nd2O3 stab (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.1036,1.1036,1.1036,90,90,90 - - 6.65 A 55407
Nd-O Nd2O3 tf Sm2O3,mS30,12 C12/m1 1.43,0.369,0.893,90,100.,90 - - 7.22 A 6946
Nd-Os NdOs2 MgZn2,hP12,194 P63 /mmc 0.5368,0.5368,0.8926,90,90,120 Friauf-Laves phase - 15.64 X 1059
Nd-Os Nd3Os Fe3C-b,oP16,62 Pnma 0.7438,0.9522,0.6427,90,90,90 - - 9.09 A 13334
Nd-P NdP rt NaCl,cF8,225 Fm-3m 0.5835,0.5835,0.5835,90,90,90 rocksalt family - 5.86 X 7547
Nd-P NdP 2 NdAs2,mP12,14 P121/c1 0.40031,0.65374,1.009,90,105.8,90 - - 5.39 A 40675
Nd-P NdP 5 NdP 5,mP12,11 P121/m1 0.4938,0.9551,0.5444,90,103.27,90 - black gray 3.98 X 10222
Nd-Pb NdPb3 Cu3Au,cP4,221 Pm-3m 0.4852,0.4852,0.4852,90,90,90 close-packed structure - 11.13 X 7425
Nd-Pb Nd5Pb3 Mn5Si3,hP16,193 P63 /mcm 0.9264,0.9264,0.677,90,90,120 - - 8.86 X 2882
Nd-Pb Nd5Pb4 Sm5Ge4,oP36,62 Pnma 0.8331,1.504,0.8467,90,90,90 - - 9.70 A 4345
Nd-Pd NdPd rt TlI,oS8,63 Cmcm 0.3827,1.079,0.4547,90,90,90 CrB(TlI)-FeB - 8.87 A 24553
Nd-Pd NdPd3 Cu3Au,cP4,221 Pm-3m 0.4125,0.4125,0.4125,90,90,90 close-packed structure - 10.96 X 25721
Nd-Pd NdPd5 ht *,oP72,* - 0.5265,0.9219,2.57,90,90,90 - - - N 49545
Nd-Pd Nd0.03Pd0.97 Cu,cF4,225 Fm-3m 0.39065,0.39065,0.39065,90,90,90 close-packed structure - 11.98 X 24553
Nd-Pd Nd3Pd4 rt Pu3Pd4,hR42,148 R-3 1.3541,1.3541,0.579,90,90,120 b.c.c. family - 9.30 A 8276
Nd-Pd Nd7Pd3 Th7Fe3,hP20,186 P63 mc 1.0131,1.0131,0.6386,90,90,120 - - 7.78 A 7492
Nd-Pr Pr0.5 Nd0.5 rt Nd,hP4,194 P63 /mmc 0.36646,0.36646,1.18181,90,90,120 close-packed structure - 6.89 X 2527
Nd-Pt NdPt ht TlI,oS8,63 Cmcm 0.3846,1.0769,0.4542,90,90,90 CrB(TlI)-FeB - 11.98 X 15600
Nd-Pt NdPt rt FeB-b,oP8,62 Pnma 0.7239,0.455,0.5675,90,90,90 CrB(TlI)-FeB - 12.06 A 11925
Nd-Pt NdPt2 MgCu2,cF24,227 Fd-3m 0.7694,0.7694,0.7694,90,90,90 Friauf-Laves phase - 15.59 X 5632
Nd-Pt NdPt5 CaCu5,hP6,191 P6/mmm 0.5346,0.5346,0.4392,90,90,120 - - 17.10 X 28834
Nd-Pt Nd0.75Pt2.25 MgCu2,cF24,227 Fd-3m 0.76258,0.76258,0.76258,90,90,90 Friauf-Laves phase - 16.39 X 7477
Nd-Pt Nd3Pt2 Er3Ni2,hR45,148 R-3 0.8893,0.8893,1.6871,90,90,120 - - 10.64 A 10402
Nd-Pt Nd3Pt4 Pu3Pd4,hR42,148 R-3 1.353,1.353,0.5746,90,90,120 b.c.c. family - 13.27 A 10744
Nd-Pt Nd7Pt3 Th7Fe3,hP20,186 P63 mc 1.0099,1.0099,0.6351,90,90,120 - - 9.44 A 7500
Nd-Pu Nd0.75Pu0.25 rt Nd,hP4,194 P63 /mmc 0.3597,0.3597,1.1614,90,90,120 close-packed structure - 8.64 X 4759
Nd-Re NdRe2 MgZn2,hP12,194 P63 /mmc 0.5364,0.5364,0.8772,90,90,120 Friauf-Laves phase - 15.70 A 2437
Nd-Rh NdRh TlI,oS8,63 Cmcm 0.389,1.084,0.4247,90,90,90 CrB(TlI)-FeB - 9.17 A 5490
Nd-Rh NdRh2 MgCu2,cF24,227 Fd-3m 0.7585,0.7585,0.7585,90,90,90 Friauf-Laves phase - 10.66 X 5490
Nd-Rh NdRh3 m Cu3Au,cP4,221 Pm-3m 0.417,0.417,0.417,90,90,90 close-packed structure - 10.37 X 56412
Nd-Rh NdRh3 CeNi3,hP24,194 P63 /mmc 0.5266,0.5266,1.747,90,90,120 Laves-CaCu5 - 10.76 A 56412
Handbook of Inorganic Substances – Edition 2015 : Data 135

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Nd-Rh Nd3 Rh2 Er3Ni2,hR45,148 R-3 0.8761,0.8761,1.664,90,90,120 - - 8.63 A 10402


Nd-Rh Nd3.2 Rh0.8 Fe3C-b,oP16,62 Pnma 0.7258,0.984,0.6431,90,90,90 - - 7.87 A 5490
Nd-Rh Nd5 Rh4 Sm5 Ge4,oP36,62 Pnma 0.7396,1.481,0.7645,90,90,90 - - 8.99 A 9915
Nd-Rh Nd7 Rh3 Th7Fe3,hP20,186 P63mc 1.003,1.003,0.6336,90,90,120 - - 7.93 A 6734
Nd-Ru NdRu2 hp MgZn2,hP12,194 P63/mmc 0.5293,0.5293,0.8955,90,90,120 Friauf-Laves phase - 10.59 A 17698
Nd-Ru NdRu2 MgCu2,cF24,227 Fd-3m 0.7608,0.7608,0.7608,90,90,90 Friauf-Laves phase - 10.45 X 23494
Nd-Ru Nd0.05 Ru0.95 Mg,hP2,194 P63/mmc 0.2721,0.2721,0.4303,90,90,120 close-packed structure - 12.43 X 17698
Nd-Ru Nd3 Ru Fe3C-b,oP16,62 Pnma 0.7353,0.9649,0.6406,90,90,90 - - 7.80 A 23494
Nd-Ru Nd5 Ru2 Mn5 C2,mS28,15 C12/c1 1.629,0.6503,0.733,90,96.63,90 - - 7.95 A 23494
Nd-Ru Nd5 Ru3 *,o**,* - 1.56,1.56,18.63,90,90,90 - - - N 23494
Nd-Ru Nd7 Ru3 Sr7Pt3,oP40,62 Pnma 0.7303,2.283,0.6532,90,90,90 - - 8.01 A 23494
Nd-S NdS lt *,t*8,* - 0.40234,0.40234,0.5673,90,90,90 - - - N 9388
Nd-S NdS rt NaCl,cF8,225 Fm-3m 0.57,0.57,0.57,90,90,90 rocksalt family golden 6.32 X 18454
Nd-S NdS2 mon CeSe 2,mP12,14 P121/c1 0.8032,0.4019,0.8008,90,90,90 - red dark 5.35 X 53589
Nd-S NdS2 tet NdS2,tP24,117 P-4b2 0.8044,0.8044,0.8034,90,90,90 - golden 5.32 X 6958
Nd-S NdS2.67 *,oP8,59 Pmmn 0.4071,0.9244,0.4085,90,90,90 - - - N 11830
Nd-S Nd10 S19 Ce10 Se19,tP58,86 P42/n 0.8901,0.8901,1.6022,90,90,90 - - 5.37 X 49625
Nd-S Nd2 S3 cub *,cF*,227 Fd-3m 1.992,1.992,1.992,90,90,90 - - - N 10945
Nd-S Nd2 S3 rt Cr3C2-b,oP20,62 Pnma 0.74397,0.40278,1.55196,90,90,90 - black red 5.49 X 26831
Nd-S Nd2.67 S4 ht Th3P 4,cI28,220 I-43d 0.8529,0.8529,0.8529,90,90,90 - green 5.50 X 30219
Nd-S Nd3 S4 Th3P 4,cI28,220 I-43d 0.8526,0.8526,0.8526,90,90,90 - black 6.01 A 4496
Nd-S Nd4 S7 Nd4S7,tP11,111 P-42m 0.5597,0.5597,0.8030,90,90,90 - - 5.29 X 6958
Nd-S Nd5 S7 *,tI192,142 I41/acd 1.494,1.494,1.982,90,90,90 - - - N 3985
Nd-Sb NdSb hp CuTi,tP2,123 P4/mmm 0.3806,0.3806,0.3123,90,90,90 b.c.c. family - 9.76 X 38036
Nd-Sb NdSb lt CoO,tI4,139 I4/mmm 0.4463,0.4463,0.6294,90,90,90 - - 7.05 X 7547
Nd-Sb NdSb rt NaCl,cF8,225 Fm-3m 0.6338,0.6338,0.6338,90,90,90 rocksalt family - 6.94 X 52560
Nd-Sb NdSb2 hp-ht SmSb2,oS24,64 Cmce 0.6326,0.6102,1.8086,90,90,90 - - 7.38 A 36493
Nd-Sb Nd2 Sb La2Sb,tI12,139 I4/mmm 0.45134,0.45134,1.75823,90,90,90 - - 7.61 X 45831
Nd-Sb Nd4 Sb3 Th3P 4,cI28,220 I-43d 0.94,0.94,0.94,90,90,90 - gray 7.54 X 54538
Nd-Sb Nd5 Sb3 Mn5 Si3,hP16,193 P63/mcm 0.918,0.918,0.6463,90,90,120 - - 7.65 X 3842
Nd-Sb Nd8.33 Sb20 Pr8.33 Sb20,mS62,8 C1m1 2.8452,0.4247,1.3459,90,95.42,90 - - 7.46 X 41926
Nd-Se NdSe lt *,t*8,* - 0.58995,0.58995,0.58832,90,90,90 - - - N 9388
Nd-Se NdSe rt NaCl,cF8,225 Fm-3m 0.59,0.59,0.59,90,90,90 rocksalt family golden 7.22 X 18454
Nd-Se NdSe 1.83 UAs2,tP6,129 P4/nmm 0.4123,0.4123,0.8396,90,90,90 - black 6.72 X 53531
Nd-Se NdSe 1.9 hp *,cI24,* - 0.8007,0.8007,0.8007,90,90,90 - - - N 5283
Nd-Se NdSe 2 CeSe 2,mP12,14 P121/c1 0.8412,0.4164,0.8352,90,90,90 - gray silver 6.86 X 45644
Nd-Se Nd10 Se19 Ce10 Se19,tP58,86 P42/n 0.92536,0.92536,1.6792,90,90,90 - gray 6.80 X 23090
Nd-Se Nd2.67 Se4 ht Th3P 4,cI28,220 I-43d 0.88632,0.88632,0.88632,90,90,90 - red ruby 6.69 X 51728
Nd-Se Nd3 Se4 Th3P 4,cI28,220 I-43d 0.8879,0.8879,0.8879,90,90,90 - - 7.10 A 5199
Nd-Si NdSi FeB-b,oP8,62 Pnma 0.81376,0.39315,0.59101,90,90,90 CrB(TlI)-FeB gray 6.05 A 58846
Nd-Si NdSi1.58 rt GdSi1.4 ,oI12,74 Imma 0.40924,0.41306,1.37455,90,90,90 - gray 5.39 X 24966
Nd-Si NdSi1.6 rt AlB2 ,hP3,191 P6/mmm 0.3948,0.3948,0.4269,90,90,120 AlB2 family - 5.45 X 23654
Nd-Si NdSi1.8 ht ThSi2,tI12,141 I41/amd 0.4142,0.4142,1.365,90,90,90 - - 5.53 X 22489
Nd-Si Nd2 Si2.8 rt Ho2Si2.67 ,oS24,63 Cmcm 0.43589,2.45774,0.39161,90,90,90 - - 5.81 X 38778
Nd-Si Nd5 Si3 hex1 *,hP48,* - 1.5045,1.5045,0.6623,90,90,120 - - - N 17145
Nd-Si Nd5 Si3 hex2 Mn5 Si3,hP16,193 P63/mcm 0.8671,0.8671,0.6577,90,90,120 - - 6.25 A 46633
Nd-Si Nd5 Si3 orth *,o**,* - 0.7621,0.793,1.513,90,90,90 - - - N 17145
Nd-Si Nd5 Si3 tet1 Cr5B3,tI32,140 I4/mcm 0.7761,0.7761,1.3804,90,90,90 - - 6.43 X 46633
Nd-Si Nd5 Si3 tet2 *,t**,* - 0.7832,0.7832,1.4683,90,90,90 - - - N 17145
Nd-Si Nd5 Si4 orth Gd5Si4,oP36,62 Pnma 0.7687,1.50835,0.7892,90,90,90 - - 6.05 X 46633
Nd-Si Nd5 Si4 tet Zr5Si4,tP36,92 P41212 0.7873,0.7873,1.48389,90,90,90 - - 6.02 X 46633
Nd-Si Nd65 Si35 *,o**,* - 0.321,0.7461,0.8556,90,90,90 - - - N 17145
Nd-Sm Nd0.2 Sm0.8 rt Sm,hR9,166 R-3m 0.3636,0.3636,2.629,90,90,120 close-packed structure - 7.41 A 18139
Nd-Sm Nd0.5 Sm0.5 rt Nd,hP4,194 P63/mmc 0.364,0.364,1.174,90,90,120 close-packed structure - 7.26 X 18139
Nd-Sn NdSn2 ZrGa2,oS12,65 Cmmm 0.44404,1.59436,0.45628,90,90,90 close-packed structure - 7.85 X 26419
Nd-Sn NdSn3 rt Cu3Au,cP4,221 Pm-3m 0.471,0.471,0.471,90,90,90 close-packed structure - 7.95 X 28969
Nd-Sn Nd11 Sn10 Ho11 Ge10,tI84,139 I4/mmm 1.1844,1.1844,1.76122,90,90,90 - - 7.46 A 26419
Nd-Sn Nd2 Sn3 Nd2Sn3,aP20,2 P-1 0.6378,0.8422,1.1098,107.37,96.78,100.03 - - 7.77 X 42507
Nd-Sn Nd2 Sn5 Ce2Sn5,oS28,65 Cmmm 0.4576,3.5123,0.4616,90,90,90 close-packed structure - 7.90 A 27469
Nd-Sn Nd3 Sn7 Ce3Sn7,oS20,65 Cmmm 0.449,2.577,0.4587,90,90,90 close-packed structure - 7.91 A 35716
Nd-Sn Nd5 Sn3 Mn5 Si3,hP16,193 P63/mcm 0.9248,0.9248,0.6735,90,90,120 - - 7.17 X 27601
Nd-Sn Nd5 Sn4 Sm5 Ge4,oP36,62 Pnma 0.82012,1.5783,0.83354,90,90,90 - - 7.36 X 44973
Nd-Te NdTe lt *,t*8,* - 0.62715,0.62715,0.6262,90,90,90 - - - N 9388
Nd-Te NdTe rt NaCl,cF8,225 Fm-3m 0.627,0.627,0.627,90,90,90 rocksalt family violet 7.33 X 18454
Nd-Te NdTe 1.89 UAs2,tP6,129 P4/nmm 0.4377,0.4377,0.906,90,90,90 - black 7.37 X 3064
Nd-Te NdTe 1.9 NdTe 1.9 ,oS180,38 Amm2 1.3289,1.7677,1.8069,90,90,90 - black 7.26 X 39569
Nd-Te NdTe 3 CeTe 3,oS16,40 Ama2 0.43629,2.58515,0.43469,90,90,90 - golden 7.14 X 44787
Nd-Te Nd0.5 Te0.5 ht Po,cP1,221 Pm-3m 0.3125,0.3125,0.3125,90,90,90 - - 7.40 X 2439
Nd-Te Nd2 Te3 rt Th2S3,oP20,62 Pnma 1.21856,0.43869,1.18687,90,90,90 - black 7.03 X 39730
Nd-Te Nd2 Te5 ht Nd2Te5,oS28,63 Cmcm 0.4409,4.41,0.4409,90,90,90 - brown 7.18 X 3452
Nd-Te Nd3 Te4 ht Th3P 4,cI28,220 I-43d 0.94356,0.94356,0.94356,90,90,90 - gray silver 7.46 X 56218
Nd-Te Nd4 Te7 *,tP22,127 P4/mbm 0.8799,0.8799,0.9001,90,90,90 - - - N 3111
Nd-Th Th0.1 Nd0.9 rt Nd,hP4,194 P63/mmc 0.3646,0.3646,1.1765,90,90,120 close-packed structure - 7.50 X 3720
Nd-Th Th0.2 Nd0.8 rt Cu,cF4,225 Fm-3m 0.513,0.513,0.513,90,90,90 close-packed structure - 7.96 X 4836
Nd-Tl TlNd lt CuTi,tP2,123 P4/mmm 0.362,0.362,0.432,90,90,90 b.c.c. family - 10.23 X 14458
Nd-Tl TlNd rt CsCl,cP2,221 Pm-3m 0.3848,0.3848,0.3848,90,90,90 b.c.c. family gray silver 10.16 X 2673
Nd-Tl TlNd2 Co1.75 Ge,hP6,194 P63/mmc 0.552,0.552,0.6816,90,90,120 AlB2 family - 9.10 X 11612
Nd-Tl TlNd3 Cu3Au,cP4,221 Pm-3m 0.4922,0.4922,0.4922,90,90,90 close-packed structure - 8.87 X 11612
136 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Nd-Tl Tl3Nd Cu3Au,cP4,221 Pm-3m 0.4737,0.4737,0.4737,90,90,90 close-packed structure - 11.83 X 11612


Nd-Tl Tl3Nd5 rt W5Si3,tI32,140 I4/mcm 1.246,1.246,0.6185,90,90,90 - - 9.23 A 11612
Nd-Tl Tl5Nd3 Pu3Pd5,oS32,63 Cmcm 1.021,0.823,1.044,90,90,90 - - 11.01 A 11612
Nd-Tm Nd0.5 Tm0.5 rt Nd,hP4,194 P63 /mmc 0.36,0.36,1.15,90,90,120 close-packed structure - 8.06 X 3218
Nd-Tm Nd0.5 Tm0.5 rt Sm,hR9,166 R-3m 0.35,0.35,2.6,90,90,120 close-packed structure - 8.48 A 3218
Nd-Y Y0.2 Nd0.8 rt Nd,hP4,194 P63 /mmc 0.3654,0.3654,1.1781,90,90,120 close-packed structure - 6.49 X 2438
Nd-Y Y0.35 Nd0.65 rt Sm,hR9,166 R-3m 0.3662,0.3662,2.6382,90,90,120 close-packed structure - 6.09 A 2438
Nd-Y Y0.431 Nd0.569 rt Mg,hP2,194 P63 /mmc 0.3681,0.3681,0.5833,90,90,120 close-packed structure - 5.84 X 2438
Nd-Zn ZnNd hp AuCd,oP4,51 Pmma 0.4772,0.3361,0.5142,90,90,90 close-packed structure - 8.44 A 33099
Nd-Zn ZnNd lt2 CuTi,tP2,123 P4/mmm 0.365,0.365,0.3661,90,90,90 b.c.c. family - 7.14 X 9066
Nd-Zn ZnNd rt CsCl,cP2,221 Pm-3m 0.3666,0.3666,0.3666,90,90,90 b.c.c. family gray silver 7.07 X 9066
Nd-Zn Zn11Nd BaCd11,tI48,141 I41/amd 1.064,1.064,0.6842,90,90,90 - - 7.40 X 2632
Nd-Zn Zn11Nd3 La3Al11,oI28,71 Immm 0.4485,0.8855,1.3318,90,90,90 - - 7.23 A 5331
Nd-Zn Zn17Nd2 ht Zn17Th2,hR57,166 R-3m 0.90497,0.90497,1.32334,90,90,120 CaCu5-Zr4Al3 gray 7.43 X 20156
Nd-Zn Zn17Nd2 rt Th2Ni17,hP38,194 P63 /mmc 0.9013,0.9013,0.8889,90,90,120 CaCu5-Zr4Al3 - 7.44 A 20169
Nd-Zn Zn2Nd KHg2,oI12,74 Imma 0.4597,0.7408,0.7555,90,90,90 AlB2 family - 7.10 X 7502
Nd-Zn Zn22Nd3 Zn22Ce3,tI100,141 I41/amd 0.8898,0.8898,2.129,90,90,90 - - 7.37 A 20169
Nd-Zn Zn3Nd Zn3Y,oP16,62 Pnma 0.6717,0.4544,1.0284,90,90,90 - - 7.20 A 5331
Nd-Zn Zn5Nd CaCu5,hP6,191 P6/mmm 0.5404,0.5404,0.4243,90,90,120 - - 7.29 X 7490
Nd-Zn Zn58.35 Nd12.82 Zn58.7 Y12.65 ,hP146,194 P63 /mmc 1.4514,1.4514,1.4124,90,90,120 - - 7.30 X 47696
Ni-Np NpNi2 MgCu2,cF24,227 Fd-3m 0.7098,0.7098,0.7098,90,90,90 Friauf-Laves phase - 13.17 X 9263
Ni-Np NpNi5 CaCu5,hP6,191 P6/mmm 0.4859,0.4859,0.3991,90,90,120 - - 10.80 X 33223
Ni-O NiO AFM CoO,mS4,12 C12/m1 0.51099,0.29556,0.29514,90,125.2,90 - - 6.81 X 9191
Ni-O NiO ht NaCl,cF8,225 Fm-3m 0.41786,0.41786,0.41786,90,90,90 bunsenite green 6.80 X 58340
Ni-O NiO rt NiO,hR6,166 R-3m 0.29549,0.29549,0.7232,90,90,120 rocksalt family grayish 6.81 X 37999
Ni-O NiO2 m mon CuBr2,mS6,12 C12/m1 0.48754,0.28141,0.48023,90,109.554,90 - - 4.85 X 36283
Ni-O NiO2 m trig CdI2,hP3,164 P-3m1 0.2818,0.2818,0.4367,90,90,120 CdI2 -PbI2 polytype grayish 5.01 X 40440
Ni-O Ni1.01O2 (Li) NaFeO2,hR12,166 R-3m 0.28353,0.28353,1.43319,90,90,120 rocksalt family - 4.56 X 31000
Ni-O Ni2O3 tf *,hP*,* - 0.461,0.461,0.561,90,90,120 - - - N 1465
Ni-O Ni3.75 O4 FM Ni3.75 O4,mS36,12 C12/m1 1.02294,0.59149,0.59083,90,125.187,90 - - 6.46 X 787
Ni-Os Os0.89 Ni0.11 Mg,hP2,194 P63 /mmc 0.27278,0.27278,0.4309,90,90,120 close-packed structure - 21.02 X 56225
Ni-P NiP hp NiP,oS56,36 Cmc21 2.3801,0.59238,0.48479,90,90,90 - - 6.10 X 56862
Ni-P NiP ht NiP,oP16,61 Pbca 0.48684,0.68788,0.6036,90,90,90 AlB2 family - 5.89 X 56862
Ni-P NiP2 hp FeS2,cP12,205 Pa-3 0.54706,0.54706,0.54706,90,90,90 negevite - 4.89 X 4040
Ni-P NiP2 PdP2,mS12,15 C12/c1 0.6352,0.56042,0.5621,90,119.62,90 - gray 4.61 X 37795
Ni-P NiP3 ht CoAs3,cI32,204 Im-3 0.78157,0.78157,0.78157,90,90,90 - black 4.22 X 38122
Ni-P Ni12P 5 rt Ni12P 5,tI34,87 I4/m 0.8646,0.8646,0.507,90,90,90 - - 7.53 X 1082
Ni-P Ni2P Fe2P,hP9,189 P-62m 0.5859,0.5859,0.3382,90,90,120 transjordanite - 7.35 X 1635
Ni-P Ni3P m cub *,cF*,* - 0.55,0.55,0.55,90,90,90 - - - N 18394
Ni-P Ni3P m hex1 *,hP*,* - 0.672,0.672,0.952,90,90,120 - - - N 18394
Ni-P Ni3P m hex2 *,hP*,* - 0.672,0.672,1.428,90,90,120 - - - N 18394
Ni-P Ni3P m hex3 *,hP*,* - 0.672,0.672,3.808,90,90,120 - - - N 18394
Ni-P Ni3P Ni3P,tI32,82 I-4 0.89499,0.89499,0.4385,90,90,90 nickelphosphide - 7.83 X 42083
Ni-P Ni5P 2 ht Ni5As2,hP48,185 P63 cm 0.65795,0.65795,1.2261,90,90,120 - - 7.70 X 56207
Ni-P Ni5P 4 Ni5P 4,hP36,186 P63 mc 0.67921,0.67921,1.09922,90,90,120 halamishite - 6.31 X 47906
Ni-P Ni5.1P2 rt Ni5P 2,hP62,165 P-3c1 0.6613,0.6613,1.2311,90,90,120 - - 7.72 X 43677
Ni-P Ni8P 3 rt Pd8Sb3,hR132,161 R3c 0.6613,0.6613,3.7914,90,90,120 - - 7.81 X 20711
Ni-Pb NiPb lt m NiAs,hP4,194 P63 /mmc 0.415,0.415,0.528,90,90,120 AlB2 family - 11.21 X 3950
Ni-Pb NiPb rt m *,hP*,* - 0.92,0.92,0.29,90,90,120 - - - N 3950
Ni-Pd Ni0.25Pd0.75 m Mg,hP2,194 P63 /mmc 0.276,0.276,0.452,90,90,120 close-packed structure - 10.52 X 56181
Ni-Pd Ni0.46Pd0.54 Cu,cF4,225 Fm-3m 0.37563,0.37563,0.37563,90,90,90 close-packed structure - 10.58 X 52787
Ni-Po NiPo NiAs,hP4,194 P63 /mmc 0.395,0.395,0.568,90,90,120 AlB2 family - 11.58 X 1261
Ni-Pr PrNi TlI,oS8,63 Cmcm 0.38307,1.0543,0.4369,90,90,90 CrB(TlI)-FeB - 7.51 X 42199
Ni-Pr PrNi2 MgCu2,cF24,227 Fd-3m 0.7275,0.7275,0.7275,90,90,90 Friauf-Laves phase - 8.91 X 25319
Ni-Pr PrNi3 PuNi3,hR36,166 R-3m 0.5038,0.5038,2.481,90,90,120 Laves-CaCu5 - 8.69 A 14667
Ni-Pr PrNi5 CaCu5,hP6,191 P6/mmm 0.4957,0.4957,0.3973,90,90,120 - - 8.53 X 30997
Ni-Pr Pr2Ni7 hex Ce2Ni7,hP36,194 P63 /mmc 0.5009,0.5009,2.4472,90,90,120 Laves-CaCu5 - 8.65 A 56772
Ni-Pr Pr2Ni7 rhom Gd2Co7,hR54,166 R-3m 0.4991,0.4991,3.646,90,90,120 Laves-CaCu5 - 8.78 A 56772
Ni-Pr Pr3Ni Fe3C-b,oP16,62 Pnma 0.707,0.996,0.649,90,90,90 - - 7.00 A 3471
Ni-Pr Pr5Ni19 hex Sm5Co19,hP48,194 P63 /mmc 0.4999,0.4999,3.241,90,90,120 Laves-CaCu5 - 8.62 A 56772
Ni-Pr Pr5Ni19 rhom Ce5Co19,hR72,166 R-3m 0.4998,0.4998,4.862,90,90,120 Laves-CaCu5 - 8.62 A 56772
Ni-Pr Pr7Ni3 Th7Fe3,hP20,186 P63 mc 0.9904,0.9904,0.6322,90,90,120 - - 7.19 A 7500
Ni-Pt NiPt rt CuAu,tP2,123 P4/mmm 0.2711,0.2711,0.3602,90,90,90 close-packed structure - 15.92 X 21437
Ni-Pt Ni0.75Pt0.25 ht Cu,cF4,225 Fm-3m 0.3652,0.3652,0.3652,90,90,90 close-packed structure - 12.66 X 17833
Ni-Pt Ni1.5Pt0.5 LiRh,hP2,187 P-6m2 0.258,0.258,0.42,90,90,120 close-packed structure - 12.73 X 46725
Ni-Pu PuNi TlI,oS8,63 Cmcm 0.359,1.021,0.422,90,90,90 CrB(TlI)-FeB - 13.00 X 1075
Ni-Pu PuNi2 MgCu2,cF24,227 Fd-3m 0.714,0.714,0.714,90,90,90 Friauf-Laves phase - 13.19 X 12917
Ni-Pu PuNi3 PuNi3,hR36,166 R-3m 0.5,0.5,2.435,90,90,120 Laves-CaCu5 - 11.91 X 1062
Ni-Pu PuNi4 PuNi4,mS30,12 C12/m1 0.487,0.846,1.027,90,100.0,90 - - 11.45 X 1203
Ni-Pu PuNi5 CaCu5,hP6,191 P6/mmm 0.4875,0.4875,0.397,90,90,120 - - 10.92 X 765
Ni-Pu Pu2Ni17 Th2Ni17,hP38,194 P63 /mmc 0.83,0.83,0.8,90,90,120 CaCu5-Zr4Al3 - 10.34 A 765
Ni-Re Re0.04 Ni0.96 Cu,cF4,225 Fm-3m 0.3537,0.3537,0.3537,90,90,90 close-packed structure - 9.58 X 44595
Ni-Re Re0.79 Ni0.21 Mg,hP2,194 P63 /mmc 0.27496,0.27496,0.4439,90,90,120 close-packed structure - 18.22 X 56225
Ni-Rh Rh0.5 Ni0.5 Cu,cF4,225 Fm-3m 0.36845,0.36845,0.36845,90,90,90 close-packed structure - 10.73 X 15392
Ni-Ru Ru0.10 Ni0.90 Cu,cF4,225 Fm-3m 0.35654,0.35654,0.35654,90,90,90 close-packed structure - 9.22 X 56225
Ni-Ru Ru0.89 Ni0.11 Mg,hP2,194 P63 /mmc 0.26878,0.26878,0.42629,90,90,120 close-packed structure - 12.01 X 56225
Ni-S NiS ht NiAs,hP4,194 P63 /mmc 0.3435,0.3435,0.5348,90,90,120 AlB2 family black 5.52 X 25154
Ni-S NiS rt NiS,hR18,160 R3m 0.96112,0.96112,0.31508,90,90,120 millerite golden 5.38 X 43687
Handbook of Inorganic Substances – Edition 2015 : Data 137

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ni-S NiS2 rt FeS2 ,cP12,205 Pa-3 0.56765,0.56765,0.56765,90,90,90 vaesite gray 4.46 X 24522
Ni-S Ni1.5 S ht Cu1.9 S,cF12,216 F-43m 0.521,0.521,0.521,90,90,90 - - 5.64 X 39314
Ni-S Ni17 S18 rt Ni17 S18,hP105,152 P3121 1.0290,1.0290,1.5993,90,90,120 - - 5.35 X 15943
Ni-S Ni2.75 S Ni3P,tI32,82 I-4 0.8831,0.8831,0.4455,90,90,90 - - 7.40 X 54062
Ni-S Ni3S2 rt Ni3S2,hR15,155 R32 0.57407,0.57407,0.71324,90,90,120 heazlewoodite bronze 5.88 X 28384
Ni-S Ni3S4 rt Fe3O4,cF56,227 Fd-3m 0.9488,0.9488,0.9488,90,90,90 spinel family - 4.73 X 24731
Ni-S Ni4S2.31 ht *,hP*,* - 0.544,0.544,1.204,90,90,120 - - - N 2003
Ni-S Ni4S3 ht *,cP*,* - 0.514,0.514,0.514,90,90,90 - - - N 39314
Ni-S Ni5.63 S4.86 ht Ni5.63 S4.86 ,oS56,63 Cmcm 0.3274,1.1359,1.6157,90,90,90 - - 5.38 X 6382
Ni-S Ni9S8 rt Ni9S8,oS68,21 C222 0.93359,1.12185,0.943,90,90,90 godlevskite MDO1 - 5.28 X 19881
Ni-S Ni9S8 tet Ni9S8,tI136,122 I-42d 0.938,0.938,2.244,90,90,90 godlevskite MDO2 - 5.28 X 52158
Ni-Sb NiSb NiAs,hP4,194 P63/mmc 0.4032,0.4032,0.52,90,90,120 breithauptite pink 8.19 X 44760
Ni-Sb NiSb2 hp NiAs2,oP24,61 Pbca 0.62866,0.63643,1.2367,90,90,90 pyrite-marcasite family gray 8.11 X 37138
Ni-Sb NiSb2 FeS2 ,oP6,58 Pnnm 0.5186,0.63192,0.38398,90,90,90 nisbite - 7.98 X 54586
Ni-Sb Ni0.15 Sb0.85 m Po,cP1,221 Pm-3m 0.303,0.303,0.303,90,90,90 - - 6.70 X 4280
Ni-Sb Ni0.92 Sb0.08 Cu,cF4,225 Fm-3m 0.359,0.359,0.359,90,90,90 close-packed structure - 9.15 X 17833
Ni-Sb Ni3Sb ht Sb+ BiF3 ,cF16,225 Fm-3m 0.596,0.596,0.596,90,90,90 b.c.c. family - 9.35 X 794
Ni-Sb Ni3Sb rt Cu3Ti,oP8,59 Pmmn 0.428,0.5373,0.45,90,90,90 close-packed structure - 9.56 A 45617
Ni-Sb Ni5Sb2 ht hex *,hP*,* - 0.355,0.355,0.93,90,90,120 - - - N 2393
Ni-Sb Ni5Sb2 rt tet *,t**,* - 0.8766,0.8766,1.2535,90,90,90 - - - N 2393
Ni-Sb Ni5Sb2 rt Ni5Sb2,mS28,5 C121 1.2949,0.5423,0.6134,90,117.788,90 - - 9.36 X 11625
Ni-Sc ScNi CsCl,cP2,221 Pm-3m 0.30935,0.30935,0.30935,90,90,90 b.c.c. family - 5.81 X 28724
Ni-Sc ScNi2 MgCu2,cF24,227 Fd-3m 0.6908,0.6908,0.6908,90,90,90 Friauf-Laves phase - 6.54 X 17459
Ni-Sc ScNi5 CaCu5,hP6,191 P6/mmm 0.469,0.469,0.3887,90,90,120 - - 7.59 X 20673
Ni-Sc Sc0.005 Ni0.995 Cu,cF4,225 Fm-3m 0.353,0.353,0.353,90,90,90 close-packed structure - 8.85 X 17459
Ni-Sc Sc2Ni Ti2Ni,cF96,227 Fd-3m 1.215,1.215,1.215,90,90,90 - - 4.40 A 33282
Ni-Sc Sc2Ni7 Ce2Ni7,hP36,194 P63/mmc 0.475,0.475,2.272,90,90,120 Laves-CaCu5 - 7.49 A 33282
Ni-Se NiSe ht NiAs,hP4,194 P63/mmc 0.3652,0.3652,0.5347,90,90,120 sederholmite - 7.40 X 5036
Ni-Se NiSe rt NiS,hR18,160 R3m 1.0007,1.0007,0.3333,90,90,120 mäkinenite - 7.12 A 1286
Ni-Se NiSe 2 FeS2 ,cP12,205 Pa-3 0.59629,0.59629,0.59629,90,90,90 penroseite - 6.79 X 4461
Ni-Se Ni21 Se20 rt *,hP*,* - 0.797,0.797,0.978,90,90,120 - - - N 2003
Ni-Se Ni3Se2 ht *,cF*,* - 0.5423,0.5423,0.5423,90,90,90 - - - N 4827
Ni-Se Ni3Se2 m *,tI*,* - 0.7289,0.7289,1.1568,90,90,90 - - - N 4827
Ni-Se Ni3Se2 rt Ni3S2,hR15,155 R32 0.60338,0.60338,0.7251,90,90,120 - - 7.28 X 3031
Ni-Se Ni3Se4 rt Cr3S4,mS14,12 C12/m1 1.21499,0.3633,0.61903,90,120.674,90 wilkmanite - 6.95 X 1286
Ni-Se Ni6Se5 ht Ni6Se5,oP88,29 Pca21 0.6863,1.709,1.1821,90,90,90 - - 7.16 X 8700
Ni-Se NixSe Se,hP3,152 P3121 0.45367,0.45367,0.47286,90,90,120 - - 4.67 A 54807
Ni-Si NiSi hp1 FeSi,cP8,198 P213 0.40471,0.40471,0.40471,90,90,90 - - 8.70 X 58415
Ni-Si NiSi hp2 CuTi,tP2,123 P4/mmm 0.25788,0.25788,0.257,90,90,90 b.c.c. family - 8.43 X 58415
Ni-Si NiSi hp3 PbO,oP8,57 Pbcm 0.43903,0.40079,0.39546,90,90,90 - - 8.28 X 58415
Ni-Si NiSi rt FeAs,oP8,62 Pnma 0.50324,0.33153,0.53474,90,90,90 AlB2 family - 6.46 X 58415
Ni-Si NiSi2 rt CaF2 ,cF12,225 Fm-3m 0.54096,0.54096,0.54096,90,90,90 fluorite family - 4.82 X 58079
Ni-Si Ni0.92 Si0.08 Cu,cF4,225 Fm-3m 0.352,0.352,0.352,90,90,90 close-packed structure - 8.57 X 17833
Ni-Si Ni1.5 Si ht Co1.75 Ge,hP6,194 P63/mmc 0.382,0.382,0.4906,90,90,120 AlB2 family - 6.22 X 12453
Ni-Si Ni2Si rt Co2Si-b,oP12,62 Pnma 0.4992,0.3741,0.7061,90,90,90 - - 7.33 X 51234
Ni-Si Ni25 Si9 ht rhom *,hR102,* - 0.67022,0.67022,2.88954,90,90,120 - - - N 20406
Ni-Si Ni25 Si9 ht trig Pd25 Ge9,hP34,147 P-3 0.6698,0.6698,0.9618,90,90,120 - - 7.64 A 12453
Ni-Si Ni3Si ht Fe3C-b,oP16,62 Pnma 0.55,0.65,0.435,90,90,90 - - 8.72 A 17697
Ni-Si Ni3Si2 rt Ni3Si2,oS80,36 Cmc21 1.2229,1.0805,0.6924,90,90,90 - - 6.75 X 1408
Ni-Si Ni3.064 Si0.936 rt Ni+ Cu3Au,cP4,221 Pm-3m 0.35091,0.35091,0.35091,90,90,90 close-packed structure - 7.92 X 10679
Ni-Si Ni31 Si12 Ni31 Si12,hP43,150 P321 0.6671,0.6671,1.2288,90,90,120 - - 7.56 X 5719
Ni-Sm SmNi TlI,oS8,63 Cmcm 0.3776,1.0358,0.4291,90,90,90 CrB(TlI)-FeB - 8.28 A 2469
Ni-Sm SmNi2 rt MgCu2,cF24,227 Fd-3m 0.723,0.723,0.723,90,90,90 Friauf-Laves phase - 9.41 X 25319
Ni-Sm SmNi3 PuNi3,hR36,166 R-3m 0.5,0.5,2.459,90,90,120 Laves-CaCu5 - 9.17 A 13181
Ni-Sm SmNi5 CaCu5,hP6,191 P6/mmm 0.49223,0.49223,0.39639,90,90,120 - - 8.86 X 59417
Ni-Sm Sm0.95 Ni2 TmNi2,cF192,216 F-43m 1.4448,1.4448,1.4448,90,90,90 Friauf-Laves phase - 9.17 X 46379
Ni-Sm Sm2 Ni17 Th2Ni17,hP38,194 P63/mmc 0.8341,0.8341,0.8062,90,90,120 CaCu5-Zr4Al3 - 8.88 A 3757
Ni-Sm Sm2 Ni7 2H Ce2Ni7,hP36,194 P63/mmc 0.4969,0.4969,2.435,90,90,120 Laves-CaCu5 - 9.08 A 5333
Ni-Sm Sm2 Ni7 3R Gd2Co 7,hR54,166 R-3m 0.5968,0.5968,3.653,90,90,120 Laves-CaCu5 - 6.29 A 10212
Ni-Sm Sm3 Ni Fe3C-b,oP16,62 Pnma 0.699,0.972,0.637,90,90,90 - - 7.83 A 3471
Ni-Sm Sm5 Ni19 12R *,hR288,166 R-3m 0.5,0.5,19.,90,90,120 - - - N 15255
Ni-Sm Sm5 Ni19 2H Sm5 Co19,hP48,194 P63/mmc 0.5,0.5,3.25,90,90,120 Laves-CaCu5 - 8.81 A 15255
Ni-Sm Sm5 Ni19 3R Ce5Co19,hR72,166 R-3m 0.5,0.5,4.9,90,90,120 Laves-CaCu5 - 8.77 A 15255
Ni-Sm Sm5 Ni19 4H *,hP96,194 P63/mmc 0.5,0.5,6.5,90,90,120 - - - N 15255
Ni-Sm Sm5 Ni19 6H *,hP144,187 P-6m2 0.5,0.5,9.7,90,90,120 - - - N 15255
Ni-Sm Sm5 Ni19 9R *,hR216,166 R-3m 0.5,0.5,15.,90,90,120 - - - N 15255
Ni-Sn NiSn rt NiSn,oP32,55 Pbam 0.52,2.4452,0.4091,90,90,90 - - 9.06 X 7494
Ni-Sn NiSn3 m *,oP*,16 P222 0.4124,0.4787,0.57486,90,90,90 - - - N 52804
Ni-Sn Ni0.03 Sn0.97 rt Sn,tI4,141 I41/amd 0.58305,0.58305,0.31811,90,90,90 - - 7.18 X 52668
Ni-Sn Ni0.75 Sn0.25 ht Mg,hP2,194 P63/mmc 0.263,0.263,0.423,90,90,120 close-packed structure - 9.66 X 2392
Ni-Sn Ni0.92 Sn0.08 Cu,cF4,225 Fm-3m 0.36,0.36,0.36,90,90,90 close-packed structure - 9.04 X 17833
Ni-Sn Ni1.35 Sn rt UPt2 ,oS12,63 Cmcm 0.40521,0.70623,0.51523,90,90,90 AlB2 family - 8.92 X 43340
Ni-Sn Ni1.50 Sn ht Co1.75 Ge,hP6,194 P63/mmc 0.4103,0.4103,0.5176,90,90,120 AlB2 family - 9.10 X 43555
Ni-Sn Ni3Sn hp Cu3Au,cP4,221 Pm-3m 0.37344,0.37344,0.37344,90,90,90 nisnite bronze 9.40 X 55859
Ni-Sn Ni3Sn ht BiF3 ,cF16,225 Fm-3m 0.598,0.598,0.598,90,90,90 b.c.c. family - 9.16 X 794
Ni-Sn Ni3Sn rt Mg3 Cd,hP8,194 P63/mmc 0.5275,0.5275,0.4234,90,90,120 close-packed structure - 9.60 X 133
Ni-Sn Ni3Sn2 rt Ni3Sn2,oP20,62 Pnma 0.71240,0.51970,0.81562,90,90,90 AlB2 family - 9.10 X 18755
Ni-Sn Ni3Sn4 rt Ni3Sn4,mS14,12 C12/m1 1.2214,0.4060,0.5219,90,105.,90 - - 8.65 X 14988
138 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ni-Sr SrNi *,hP*,* - 0.3332,0.3332,0.7009,90,90,120 - - - N 3211


Ni-Sr Sr2Ni3 Sr2Ni3,hP5,164 P-3m1 0.41262,0.41262,0.86857,90,90,120 - gray 4.56 X 55881
Ni-Ta TaNi2 MoSi2,tI6,139 I4/mmm 0.316,0.316,0.795,90,90,90 b.c.c. family - 12.48 X 3737
Ni-Ta TaNi3 m tet TiAl3,tI8,139 I4/mmm 0.3627,0.3627,0.7455,90,90,90 close-packed structure - 12.09 X 2315
Ni-Ta TaNi3 mon NbPt3,mP16,11 P121/m1 0.45319,0.51253,0.8632,90,100.79,90 close-packed structure - 12.04 X 24431
Ni-Ta TaNi3 stab Cu3Ti,oP8,59 Pmmn 0.424,0.51,0.452,90,90,90 close-packed structure - 12.13 X 1035
Ni-Ta Ta0.08 Ni0.92 Cu,cF4,225 Fm-3m 0.3579,0.3579,0.3579,90,90,90 close-packed structure - 9.92 X 17833
Ni-Ta Ta0.25 Ni0.75 m hex Mg,hP2,194 P63 /mmc 0.2585,0.2585,0.4229,90,90,120 close-packed structure - 12.11 X 3598
Ni-Ta Ta2Ni CuAl2,tI12,140 I4/mcm 0.6197,0.6197,0.486,90,90,90 - - 14.97 X 6743
Ni-Ta Ta5Ni Nb5Ni,cF96,227 Fd-3m 1.1635,1.1635,1.1635,90,90,90 - - 16.25 A 3737
Ni-Ta Ta6.9 Ni6.1 W6Fe7,hR39,166 R-3m 0.4911,0.4911,2.6836,90,90,120 Frank-Kasper phase - 14.28 X 42927
Ni-Tb TbNi ht TbNi,oP24,62 Pnma 2.109,0.422,0.545,90,90,90 CrB(TlI)-FeB - 8.94 X 5322
Ni-Tb TbNi rt TbNi,mP24,11 P121/m1 0.545,0.421,2.125,90,97.31,90 CrB(TlI)-FeB - 8.97 X 5322
Ni-Tb TbNi2 lt TbFe2,hR18,166 R-3m 0.5063,0.5063,1.242,90,90,120 Friauf-Laves phase - 9.99 A 23634
Ni-Tb TbNi2 rt MgCu2,cF24,227 Fd-3m 0.7178,0.7178,0.7178,90,90,90 Friauf-Laves phase gray olive 9.93 X 46379
Ni-Tb TbNi3 PuNi3,hR36,166 R-3m 0.4979,0.4979,2.448,90,90,120 Laves-CaCu5 - 9.53 A 15504
Ni-Tb TbNi5 CaCu5,hP6,191 P6/mmm 0.48869,0.48869,0.39501,90,90,120 - - 9.20 X 47354
Ni-Tb Tb0.95 Ni2 rt TmNi2,cF192,216 F-43m 1.4341,1.4341,1.4341,90,90,90 Friauf-Laves phase - 9.67 X 46379
Ni-Tb Tb2Ni17 Th2Ni17,hP38,194 P63 /mmc 0.831,0.831,0.804,90,90,120 CaCu5-Zr4Al3 - 9.09 X 10906
Ni-Tb Tb2Ni7 ht Gd2Co7,hR54,166 R-3m 0.4948,0.4948,3.623,90,90,120 Laves-CaCu5 - 9.45 A 5333
Ni-Tb Tb2Ni7 rt Ce2Ni7,hP36,194 P63 /mmc 0.4948,0.4948,2.412,90,90,120 Laves-CaCu5 - 9.47 A 5333
Ni-Tb Tb3Ni Fe3C-b,oP16,62 Pnma 0.689,0.958,0.632,90,90,90 - - 8.53 X 15603
Ni-Tb Tb3Ni2 Dy3Ni2,mS20,12 C12/m1 1.338,0.371,0.964,90,106.,90 - - 8.58 A 7971
Ni-Tc Tc0.17 Ni0.83 Cu,cF4,225 Fm-3m 0.358,0.358,0.358,90,90,90 close-packed structure - 9.47 X 9304
Ni-Tc Tc0.5 Ni0.5 Mg,hP2,194 P63 /mmc 0.263,0.263,0.424,90,90,120 close-packed structure - 10.25 X 1920
Ni-Te NiTe0.67 tf rhom Ni0.67 (Ni0.33 Te0.67),hR12,166 R-3m 0.388,0.388,2.02,90,90,120 - - 5.46 X 2359
Ni-Te NiTe2 hp FeS2,cP12,205 Pa-3 0.6374,0.6374,0.6374,90,90,90 pyrite-marcasite family - 8.05 A 4031
Ni-Te NiTe2 CdI2,hP3,164 P-3m1 0.3861,0.3861,0.5297,90,90,120 CdI2 -PbI2 polytype - 7.62 A 153
Ni-Te Ni0.528 Te Cr0.88 S,hP4,164 P-3m1 0.3869,0.3869,0.5288,90,90,120 melonite gray silver 7.68 X 31996
Ni-Te Ni1.38 Te ht1 Cu1.43 Te,oP6,59 Pmmn 0.3761,0.3796,0.6084,90,90,90 - - 7.98 X 27122
Ni-Te Ni1.43 Te ht1 Cu2Sb,tP6,129 P4/nmm 0.3782,0.3782,0.6062,90,90,90 - - 8.10 X 4827
Ni-Te Ni1.43 Te rt *,tP*,115 P-4m2 0.7564,0.7564,0.6062,90,90,90 - - - N 2782
Ni-Te Ni1.65 Te rt *,mP10,11 P121/m1 0.6089,0.3799,0.754,90,91.2,90 - - - N 2782
Ni-Te Ni1.67 Te ht *,t**,* - 0.2865,0.2865,0.662,90,90,90 - - - N 2782
Ni-Te Ni2.59 Te2 ht *,h**,* - 0.3952,0.3952,1.2472,90,90,120 - - - N 4827
Ni-Te Ni2.60 Te2 rt Ni2.60 Te2,oP20,62 Pnma 1.238,0.39192,0.68818,90,90,90 - black 8.11 X 47933
Ni-Te Ni2.86 Te2 ht2 *,cF*,* - 0.5709,0.5709,0.5709,90,90,90 - - - N 4827
Ni-Te Ni2.88 Te2 Ni2.88 Te2,oP12,28 Pma2 0.75382,0.37879,0.60647,90,90,90 - - 8.14 X 43160
Ni-Te Ni3Te2 Ni3Te2,mP10,11 P121/m1 0.60883,0.37934,0.75382,90,91.159,90 - - 8.23 X 43160
Ni-Te Ni3.08 Te2 ht3 *,cF*,* - 0.5726,0.5726,0.5726,90,90,90 - - - N 4827
Ni-Te Ni3.34 Te2 ht1 *,o**,* - 0.3834,0.3853,0.6089,90,90,90 - - - N 4827
Ni-Te Ni3.34 Te2 ht2 *,cF*,* - 1.1439,1.1439,1.1439,90,90,90 - - - N 4827
Ni-Te Ni9Te6 tf trig Ni8(Ni0.17 Te0.83)6Te,hP32,162 P-31m 0.672,0.672,2.02,90,90,120 - - 5.44 X 2359
Ni-Th ThNi SrAg,oP16,62 Pnma 1.4146,0.4286,0.5702,90,90,90 CrB(TlI)-FeB - 11.17 X 15897
Ni-Th ThNi1.75 ThNi1.75 ,mS12,15 C12/c1 0.5509,0.5510,0.7445,90,111.71,90 - - 10.59 X 21350
Ni-Th ThNi2 rt AlB2,hP3,191 P6/mmm 0.3965,0.3965,0.3856,90,90,120 AlB2 family - 11.05 X 17111
Ni-Th ThNi5 CaCu5,hP6,191 P6/mmm 0.4938,0.4938,0.402,90,90,120 - - 10.28 X 9068
Ni-Th Th2Ni17 Th2Ni17,hP38,194 P63 /mmc 0.837,0.837,0.814,90,90,120 CaCu5-Zr4Al3 - 9.83 X 738
Ni-Th Th2Ni7 ht Gd2Co7,hR54,166 R-3m 0.4945,0.4945,3.87,90,90,120 Laves-CaCu5 - 10.64 A 24132
Ni-Th Th2Ni7 rt Ce2Ni7,hP36,194 P63 /mmc 0.4945,0.4945,2.58,90,90,120 Laves-CaCu5 - 10.64 A 24132
Ni-Th Th7Ni3 Th7Fe3,hP20,186 P63 mc 0.986,0.986,0.623,90,90,120 - - 11.40 X 738
Ni-Ti TiNi ht CsCl,cP2,221 Pm-3m 0.3011,0.3011,0.3011,90,90,90 b.c.c. family - 6.48 X 56236
Ni-Ti TiNi lt AuCd,hP18,157 P31m 0.7335,0.7335,0.5271,90,90,120 - - 6.49 X 28370
Ni-Ti TiNi tricl TiNi,aP6,2 P-1 0.3,0.424,0.67,108.4,90.,90. - - 6.57 X 6719
Ni-Ti TiNi trig TiNi,hP18,147 P-3 0.73451,0.73451,0.52718,90,90,120 - - 6.47 X 45911
Ni-Ti TiNi3 TiNi3,hP16,194 P63 /mmc 0.5109,0.5109,0.8299,90,90,120 close-packed structure - 7.93 X 179
Ni-Ti Ti0.08 Ni0.92 Cu,cF4,225 Fm-3m 0.3561,0.3561,0.3561,90,90,90 close-packed structure - 8.51 X 17833
Ni-Ti Ti0.33 Ni0.67 m (Ti0.33 Ni0.67),hR21,166 R-3m 0.2549,0.2549,4.3648,90,90,120 close-packed structure - 7.83 X 6025
Ni-Ti Ti0.891 Ni0.109 ht W,cI2,229 Im-3m 0.318,0.318,0.318,90,90,90 b.c.c. family - 5.07 X 18514
Ni-Ti Ti0.986 Ni1.014 rt TiNi,mP4,11 P121/m1 0.28758,0.41264,0.46325,90,96.964,90 - - 6.50 X 53164
Ni-Ti Ti2Ni Ti2Ni,cF96,227 Fd-3m 1.13193,1.13193,1.13193,90,90,90 - - 5.66 X 2023
Ni-Ti Ti3Ni4 m Pu3Pd4,hR42,148 R-3 1.12626,1.12626,0.50967,90,90,120 b.c.c. family - 6.74 X 53164
Ni-Tl TlNi tf NiAs,hP4,194 P63 /mmc 0.4426,0.4426,0.5535,90,90,120 AlB2 family - 9.30 X 4844
Ni-Tm TmNi FeB-b,oP8,62 Pnma 0.696,0.411,0.54,90,90,90 CrB(TlI)-FeB - 9.79 X 6954
Ni-Tm TmNi2 cub MgCu2,cF24,227 Fd-3m 0.7114,0.7114,0.7114,90,90,90 Friauf-Laves phase gray light 10.57 X 45849
Ni-Tm TmNi2 ht TmNi2,cP24,215 P-43m 0.7095,0.7095,0.7095,90,90,90 Friauf-Laves phase - 10.65 X 22392
Ni-Tm TmNi2 rt TmNi2,cF192,216 F-43m 1.41930,1.41930,1.41930,90,90,90 Friauf-Laves phase - 10.64 X 22392
Ni-Tm TmNi3 PuNi3,hR36,166 R-3m 0.4935,0.4935,2.426,90,90,120 Laves-CaCu5 - 10.08 A 15504
Ni-Tm TmNi5 CaCu5,hP6,191 P6/mmm 0.4834,0.4834,0.397,90,90,120 - - 9.56 X 7425
Ni-Tm Tm2Ni17 Th2Ni17,hP38,194 P63 /mmc 0.825,0.825,0.8008,90,90,120 CaCu5-Zr4Al3 - 9.40 X 10906
Ni-Tm Tm3Ni Fe3C-b,oP16,62 Pnma 0.677,0.94,0.619,90,90,90 - - 9.54 A 3471
Ni-Tm Tm3Ni2 Er3Ni2,hR45,148 R-3 0.8433,0.8433,1.5593,90,90,120 - - 9.71 X 30980
Ni-U UNi2 rt MgZn2,hP12,194 P63 /mmc 0.49701,0.49701,0.82527,90,90,120 Friauf-Laves phase - 13.37 X 50113
Ni-U UNi5 Be5Au,cF24,216 F-43m 0.67958,0.67958,0.67958,90,90,90 Friauf-Laves phase - 11.25 X 50113
Ni-U U1.2 Ni4.8 CaCu5,hP6,191 P6/mmm 0.48457,0.48457,0.40451,90,90,120 - - 11.45 X 40025
Ni-U U10Ni13 U10Ni13,mS46,12 C12/m1 0.76602,1.30801,0.76498,90,108.875,90 - - 14.39 X 39060
Ni-U U11Ni16 U11Ni16,hR162,148 R-3 1.17786,1.17786,2.07485,90,90,120 - - 14.22 X 40214
Ni-U U6Ni U6Mn,tI28,140 I4/mcm 1.03835,1.03835,0.51565,90,90,90 - - 17.76 X 50113
Handbook of Inorganic Substances – Edition 2015 : Data 139

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ni-V VNi2 rt MoPt2,oI6,71 Immm 0.2559,0.3549,0.7641,90,90,90 close-packed structure - 8.06 X 2667


Ni-V VNi3 rt TiAl3,tI8,139 I4/mmm 0.3537,0.3537,0.7222,90,90,90 close-packed structure - 8.35 X 48502
Ni-V V0.25 Ni0.75 ht Cu,cF4,225 Fm-3m 0.3563,0.3563,0.3563,90,90,90 close-packed structure - 8.34 X 17833
Ni-V V0.53 Ni0.47 m W,cI2,229 Im-3m 0.2904,0.2904,0.2904,90,90,90 b.c.c. family - 7.40 X 3683
Ni-V V0.65 Ni0.35 *,tP240,* - 1.7116,1.7116,0.9353,90,90,90 - - - N 30485
Ni-V V0.70 Ni0.30 rt (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.904,0.904,0.467,90,90,90 Frank-Kasper phase - 6.95 X 737
Ni-V V0.93 Ni0.07 W,cI2,229 Im-3m 0.30134,0.30134,0.30134,90,90,90 b.c.c. family - 6.25 X 48502
Ni-V V3.1 Ni0.9 rt Cr3Si,cP8,223 Pm-3n 0.471,0.471,0.471,90,90,90 Frank-Kasper phase - 6.70 X 8265
Ni-W WNi rt *,o**,* - 0.71,0.776,1.248,90,90,90 - - - N 7704
Ni-W WNi4 rt MoNi4,tI10,87 I4/m 0.5733,0.5733,0.3554,90,90,90 close-packed structure - 11.90 X 52217
Ni-W W0.09 Ni0.91 Cu,cF4,225 Fm-3m 0.3564,0.3564,0.3564,90,90,90 close-packed structure - 10.27 X 17833
Ni-W W0.968 Ni0.032 W,cI2,229 Im-3m 0.3164,0.3164,0.3164,90,90,90 b.c.c. family - 18.86 X 52217
Ni-W W2Ni rt *,tI96,* - 1.04,1.04,1.09,90,90,90 - - - N 8544
Ni-Y YNi FeB-b,oP8,62 Pnma 0.7156,0.4124,0.5515,90,90,90 CrB(TlI)-FeB - 6.02 X 13062
Ni-Y YNi3 PuNi3,hR36,166 R-3m 0.49779,0.49779,2.4449,90,90,120 Laves-CaCu5 - 7.55 X 2475
Ni-Y YNi4 *,hR*,* - 0.4898,0.4898,4.993,90,90,120 - - - N 17695
Ni-Y YNi5 CaCu5,hP6,191 P6/mmm 0.4882,0.4882,0.3959,90,90,120 - - 7.77 X 16459
Ni-Y Y0.95 Ni2 TmNi2,cF192,216 F-43m 1.435,1.435,1.435,90,90,90 Friauf-Laves phase - 7.26 X 23559
Ni-Y Y2Ni17 rt Th2Ni17,hP38,194 P63/mmc 0.8307,0.8307,0.8041,90,90,120 CaCu5-Zr4Al3 - 8.13 A 58184
Ni-Y Y2Ni7 ht Gd2Co 7,hR54,166 R-3m 0.4924,0.4924,3.607,90,90,120 Laves-CaCu5 - 7.74 X 4708
Ni-Y Y2Ni7 rt Ce2Ni7,hP36,194 P63/mmc 0.4897,0.4897,2.103,90,90,120 Laves-CaCu5 - 8.95 A 55417
Ni-Y Y3Ni Fe3C-b,oP16,62 Pnma 0.6917,0.9644,0.6357,90,90,90 - - 5.10 A 55417
Ni-Y Y3Ni2 Y3Ni2,tP80,92 P41212 0.7104,0.7104,3.6597,90,90,90 - - 5.53 X 10453
Ni-Yb YbNi rt FeB-b,oP8,62 Pnma 0.69,0.41,0.53,90,90,90 CrB(TlI)-FeB - 10.27 A 10314
Ni-Yb YbNi2 MgCu2,cF24,227 Fd-3m 0.70998,0.70998,0.70998,90,90,90 Friauf-Laves phase - 10.78 X 59348
Ni-Yb YbNi3 PuNi3,hR36,166 R-3m 0.492,0.492,2.416,90,90,120 Laves-CaCu5 - 10.30 A 6737
Ni-Yb YbNi5 CaCu5,hP6,191 P6/mmm 0.483,0.483,0.3968,90,90,120 - - 9.66 X 46614
Ni-Yb Yb2Ni17 Th2Ni17,hP38,194 P63/mmc 0.828,0.828,0.8024,90,90,120 CaCu5-Zr4Al3 - 9.37 A 6737
Ni-Yb Yb2Ni7 hp Gd2Co 7,hR54,166 R-3m 0.4965,0.4965,3.586,90,90,120 Laves-CaCu5 - 9.85 A 19088
Ni-Yb Yb3Ni hp Fe3C-b,oP16,62 Pnma 0.682,0.976,0.626,90,90,90 - - 9.21 A 19088
Ni-Zn ZnNi rt CuTi,tP2,123 P4/mmm 0.274,0.274,0.324,90,90,90 b.c.c. family - 8.47 X 56984
Ni-Zn Zn0.08 Ni0.92 Cu,cF4,225 Fm-3m 0.3546,0.3546,0.3546,90,90,90 close-packed structure - 8.82 X 17833
Ni-Zn Zn1.04 Ni0.96 ht CsCl,cP2,221 Pm-3m 0.2944,0.2944,0.2944,90,90,90 b.c.c. family - 8.09 X 58978
Ni-Zn Zn11 Ni2 Zn9(Zn0.5 Fe0.5)2Fe2,cI52,217 I-43m 0.89206,0.89206,0.89206,90,90,90 γ-brass - 7.83 X 3874
Ni-Zn Zn22 Ni3 Zn22 Ni3,mS50,12 C12/m1 1.337,0.747,0.765,90,111.3,90 - - 7.53 X 6064
Ni-Zn Zn53 Ni16 rt Zn53 Ni16,oS276,39 Aem2 3.3326,1.2499,0.8869,90,90,90 - - 7.92 X 13348
Ni-Zr ZrNi TlI,oS8,63 Cmcm 0.32712,0.9931,0.41072,90,90,90 CrB(TlI)-FeB - 7.46 X 41687
Ni-Zr ZrNi2 m *,oI*,45 Iba2 0.9,0.9,3.14,90,90,90 - - - N 18395
Ni-Zr ZrNi2 MgCu2,cF24,227 Fd-3m 0.6925,0.6925,0.6925,90,90,90 Friauf-Laves phase - 8.35 X 6969
Ni-Zr ZrNi3 rt Mg3 Cd,hP8,194 P63/mmc 0.5309,0.5309,0.43034,90,90,120 close-packed structure - 8.45 X 12454
Ni-Zr ZrNi5 Be5Au,cF24,216 F-43m 0.6708,0.6708,0.6708,90,90,90 Friauf-Laves phase - 8.47 X 14342
Ni-Zr Zr0.01 Ni0.99 Cu,cF4,225 Fm-3m 0.3533,0.3533,0.3533,90,90,90 close-packed structure - 8.89 X 17833
Ni-Zr Zr2Ni CuAl2,tI12,140 I4/mcm 0.64875,0.64875,0.52656,90,90,90 - - 7.23 X 23103
Ni-Zr Zr2Ni7 Zr2Ni7,mS18,12 C12/m1 0.4698,0.8235,0.6307,90,105.92,90 - - 8.40 X 8765
Ni-Zr Zr6Ni23 Th6Mn23,cF116,225 Fm-3m 1.13534,1.13534,1.13534,90,90,90 - - 8.61 A 17053
Ni-Zr Zr7Ni10 Zr7Ni10,oS68,64 Cmce 1.2381,0.9185,0.9221,90,90,90 - gray silver 7.76 X 32775
Ni-Zr Zr8Ni21 Hf8Ni21,aP29,2 P-1 0.6476,0.8064,0.8594,75.15,68.07,75.23 - gray 8.23 X 35284
Ni-Zr Zr9Ni11 ht Zr9Pt11,tI40,87 I4/m 0.988,0.988,0.661,90,90,90 - - 7.55 X 12443
Ni-Zr Zr9Ni11 rt Zr9Ni11,tP44,83 P4/m 0.9882,0.9882,0.66089,90,90,90 - - 7.55 X 50733
Np-O NpO NaCl,cF8,225 Fm-3m 0.501,0.501,0.501,90,90,90 rocksalt family - 13.37 X 309
Np-O NpO2 hp *,oS*,63 Cmcm 0.346,0.658,0.577,90,90,90 - - - N 19137
Np-O NpO2 rt CaF2 ,cF12,225 Fm-3m 0.542,0.542,0.542,90,90,90 fluorite family - 11.22 X 3641
Np-O Np2 O5 lt Np2O5,mP28,13 P12/c1 0.8168,0.6584,0.9313,90,116.09,90 - green 8.18 X 48523
Np-Os NpOs2 lt MgCu2,cF24,227 Fd-3m 0.7528,0.7528,0.7528,90,90,90 Friauf-Laves phase - 19.23 X 6793
Np-P NpP lt *,t*8,* - 0.5616,0.5616,0.5592,90,90,90 - - - N 7735
Np-P NpP rt NaCl,cF8,225 Fm-3m 0.56148,0.56148,0.56148,90,90,90 rocksalt family - 10.06 X 7735
Np-Pd NpPd3 ht Cu3Au,cP4,221 Pm-3m 0.4096,0.4096,0.4096,90,90,90 close-packed structure - 13.44 X 10202
Np-Pd NpPd3 rt TiNi3,hP16,194 P63/mmc 0.5767,0.5767,0.9544,90,90,120 close-packed structure - 13.44 A 8487
Np-Pt NpPt TlI,oS8,63 Cmcm 0.3782,1.0743,0.4378,90,90,90 CrB(TlI)-FeB - 16.14 A 8331
Np-Pt NpPt3 TiNi3,hP16,194 P63/mmc 0.5803,0.5803,0.9566,90,90,120 close-packed structure - 19.58 A 8331
Np-Pt NpPt5 *,oP72,* - 0.5225,0.9134,2.743,90,90,90 - - - N 7597
Np-Pu NpPu4 ht *,oP*,* - 1.043,1.067,1.086,90,90,90 - - - N 1447
Np-Pu Np0.5 Pu0.5 ht W,cI2,229 Im-3m 0.3565,0.3565,0.3565,90,90,90 b.c.c. family - 17.63 X 1447
Np-Pu Np0.5 Pu0.5 ht1 Pu,mS34,12 C12/m1 1.17554,1.029,0.773,90,128.567,90 - - 18.58 A 1447
Np-Pu Np0.566 Pu0.434 rt Pu,mP16,11 P121/m1 0.612,0.48,1.095,90,101.74,90 - - 20.25 A 2268
Np-Re NpRe2 MgZn2,hP12,194 P63/mmc 0.5383,0.5383,0.8772,90,90,120 Friauf-Laves phase - 18.39 A 6793
Np-Rh NpRh3 Cu3Au,cP4,221 Pm-3m 0.4007,0.4007,0.4007,90,90,90 close-packed structure - 14.09 X 10202
Np-Ru NpRu2 rt MgCu2,cF24,227 Fd-3m 0.74456,0.74456,0.74456,90,90,90 Friauf-Laves phase - 14.14 X 6793
Np-S NpS NaCl,cF8,225 Fm-3m 0.55326,0.55326,0.55326,90,90,90 rocksalt family - 10.56 X 30189
Np-S NpS3 *,mP16,* - 0.536,0.387,1.80088,90,97.571,90 - - - N 3497
Np-S Np2 S3 Th2S3,oP20,62 Pnma 1.06,0.386,1.03,90,90,90 - - 8.99 A 307
Np-S Np2 S5 Th2S5,oP28,60 Pbcn 0.74,0.984,0.74,90,90,90 - - 7.82 A 3497
Np-S Np3 S4 ht Th3P 4,cI28,220 I-43d 0.844,0.844,0.844,90,90,90 - - 9.27 A 3497
Np-S Np3 S5 Yb5Sb3,oP32,62 Pnma 1.17435,0.80479,0.74108,90,90,90 - black 8.26 X 56269
Np-Sb NpSb hp CuTi,tP2,123 P4/mmm 0.3761,0.3761,0.328,90,90,90 b.c.c. family - 12.84 X 23537
Np-Sb NpSb rt NaCl,cF8,225 Fm-3m 0.62517,0.62517,0.62517,90,90,90 rocksalt family - 9.75 X 23537
Np-Sb NpSb2 SmSb2,oS24,64 Cmce 0.617,0.604,1.75,90,90,90 - - 9.79 A 15308
Np-Se NpSe rt NaCl,cF8,225 Fm-3m 0.58054,0.58054,0.58054,90,90,90 rocksalt family - 10.73 X 30189
140 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Np-Se NpSe3 ZrSe3,mP8,11 P121/m1 0.5592,0.4002,0.9422,90,97.4,90 - black 7.53 X 59444


Np-Se Np2Se5 Th2S5,oP28,60 Pbcn 0.7725,1.0622,0.7725,90,90,90 - - 9.11 A 15250
Np-Se Np3Se4 Th3P 4,cI28,220 I-43d 0.88261,0.88261,0.88261,90,90,90 - - 9.92 A 6084
Np-Se Np3Se5 Yb5Sb3,oP32,62 Pnma 1.22863,0.83499,0.77583,90,90,90 - black 9.23 X 56269
Np-Si NpSi ht FeB-b,oP8,62 Pnma 0.7798,0.3836,0.5657,90,90,90 CrB(TlI)-FeB - 10.41 X 41635
Np-Si NpSi rt LaSi,oS16,63 Cmcm 0.4229,1.2618,0.6309,90,90,90 - - 10.46 X 41635
Np-Si NpSi1.6 AlB2,hP3,191 P6/mmm 0.38375,0.38375,0.40924,90,90,120 AlB2 family - 8.97 X 41635
Np-Si NpSi1.72 ThSi2,tI12,141 I41/amd 0.3955,0.3955,1.37015,90,90,90 - - 8.84 X 41635
Np-Si NpSi3 Cu3Au,cP4,221 Pm-3m 0.40248,0.40248,0.40248,90,90,90 close-packed structure - 8.18 X 41635
Np-Si Np3Si2 U3Si2,tP10,127 P4/mbm 0.74236,0.74236,0.39379,90,90,90 - - 11.74 A 41635
Np-Sn NpSn3 Cu3Au,cP4,221 Pm-3m 0.463,0.463,0.463,90,90,90 close-packed structure - 9.92 X 28969
Np-Sn Np3Sn Cu3Au,cP4,221 Pm-3m 0.4632,0.4632,0.4632,90,90,90 close-packed structure - 13.87 X 8331
Np-Te NpTe hp CsCl,cP2,221 Pm-3m 0.3612,0.3612,0.3612,90,90,90 b.c.c. family - 12.85 X 23537
Np-Te NpTe rt NaCl,cF8,225 Fm-3m 0.62021,0.62021,0.62021,90,90,90 rocksalt family - 10.15 X 23537
Np-Te NpTe2 UAs2,tP6,129 P4/nmm 0.4424,0.4424,0.9004,90,90,90 - - 9.28 A 15308
Np-Te NpTe3 NdTe3,oS16,63 Cmcm 0.4355,2.54,0.4355,90,90,90 - - 8.55 A 8324
Np-Te Np2Te3 rt *,o**,* - 0.4369,1.189,1.221,90,90,90 - - - N 8324
Np-Te Np2.67 Te4 ht Th3P 4,cI28,220 I-43d 0.9413,0.9413,0.9413,90,90,90 - - 9.11 A 8324
Np-Te Np3Te4 Th3P 4,cI28,220 I-43d 0.94048,0.94048,0.94048,90,90,90 - - 9.75 A 6084
Np-Tl TlNp3 Cu3Au,cP4,221 Pm-3m 0.4712,0.4712,0.4712,90,90,90 close-packed structure - 14.53 X 8331
Np-U U0.5 Np0.5 ht1 Np,tP4,129 P4/nmm 0.4945,0.4945,0.3385,90,90,90 b.c.c. family - 19.06 A 1110
Np-U U0.5 Np0.5 rt cub *,cP58,* - 1.063,1.063,1.063,90,90,90 - - - N 1110
Np-U U0.5 Np0.5 rt orth Np,oP8,62 Pnma 0.6697,0.4734,0.4912,90,90,90 b.c.c. family - 20.26 A 1110
Np-Zr NpZr2 rt Hg2U,hP3,191 P6/mmm 0.50256,0.50256,0.30751,90,90,120 AlB2 family - 10.36 X 31705
Np-Zr Np0.10 Zr0.90 rt Mg,hP2,194 P63 /mmc 0.3251,0.3251,0.5198,90,90,120 close-packed structure - 7.39 X 28818
Np-Zr Np0.999 Zr0.001 ht1 Np,tP4,129 P4/nmm 0.4909,0.4909,0.33944,90,90,90 b.c.c. family - 19.24 A 31705
Np-Zr Np0.999 Zr0.001 ht2 W,cI2,229 Im-3m 0.35257,0.35257,0.35257,90,90,90 b.c.c. family - 17.95 X 31705
O-Os OsO2 TiO2,tP6,136 P42 /mnm 0.45003,0.45003,0.31839,90,90,90 - brown 11.44 X 5038
O-Os OsO4 OsO4,mS20,15 C12/c1 0.9379,0.4515,0.8630,90,116.58,90 - colorless 5.17 X 9531
O-P PO2 PO2,mS48,15 C12/c1 0.97,1.0179,0.6923,90,96.95,90 - colorless 2.47 X 33990
O-P P 2O3 rt P 2O3,mP20,11 P121/m1 0.6422,0.7877,0.6786,90,106.1,90 - - 2.21 X 17000
O-P P 2O3[O3]2 P 2O3[O3]2 ,oP88,19 P212121 0.83666,0.90947,1.42355,90,90,90 - colorless 2.53 X 41123
O-P P 2O5 orth1 P 2O5,oP28,62 Pnma 0.9193,0.489,0.7162,90,90,90 - colorless 2.93 X 29764
O-P P 2O5 orth2 P 2O5,oF56,43 Fdd2 0.8115,1.6314,0.5265,90,90,90 - - 2.71 X 32145
O-P P 2O5 rhom P 2O5,hR84,161 R3c 1.03035,1.03035,1.35102,90,90,120 - - 2.28 X 19758
O-P P 4O7 P 4O7,mP44,14 P121/c1 0.684,0.9973,1.12698,90,120.228,90 - colorless 2.36 X 17597
O-P P 4O9 P 4O9,hR156,167 R-3c 0.96936,0.96936,2.48823,90,90,120 - colorless 2.64 X 25652
O-Pa PaO NaCl,cF8,225 Fm-3m 0.49226,0.49226,0.49226,90,90,90 rocksalt family - 13.76 X 9103
O-Pa PaO2 ht FeS2,cP12,205 Pa-3 0.5473,0.5473,0.5473,90,90,90 pyrite-marcasite family - 10.66 A 3050
O-Pa PaO2 rt CaF2,cF12,225 Fm-3m 0.551,0.551,0.551,90,90,90 fluorite family black 10.44 X 2261
O-Pa PaO2.5 ht3 BiF3,cF16,225 Fm-3m 0.5476,0.5476,0.5476,90,90,90 b.c.c. family black 10.96 X 621
O-Pa Pa2O5 ht1 *,hP*,* - 0.3817,0.3817,1.322,90,90,120 - - - N 3050
O-Pa Pa2O5 ht2 *,hR*,* - 0.76546,0.76546,0.94339,90,90,120 - - - N 3050
O-Pa Pa2O5 rt *,t**,* - 0.5429,0.5429,0.5503,90,90,90 - white - N 3050
O-Pb PbO hp SnO,oP4,31 Pmn21 0.4127,0.4767,0.385,90,90,90 - - 9.79 A 26604
O-Pb PbO ht PbO,oP8,57 Pbcm 0.58931,0.54904,0.47528,90,90,90 massicot yellow 9.64 X 17756
O-Pb PbO lt PbO,oS8,67 Cmme 0.56099,0.56076,0.49979,90,90,90 - - 9.43 X 42111
O-Pb PbO rt PbO,tP4,129 P4/nmm 0.39777,0.39777,0.50259,90,90,90 litharge red 9.32 X 18232
O-Pb PbO2 hp1 Fe2N0.94 ,oP12,60 Pbcn 0.49858,0.59596,0.54626,90,90,90 scrutinyite brown dark 9.79 X 45572
O-Pb PbO2 hp2 CaF2,cF12,225 Fm-3m 0.53492,0.53492,0.53492,90,90,90 fluorite family - 10.38 X 4192
O-Pb PbO2 TiO2,tP6,136 P42 /mnm 0.49578,0.49578,0.33878,90,90,90 plattnerite brown 9.54 X 13016
O-Pb Pb12O19 ht *,mP62,14 P121/c1 1.15057,1.08362,0.77354,90,90.76,90 - black - N 5818
O-Pb Pb2O Cu2O,cP6,224 Pn-3m 0.538,0.538,0.538,90,90,90 - - 9.18 X 10
O-Pb Pb2O3 m Pb2O3,mP20,14 P121/c1 0.7565,0.5625,0.7814,90,113.22,90 - black 10.05 X 4953
O-Pb Pb2O3 Pb2O3,oP20,26 Pmc21 0.764,0.549,0.778,90,90,90 - - 9.41 X 251
O-Pb Pb3O4 hp1 *,oP28,55 Pbam 0.7,0.96,0.666,90,90,90 - - 10.18 N 41269
O-Pb Pb3O4 hp2 Pb3O4,oP14,55 Pbam 0.6461,0.93812,0.33168,90,90,90 - - 11.33 X 41269
O-Pb Pb3O4 lt Pb3O4,oP28,55 Pbam 0.88068,0.88189,0.65636,90,90,90 - - 8.93 X 11688
O-Pb Pb3O4 rt Pb3O4,tP28,135 P42 /mbc 0.8811,0.8811,0.6563,90,90,90 minium - 8.94 X 9154
O-Pd PdO hp CoO,tI4,139 I4/mmm 0.2967,0.2967,0.5315,90,90,90 rocksalt family - 8.69 X 30929
O-Pd PdO rt PtS,tP4,131 P42 /mmc 0.303,0.303,0.533,90,90,90 palladinite black 8.31 X 488
O-Pd PdO tf NaCl,cF8,225 Fm-3m 0.565,0.565,0.565,90,90,90 rocksalt family - 4.51 X 22364
O-Pd PdO0.24 Cu,cF4,225 - 0.4043,0.4043,0.4043,90,90,90 close-packed structure black 11.08 F 30929
O-Pd PdO2 hp TiO2,tP6,136 P42 /mnm 0.4483,0.4483,0.3101,90,90,90 - - 7.38 A 18467
O-Pd Pd2O tf Cu2O,cP6,224 Pn-3m 0.428,0.428,0.428,90,90,90 - - 9.69 X 22364
O-Pd Pd3.5 O4 Pt3.4 O4,cP16,223 Pm-3n 0.5756,0.5756,0.5756,90,90,90 - black 7.60 X 12872
O-Pm Pm2O3 ht1 Sm2O3,mS30,12 C12/m1 1.422,0.365,0.891,90,100.1,90 - - 7.40 A 6714
O-Pm Pm2O3 ht2 La2O3,hP5,164 P-3m1 0.3802,0.3802,0.5954,90,90,120 - - 7.53 A 6714
O-Pm Pm2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.099,1.099,1.099,90,90,90 - - 6.77 A 6714
O-Po PoO2 cub CaF2,cF12,225 Fm-3m 0.5637,0.5637,0.5637,90,90,90 fluorite family - 8.94 X 627
O-Po PoO2 tet *,tP*,* - 0.545,0.545,0.836,90,90,90 - - - N 627
O-Pr PrO hp NaCl,cF8,225 Fm-3m 0.4912,0.4912,0.4912,90,90,90 rocksalt family golden 8.79 X 53239
O-Pr PrO1.5 ht2 NdO1.5 ,cI26,229 Im-3m 0.4415,0.4415,0.4415,90,90,90 - - 6.36 A 3998
O-Pr PrO1.833 CaF2,cF12,225 Fm-3m 0.5472,0.5472,0.5472,90,90,90 fluorite family black 6.90 X 51133
O-Pr PrO2 hp PbCl2,oP12,62 Pnma 0.6371,0.3839,0.7026,90,90,90 - brown 6.68 X 55499
O-Pr Pr11O20 Tb11O20-b,aP31,2 P-1 0.65,0.65,0.99,96.3,90.,99.9 - - 7.58 A 9165
O-Pr Pr2O3 (Ni) Sm2O3,mS30,12 C12/m1 1.436,0.372,0.897,90,100.,90 - - 6.96 A 6946
O-Pr Pr2O3 ht1 La2O3,hP5,164 P-3m1 0.38577,0.38577,0.6012,90,90,120 - yellow 7.07 X 18642
Handbook of Inorganic Substances – Edition 2015 : Data 141

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

O-Pr Pr2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.092,1.092,1.092,90,90,90 - - 6.73 A 53105


O-Pr Pr5O9 rt Pr5O9-b,mP112,14 P121/c1 0.67304,1.939,1.2794,90,100.213,90 - - 6.86 X 30643
O-Pr Pr6O11 rt Pr6O11,mP68,14 P121/c1 0.6685,1.16004,1.28271,90,99.974,90 - black 6.93 X 32029
O-Pr Pr7O12 rt Pr7O12,hR57,148 R-3 1.02783,1.02783,0.96069,90,90,120 fluorite family - 6.68 X 8864
O-Pr Pr9O16 rt Pr9O16,aP25,2 P-1 0.66726,0.67396,0.8711,75.301,82.576,80.027 - - 6.81 X 30642
O-Pt PtO tf1 PtS,tP4,131 P42/mmc 0.30777,0.30777,0.534,90,90,90 - - 13.86 X 24775
O-Pt PtO tf2 NaCl,cF8,225 Fm-3m 0.515,0.515,0.515,90,90,90 rocksalt family - 10.27 X 22364
O-Pt PtO2 6H CdI2 ,hP9,164 P-3m1 0.311,0.311,1.26,90,90,120 CdI2-PbI2 polytype - 10.72 A 5751
O-Pt PtO2 hex CdI2 ,hP6,186 P63mc 0.31,0.31,0.832,90,90,120 CdI2-PbI2 polytype - 10.89 A 5751
O-Pt PtO2 hp TiO2 ,tP6,136 P42/mnm 0.4485,0.4485,0.313,90,90,90 - black 11.98 A 17154
O-Pt PtO2 hp-ht CaCl2,oP6,58 Pnnm 0.44839,0.45385,0.3136,90,90,90 - black 11.82 X 20526
O-Pt PtO2 rt CdI2 ,hP3,164 P-3m1 0.31,0.31,0.4161,90,90,120 CdI2-PbI2 polytype black 10.89 X 5751
O-Pt Pt2O tf Cu2O,cP6,224 Pn-3m 0.395,0.395,0.395,90,90,90 - - 21.89 X 22364
O-Pt Pt3O4 Pt3O4,cP14,223 Pm-3n 0.5585,0.5585,0.5585,90,90,90 - black 12.38 X 18467
O-Pu PuO stab NaCl,cF8,225 Fm-3m 0.4948,0.4948,0.4948,90,90,90 rocksalt family - 14.26 X 2269
O-Pu PuO2 rt CaF2 ,cF12,225 Fm-3m 0.53982,0.53982,0.53982,90,90,90 fluorite family - 11.65 X 43040
O-Pu Pu2O3 ht O+ (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.098,1.098,1.098,90,90,90 - - 10.76 A 2269
O-Pu Pu2O3 ht La2O3,hP5,164 P-3m1 0.38381,0.38381,0.5917,90,90,120 - black 11.79 X 14303
O-Pu Pu2O3 rt O+ (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.10446,1.10446,1.10446,90,90,90 - - 10.57 A 9955
O-Rb Rb[O2] ht NaCl,cF8,225 Fm-3m 0.633,0.633,0.633,90,90,90 rocksalt family - 3.08 X 9820
O-Rb Rb[O2] rt CaC2,tI6,139 I4/mmm 0.422,0.422,0.701,90,90,90 - - 3.13 A 8549
O-Rb Rb[O3] Rb[O3],mP16,14 P121/c1 0.6452,0.6022,0.8763,90,122.34,90 - red dark 3.08 X 19664
O-Rb Rb19 O3 lt Rb19 O3,cF176,226 Fm-3c 2.3152,2.3152,2.3152,90,90,90 - - 1.79 X 12031
O-Rb Rb2O ht1 *,cP72,* - 1.244,1.244,1.244,90,90,90 - - - N 6243
O-Rb Rb2O ht2 *,hR216,* - 1.8243,1.8243,2.1228,90,90,120 - - - N 6243
O-Rb Rb2O rt CaF2 ,cF12,225 Fm-3m 0.6755,0.6755,0.6755,90,90,90 fluorite family - 4.03 X 15772
O-Rb Rb2O3 Pu2C3,cI40,220 I-43d 0.93327,0.93327,0.93327,90,90,90 - black 3.58 X 25532
O-Rb Rb2[O2] ht *,cP32,* - 0.9,0.9,0.9,90,90,90 - - 3.70 N 2566
O-Rb Rb2[O2] rt Rb2[O2],oI8,71 Immm 0.4201,0.5983,0.7075,90,90,90 - - 3.79 X 918
O-Rb Rb3O *,hP144,* - 2.261,2.261,1.407,90,90,120 - red golden 2.61 N 6558
O-Rb Rb6O lt Rb6O,hP28,176 P63/m 0.8393,0.8393,3.0467,90,90,120 - brass 1.89 X 10153
O-Rb Rb9O2 lt Rb9O2,mP22,11 P121/m1 0.8351,1.4023,1.1685,90,104.51,90 - red copper 2.01 X 11042
O-Re ReO2 ht ReO2,oP12,60 Pbcn 0.481,0.5643,0.4601,90,90,90 - black 11.61 X 733
O-Re ReO2 rt ReO2,mP14,14 P121/c1 0.55836,0.4782,0.5574,90,119.57,90 - - 11.20 X 42727
O-Re ReO2 tet TiO2 ,tP6,136 P42/mnm 0.47983,0.47983,0.28077,90,90,90 - - 11.21 X 45506
O-Re ReO3 hp Re+ *,o**,* - 0.3713,0.3744,0.3758,90,90,90 - red copper - N 3257
O-Re ReO3 hp-ht *,hR96,167 R-3c 0.92322,0.92322,1.31234,90,90,120 - red copper 9.64 N 48774
O-Re ReO3 hp1 ReO3,tP8,127 P4/mbm 0.52968,0.52968,0.37415,90,90,90 - - 7.41 X 19466
O-Re ReO3 hp2 H0.5 WO3,cI32,204 Im-3 0.73109,0.73109,0.73109,90,90,90 - - 7.96 X 43045
O-Re ReO3 hp3 FeF3 ,hR24,167 R-3c 0.50698,0.50698,1.26606,90,90,120 - red copper 8.28 A 48774
O-Re ReO3 mon MnF3,mS48,15 C12/c1 0.89996,0.4944,1.3637,90,91.,90 - red copper 7.69 A 48774
O-Re ReO3 rt ReO3,cP4,221 Pm-3m 0.37477,0.37477,0.37477,90,90,90 - purple 7.39 X 51288
O-Re Re1.16 O3 hp Re1.16 O3,hP10,182 P6322 0.48350,0.48350,0.45350,90,90,120 - red copper 9.55 X 6820
O-Re Re2O7 Re2O7,oP72,19 P212121 0.5448,1.2508,1.5196,90,90,90 - yellow 6.21 X 4643
O-Re Re3O10 Re3O10,tI40,119 I-4m2 0.5171,0.5171,1.3371,90,90,90 - blue 6.68 X 39164
O-Rh RhO2 hp1 FeS2 ,cP12,205 Pa-3 0.4844,0.4844,0.4844,90,90,90 pyrite-marcasite family - 7.88 X 57707
O-Rh RhO2 hp2 TiO2 ,tP6,136 P42/mnm 0.4487,0.4487,0.3089,90,90,90 - black 7.20 X 47771
O-Rh Rh2O3 hp-ht Rh2S3,oP20,60 Pbcn 0.7241,0.5159,0.5381,90,90,90 - gray 8.39 X 14308
O-Rh Rh2O3 ht Rh2O3,oP40,61 Pbca 0.51477,0.54425,1.46977,90,90,90 - - 8.19 X 7462
O-Rh Rh2O3 rt Al2O3,hR30,167 R-3c 0.5127,0.5127,1.3853,90,90,120 - gray 8.02 X 4994
O-Ru RuO2 hp1 CaCl2,oP6,58 Pnnm 0.44347,0.44865,0.30934,90,90,90 - - 7.18 X 32867
O-Ru RuO2 hp2 FeS2 ,cP12,205 Pa-3 0.48589,0.48589,0.48589,90,90,90 pyrite-marcasite family - 7.71 X 34740
O-Ru RuO2 TiO2 ,tP6,136 P42/mnm 0.44931,0.44931,0.31064,90,90,90 - black blue 7.05 X 32867
O-Ru RuO4 cub Os(O0.5F0.5 )4,cP40,218 P-43n 0.8509,0.8509,0.8509,90,90,90 - - 3.56 X 45213
O-Ru RuO4 mon OsO4,mS20,15 C12/c1 0.9302,0.43967,0.8454,90,116.82,90 - - 3.55 X 45213
O-S SO2 lt SO2,oS12,41 Aea2 0.607,0.594,0.614,90,90,90 - - 1.92 X 418
O-S SO3 mon SO3,mP16,14 P121/c1 0.620,0.406,0.931,90,109.83,90 - - 2.41 X 576
O-S SO3 orth SO3,oP48,33 Pna21 1.082,1.24,0.513,90,90,90 - - 2.32 X 2468
O-S S8O S8O,oP36,29 Pca21 1.3197,0.7973,0.8096,90,90,90 - yellow 2.12 X 9735
O-Sb SbO2 cer SbO2,oP24,33 Pna21 0.53336,0.47138,1.16146,90,90,90 cervantite colorless 6.99 X 45181
O-Sb SbO2 cli SbO2,mS24,15 C12/c1 1.1896,0.47567,0.52449,90,106.73,90 clinocervantite colorless 7.19 X 45181
O-Sb Sb2O3 hp Sb2O3,oP40,19 P212121 0.74771,0.75666,1.16411,90,90,90 - white 5.88 X 57768
O-Sb Sb2O3 sen As2O3,cF80,227 Fd-3m 1.1116,1.1116,1.1116,90,90,90 senarmontite colorless 5.64 X 42856
O-Sb Sb2O3 val Sb2O3,oP20,56 Pccn 0.48996,1.2449,0.54103,90,90,90 valentinite colorless 5.87 X 42856
O-Sb Sb2O5 Nb2O5,mS28,15 C12/c1 1.2646,0.4782,0.54247,90,103.91,90 - yellow 6.75 X 12204
O-Sb Sb3O6.5 Sb3O6.5 ,cF88,227 Fd-3m 1.03024,1.03024,1.03024,90,90,90 pyrochlore family white 5.70 X 54508
O-Sc ScO0.95 NaCl,cF8,225 Fm-3m 0.448,0.448,0.448,90,90,90 rocksalt family black blue 4.44 X 3664
O-Sc Sc2O3 hp Cr3C2-b,oP20,62 Pnma 0.54796,0.29796,1.15479,90,90,90 - - 4.86 A 52323
O-Sc Sc2O3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 0.98446,0.98446,0.98446,90,90,90 kangite white 3.84 X 22373
O-Se SeO2 hp SeO2,oP24,55 Pbam 0.7928,0.8134,0.49491,90,90,90 - colorless 4.62 X 40553
O-Se SeO2 lt SeO2,oP24,26 Pmc21 0.5071,0.44832,1.49672,90,90,90 - white 4.33 X 43364
O-Se SeO2 m1 SeO2,oP12,26 Pmc21 0.50722,0.44704,0.75309,90,90,90 - white 4.32 X 43364
O-Se SeO2 tet SeO2,tP24,135 P42/mbc 0.83622,0.83622,0.50612,90,90,90 downeyite colorless 4.17 X 26943
O-Se SeO3 SeO3,tP32,114 P-421c 0.9636,0.9636,0.528,90,90,90 - - 3.44 X 2465
O-Se Se2O5 Se2O5,mP28,14 P121/c1 0.4585,0.6972,1.389,90,91.98,90 - - 3.56 X 13763
O-Si SiO ZnS,cF8,216 F-43m 0.545,0.545,0.545,90,90,90 adamantane structure - 1.81 X 508
O-Si SiO1.66 *,oP*,18 P21212 0.9685,1.487,1.6898,90,90,90 - - - N 46548
O-Si SiO2 CIT-5-1 SiO2 ,oI96,74 Imma 0.50213,1.36947,2.5497,90,90,90 zeolite CFI - 1.82 X 32900
142 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

O-Si SiO2 CIT-5-2 SiO2,oP96,31 Pmn21 1.36739,0.50216,2.54884,90,90,90 zeolite CFI - 1.82 X 34735
O-Si SiO2 COK-5 m SiO2,mP188,10 P12/m1 1.427,1.442,1.868,90,103.41,90 zeolite MFS - 1.92 X 44501
O-Si SiO2 COK-5 o1 SiO2,oP216,47 Pmmm 1.398,1.446,1.909,90,90,90 zeolite MFS - 1.86 X 44501
O-Si SiO2 COK-5 o2 SiO2,oS432,65 Cmmm 1.439,3.767,1.447,90,90,90 zeolite MFS - 1.83 X 44501
O-Si SiO2 DD-3R SiO2,hR360,148 R-3 1.37761,1.37761,4.15456,90,90,120 zeolite DDR colorless 1.75 X 44381
O-Si SiO2 GUS-1 SiO2,oS96,21 C222 1.64206,2.0054,0.50464,90,90,90 zeolite GON - 1.92 X 37016
O-Si SiO2 HPM-1 SiO2,hP180,178 P6122 1.19356,1.19356,2.975,90,90,120 - - 1.63 X 57553
O-Si SiO2 IM-5 SiO2,oS864,63 Cmcm 1.42088,5.72368,1.9994,90,90,90 zeolite IMF - 1.77 X 49448
O-Si SiO2 ITQ-1 SiO2,hP216,191 P6/mmm 1.42081,1.42081,2.4945,90,90,120 zeolite MWW - 1.65 X 34734
O-Si SiO2 ITQ-12 SiO2,mS72,8 C1m1 1.0336,1.50177,0.88639,90,105.356,90 zeolite ITW - 1.80 X 43046
O-Si SiO2 ITQ-24 SiO2,oS168,38 Amm2 1.24802,2.10374,1.34698,90,90,90 zeolite IWR - 1.58 X 46554
O-Si SiO2 ITQ-3 SiO2-b,oS192,63 Cmcm 2.0622,0.97242,1.9623,90,90,90 zeolite ITE white 1.62 X 32748
O-Si SiO2 ITQ-7 SiO2,tP192,131 P42 /mmc 1.28528,1.28528,2.52136,90,90,90 zeolite ISV - 1.53 X 35404
O-Si SiO2 MCM-35 SiO2,mS132,12 C12/m1 0.95,3.07096,0.73133,90,91.711,90 zeolite MTF - 2.06 X 35646
O-Si SiO2 MCM-65 SiO2,oS108,63 Cmcm 0.7373,1.8006,1.3849,90,90,90 zeolite CDO - 1.95 X 43321
O-Si SiO2 Nu-6(2) SiO2,mP72,14 P121/c1 1.3848,0.49881,1.7257,90,106.09,90 zeolite NSI - 2.09 X 42560
O-Si SiO2 RUB-24 SiO2,tI96,141 I41/amd 0.76677,0.76677,2.70625,90,90,90 zeolite RWR colorless 2.01 X 45312
O-Si SiO2 RUB-3 SiO2,mS72,12 C12/m1 1.4018,1.3612,0.7418,90,102.12,90 zeolite RTE - 1.73 X 34949
O-Si SiO2 RUB-41 SiO2,mP54,13 P12/c1 0.7345,0.8724,1.7152,90,114.2,90 zeolite RRO - 1.79 X 44487
O-Si SiO2 SSZ-24 (Al0.5P 0.5 )O2,hP72,192 P6/mcc 1.3603,1.3603,0.8277,90,90,120 zeolite AFI - 1.81 X 25698
O-Si SiO2 SSZ-31 A SiO2,mP84,10 P12/m1 1.235,0.838,1.492,90,106.,90 zeolite STO - 1.88 X 33084
O-Si SiO2 SSZ-31 B SiO2,oP168,53 Pmna 0.838,1.235,2.878,90,90,90 - - 1.88 X 33084
O-Si SiO2 SSZ-31 C SiO2,mS168,12 C12/m1 2.993,0.838,1.235,90,106.,90 - - 1.88 X 33084
O-Si SiO2 SSZ-31 D SiO2,oP168,57 Pbcm 1.235,2.878,0.838,90,90,90 - - 1.88 X 33084
O-Si SiO2 SSZ-35 SiO2-a,aP48,2 P-1 0.7377,1.14114,1.15268,104.892,94.661,96.205 zeolite STF - 1.72 X 35396
O-Si SiO2 SSZ-42 SiO2,mS96,12 C12/m1 1.86136,1.34777,0.76305,90,101.719,90 zeolite IFR - 1.70 X 38746
O-Si SiO2 SSZ-44 SiO2,mP96,11 P121/m1 0.73881,2.19458,1.14853,90,94.702,90 zeolite SFF - 1.72 X 35396
O-Si SiO2 SSZ-53 SiO2-a,mS192,15 C12/c1 0.50192,3.37437,2.11653,90,90.485,90 zeolite SFH - 1.78 X 41337
O-Si SiO2 SSZ-58 SiO2,oP222,51 Pmma 2.51106,1.24972,1.28596,90,90,90 zeolite SFG - 1.83 X 41605
O-Si SiO2 SSZ-59 SiO2-b,aP48,2 P-1 0.50231,1.27351,1.47219,103.44,90.51,100.88 zeolite SFN - 1.78 X 41337
O-Si SiO2 SSZ-73 SiO2,tI96,139 I4/mmm 1.41039,1.41039,1.01875,90,90,90 zeolite SAS - 1.58 X 48209
O-Si SiO2 UTD-1 C SiO2-a,oS192,63 Cmcm 1.898,2.304,0.841,90,90,90 - - 1.74 X 33089
O-Si SiO2 UTD-1 D SiO2,oI192,71 Immm 0.841,1.898,2.304,90,90,90 - - 1.74 X 33089
O-Si SiO2 UTD-1 SiO2,oI192,74 Imma 0.8415,1.8981,2.304,90,90,90 zeolite DON - 1.74 X 32195
O-Si SiO2 ZSM-12-1 SiO2,mS84,12 C12/m1 2.488,0.502,1.215,90,107.7,90 zeolite MTW - 1.93 X 18703
O-Si SiO2 ZSM-12-2 SiO2,mS168,15 C12/c1 2.48633,0.50124,2.43275,90,107.721,90 zeolite MTW - 1.93 X 23685
O-Si SiO2 ZSM-22 SiO2,oS72,36 Cmc21 1.3796,1.7387,0.5024,90,90,90 zeolite TON - 1.99 X 53032
O-Si SiO2 ZSM-39 SiO2,cF408,227 Fd-3m 1.9369,1.9369,1.9369,90,90,90 zeolite MTN black 1.87 X 26913
O-Si SiO2 ZSM-48 SiO2,oS144,63 Cmcm 1.424,2.014,0.840,90,90,90 zeolite MRE - 1.99 X 18705
O-Si SiO2 ZSM-5m SiO2,mP288,14 P121/c1 1.3369,2.0107,2.38262,90,123.46,90 zeolite MFI - 1.79 X 24298
O-Si SiO2 beta B SiO2-b,mS192,15 C12/c1 1.7606,1.7656,1.4336,90,113.84,90 zeolite BEA - 1.57 X 45308
O-Si SiO2 cha SiO2,hR108,166 R-3m 1.35292,1.35292,1.47483,90,90,120 zeolite CHA - 1.54 X 34205
O-Si SiO2 coe-2 *,mP60,3 P121 0.7276,1.1039,1.5594,90,91.2,90 - - 1.59 N 55959
O-Si SiO2 dod 1H SiO2,hP102,191 P6/mmm 1.3783,1.3783,1.119,90,90,120 zeolite DOH - 1.84 X 17643
O-Si SiO2 dod 3C SiO2,cF808,227 Fd-3m 1.9369,1.9369,1.9369,90,90,90 zeolite MTN black 1.87 X 26913
O-Si SiO2 fau SiO2,cF576,227 Fd-3m 2.4268,2.4268,2.4268,90,90,90 zeolite FAU - 1.34 X 43049
O-Si SiO2 fer ht SiO2,oI108,71 Immm 0.7428,1.4065,1.8765,90,90,90 zeolite FER - 1.83 X 41609
O-Si SiO2 fib SiS2,oI12,72 Ibam 0.472,0.836,0.516,90,90,90 - - 1.96 X 645
O-Si SiO2 hex *,hP36,* - 0.68,0.68,1.122,90,90,120 - - 2.66 N 6
O-Si SiO2 hp coe SiO2,mS48,15 C12/c1 0.71367,1.23695,0.71190,90,119.570,90 coesite colorless 2.92 X 20309
O-Si SiO2 hp cub2 *,cP96,223 Pm-3n 1.3436,1.3436,1.3436,90,90,90 melanophlogite colorless - N 13928
O-Si SiO2 hp mon1 SiO2,mP20,14 P121/c1 0.59137,0.4424,0.4625,90,102.48,90 - - 5.07 X 38901
O-Si SiO2 hp mon2 SiO2,mP12,4 P1211 0.50096,0.82147,0.50322,90,119.576,90 tridymite high-2 - 2.22 X 45776
O-Si SiO2 hp qua *,mP*,14 P121/c1 0.69223,0.41,0.503,90,102.054,90 - - - N 43656
O-Si SiO2 hp sti TiO2,tP6,136 P42 /mnm 0.4134,0.4134,0.2654,90,90,90 stishovite colorless 4.40 X 45276
O-Si SiO2 hp trig SiO2,hP9,152 P3121 0.4921,0.4921,0.54163,90,90,120 quartz low colorless 2.64 X 26882
O-Si SiO2 hp1 cri *,mP*,4 P1211 0.82747,0.4746,0.84962,90,111.826,90 cristobalite hp - - N 28470
O-Si SiO2 hp2 SiO2,mP24,14 P121/c1 0.8011,0.4544,0.889,90,121.,90 - - 2.88 X 57081
O-Si SiO2 hp3 *,m**,* - 0.4327,0.3622,0.5686,90,91.65,90 - - - N 38901
O-Si SiO2 ht ZSM11 SiO2,tI288,119 I-4m2 2.00647,2.00647,1.34082,90,90,90 zeolite MEL - 1.77 X 21422
O-Si SiO2 ht cri SiO2,cF104,227 Fd-3m 0.7166,0.7166,0.7166,90,90,90 cristobalite high - 2.17 X 7845
O-Si SiO2 ht qua SiO2,hP9,180 P6222 0.49965,0.49965,0.5457,90,90,120 quartz high - 2.54 X 23320
O-Si SiO2 ht SiO2,oP288,62 Pnma 2.01210,1.99331,1.33809,90,90,90 zeolite MFI - 1.78 X 30789
O-Si SiO2 ht1 tri SiO2,oP72,19 P212121 0.4987,0.8199,2.6163,90,90,90 tridymite high-1 - 2.24 X 45074
O-Si SiO2 ht3 tri SiO2,oS24,20 C222 1 0.5024,0.8756,0.8213,90,90,90 tridymite high-3 - 2.21 X 19763
O-Si SiO2 ht4 tri SiO2,hP12,194 P63 /mmc 0.5052,0.5052,0.827,90,90,120 tridymite high-4 - 2.18 X 19767
O-Si SiO2 kea SiO2,tP36,92 P41212 0.7464,0.7464,0.862,90,90,90 keatite - 2.49 X 1169
O-Si SiO2 mog SiO2-a,mS36,15 C12/c1 1.3829,0.4876,0.8758,90,129.21,90 moganite - 2.62 X 25909
O-Si SiO2 mon SiO2,mP48,14 P121/c1 0.715,1.24,0.716,90,119.,90 - - 2.88 A 21223
O-Si SiO2 qua (Fe) SiO2-a,aP9,1 P1 0.4916,0.4916,0.5407,90,90,119.99 quartz A brown 2.64 X 28049
O-Si SiO2 rt ZSM11 SiO2,tI288,82 I-4 2.0019,2.0019,1.338,90,90,90 zeolite MEL - 1.79 X 32522
O-Si SiO2 rt fer SiO2,oP108,58 Pnnm 0.74119,1.40747,1.8681,90,90,90 zeolite FER - 1.84 X 41609
O-Si SiO2 rt tri-A SiO2,aP240,1 P1 0.9932,0.9938,4.1232,86.55,83.08,60.02 - - 2.28 X 11319
O-Si SiO2 rt tri-M SiO2,mS144,9 C1c1 1.8526,0.5001,2.38186,90,105.839,90 tridymite low - 2.26 X 45074
O-Si SiO2 rt SiO2,tP12,92 P41212 0.49717,0.49717,0.69223,90,90,90 cristobalite low colorless 2.33 X 28486
O-Si SiO2 sei Fe2N0.94 ,oP12,60 Pbcn 0.4097,0.50462,0.44946,90,90,90 seifertite - 4.30 X 50295
O-Si SiO2 sod SiO2,hR54,148 R-3 1.2441,1.2441,0.70911,90,90,120 zeolite SOD colorless 1.89 X 51940
O-Si SiO2 trig SiO2,hP31,143 P3 0.831,0.831,0.5205,90,90,120 - - 1.92 X 40664
Handbook of Inorganic Substances – Edition 2015 : Data 143

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

O-Si SiO2 βC SiO2 ,tP96,131 P42/mmc 1.26241,1.26241,1.31255,90,90,90 zeolite BEC white 1.53 X 45909
O-Si Si24 O48 (Ge0.5 Si0.5)24O48,cP72,221 Pm-3m 1.18532,1.18532,1.18532,90,90,90 zeolite LTA - 1.44 X 57884
O-Si Si64 O128 Na4Al4Si60O128 ,tP192,91 P4122 1.2464,1.2464,2.6223,90,90,90 zeolite BEA - 1.57 X 45308
O-Sm SmO tf ZnS,cF8,216 F-43m 0.515,0.515,0.515,90,90,90 adamantane structure - 8.09 X 6953
O-Sm SmO NaCl,cF8,225 Fm-3m 0.4943,0.4943,0.4943,90,90,90 rocksalt family golden 9.15 X 14372
O-Sm SmO0.61 cub ZnS,cF8,216 F-43m 0.53725,0.53725,0.53725,90,90,90 - - 6.86 X 774
O-Sm SmO0.656 tf *,hR159,160 R3m 1.457,1.457,1.784,90,90,120 - - - N 6953
O-Sm SmO1.5 ht3 NdO1.5 ,cI26,229 Im-3m 0.434,0.434,0.434,90,90,90 - - 7.09 A 3998
O-Sm Sm2 O3 ht1 La2O3,hP5,164 P-3m1 0.3748,0.3748,0.579,90,90,120 - - 8.22 A 22665
O-Sm Sm2 O3 ht2 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.09295,1.09295,1.09295,90,90,90 - - 7.10 X 52535
O-Sm Sm2 O3 rt Sm2 O3,mS30,12 C12/m1 1.41975,0.36273,0.88561,90,99.986,90 - yellow 7.74 X 22373
O-Sn SnO hp SnO,oP4,31 Pmn21 0.382,0.430,0.361,90,90,90 - - 7.54 X 5567
O-Sn SnO m SnO-b,oS16,36 Cmc21 0.50045,0.57457,1.10485,90,90,90 - red ruby 5.63 X 59450
O-Sn SnO PbO,tP4,129 P4/nmm 0.38494,0.38494,0.4894,90,90,90 - black 6.17 X 56012
O-Sn SnO2 cub *,cF*,225 Fm-3m 0.53405,0.53405,0.53405,90,90,90 fluorite family - - N 44915
O-Sn SnO2 hp cub FeS2 ,cP12,205 Pa-3 0.48883,0.48883,0.48883,90,90,90 pyrite-marcasite family - 8.57 X 33670
O-Sn SnO2 hp orth1 ZrO2,oP24,61 Pbca 0.4731,0.9304,0.48927,90,90,90 - - 9.30 X 47305
O-Sn SnO2 hp orth2 CaCl2,oP6,58 Pnnm 0.46313,0.46533,0.3155,90,90,90 - - 7.36 X 33670
O-Sn SnO2 hp orth3 Fe2N0.94 ,oP12,60 Pbcn 0.4744,0.5707,0.5209,90,90,90 - - 7.10 A 33670
O-Sn SnO2 hp orth4 PbCl2,oP12,62 Pnma 0.50156,0.30282,0.59044,90,90,90 - - 11.16 X 47305
O-Sn SnO2 hp orth5 SnO2,oP36,60 Pbcn 0.476,0.571,1.584,90,90,90 - - 6.97 X 16907
O-Sn SnO2 rt TiO2 ,tP6,136 P42/mnm 0.47397,0.47397,0.31877,90,90,90 cassiterite white 6.99 X 38278
O-Sn Sn3O4 Sn3O4,mP14,14 P121/c1 0.8,0.55,0.48,90,95.9,90 - - 6.64 X 55553
O-Sr SrO rt NaCl,cF8,225 Fm-3m 0.51326,0.51326,0.51326,90,90,90 rocksalt family - 5.09 X 46184
O-Sr SrO1.96 CaC2,tI6,139 I4/mmm 0.35619,0.35619,0.6576,90,90,90 - colorless 4.74 X 36288
O-Ta TaO stab NaCl,cF8,225 Fm-3m 0.4422,0.4422,0.4422,90,90,90 rocksalt family - 15.13 X 591
O-Ta TaO0.05 W,cI2,229 Im-3m 0.3341,0.3341,0.3341,90,90,90 b.c.c. family - 16.19 F 591
O-Ta TaO0.9 tf BiF3 ,cF16,225 Fm-3m 0.444,0.444,0.444,90,90,90 b.c.c. family - 14.82 X 4261
O-Ta TaO1.1 tf TaO1.1 ,tI12,139 I4/mmm 0.361,0.361,0.51,90,90,90 - - 9.92 X 12755
O-Ta TaO1.67 rt AlB2 ,hP3,191 P6/mmm 0.362,0.362,0.3883,90,90,120 AlB2 family - 7.83 X 21252
O-Ta TaO2 hp TiO2 ,tP6,136 P42/mnm 0.4709,0.4709,0.3065,90,90,90 - black 10.41 X 591
O-Ta TaO2 tf NbO2,tI96,88 I41/a 1.332,1.332,0.612,90,90,90 - - 10.42 X 4253
O-Ta TaO2.5 rt orth7 *,oP*,17 P222 1 0.86,0.889,0.517,90,90,90 - - - N 4354
O-Ta TaO2.5 rt orth9 TaO2.5 ,oS14,38 Amm2 0.38933,0.36555,0.61966,90,90,90 - - 8.32 X 56423
O-Ta Ta0.36 O0.52 tf Ta0.36 O0.52,hP48,191 P6/mmm 0.716,0.716,1.152,90,90,120. - - 2.86 X 13735
O-Ta Ta0.38 O0.78 tf Ta0.38 O0.78,hP16,191 P6/mmm 0.620,0.620,0.590,90,90,120 - - 2.75 X 12746
O-Ta Ta0.625 O tf Ta0.625 O,tP80,123 P4/mmm 0.783,0.783,0.79,90,90,90 - - 3.54 X 15577
O-Ta Ta1.08 O Ta1.08 O,cP40,221 Pm-3m 0.775,0.775,0.775,90,90,90 - - 6.03 X 3248
O-Ta Ta1.1 O0.84 tf Ta1.1 O0.84 ,cP5,221 Pm-3m 0.387,0.387,0.387,90,90,90 - - 6.09 X 3248
O-Ta Ta1.10 O1.05 tf Ta1.10 O1.05,tP5,123 P4/mmm 0.387,0.387,0.389,90,90,90 - - 6.15 X 15577
O-Ta Ta1.19 O1.5 Nb0.91 O1.5 ,cP112,221 Pm-3m 0.79,0.79,0.79,90,90,90 - - 6.45 X 3248
O-Ta Ta1.5 O4.5 tf Ta1.5 O4.55 ,mS28,12 C12/m1 1.203,0.376,0.63,90,106.92,90 - - 4.18 X 10187
O-Ta Ta1.8 O2.83 tf Ta1.8 O2.8 ,oS46,65 Cmmm 0.3825,2.61,0.547,90,90,90 - - 2.26 X 7003
O-Ta Ta2O Ta2O,cI24,217 I-43m 0.668,0.668,0.668,90,90,90 - - 16.84 X 2674
O-Ta Ta2O5 (Sc) Ta2O5,mS42,5 C121 3.5961,0.3810,0.3810,90,96.04,90 tantite - 8.48 X 6097
O-Ta Ta2O5 19L Ta2O5,mP81,10 P12/m1 0.61939,0.38895,3.4912,90,95.089,90 - - 8.76 X 45219
O-Ta Ta2O5 hp Nb2O5,mS28,15 C12/c1 1.27853,0.48537,0.55276,90,104.264,90 - - 8.83 X 36951
O-Ta Ta2O5 ht mon Ta2O5,mS44,12 C12/m1 3.632,0.387,0.384,90,95.1,90 - - 8.19 X 47832
O-Ta Ta2O5 ht orth Ta2O5,oI44,74 Imma 0.384,0.387,3.618,90,90,90 - - 8.19 X 47832
O-Ta Ta2O5 ht tet Ta2O5,tI44,141 I41/amd 0.386,0.386,3.618,90,90,90 - - 8.17 X 47832
O-Ta Ta2O5 ht tricl *,aP42,* - 0.378,0.38,3.574,89.8,89.04,89.97 - - - N 5409
O-Ta Ta2O5 ht Ta2O5,oP84,25 Pmm2 0.3888,4.029,0.6198,90,90,90 - - 8.31 X 5643
O-Ta Ta2O5 mon Nb2O5,mS14,5 C121 0.52252,0.46991,0.58534,90,108.2,90 - - 10.75 X 36951
O-Ta Ta2O5 rt orth1 *,oS14,65 Cmmm 0.3662,0.6192,0.3885,90,90,90 - - - N 10005
O-Ta Ta2O5 rt orth2 Ta2O5,oP86,25 Pmm2 0.3894,4.3977,0.6209,90,90,90 - - 8.28 X 25872
O-Ta Ta2O5 rt orth4 *,oP42,* - 0.366,0.7551,1.8446,90,90,90 - - - N 4354
O-Ta Ta2O5 rt orth5 *,oP126,33 Pna21 2.2541,0.6621,1.0558,90,90,90 - - - N 4354
O-Ta Ta2O5 rt orth6 *,oP336,33 Pna21 1.465,0.9395,3.119,90,90,90 - - - N 4354
O-Ta Ta2O5 rt orth8 Ta2O5,oP14,49 Pccm 0.3677,0.6217,0.7794,90,90,90 - - 8.24 X 40617
O-Ta Ta2O5 tf orth *,o**,* - 0.62,1.17,6.96,90,90,90 - - - N 12746
O-Ta Ta2.32 O7.40 tf Ta2.32 O7.40,hP55,191 P6/mmm 0.716,0.716,1.152,90,90,120. - - 1.75 X 13735
O-Ta Ta3O7.5 F Ta3O7.5 ,oI44,72 Ibam 0.73485,1.04546,0.69576,90,90,90 - - 8.24 X 42542
O-Ta Ta4O Ta4O,oP5,47 Pmmm 0.3273,0.3273,0.7238,90,90,90 - black 15.84 X 591
O-Ta Ta9O22.5 tf *,hR30,146 R3 0.61944,0.61944,3.65988,90,90,120 - - 8.15 P 56864
O-Tb TbO1.5 ht2 NdO1.5 ,cI26,229 Im-3m 0.427,0.427,0.427,90,90,90 - - 7.80 A 5888
O-Tb TbO1.68 cub UN1.6 ,cI96,206 Ia-3 1.071,1.071,1.071,90,90,90 - - 8.04 X 50575
O-Tb TbO1.75 CaF2 ,cF12,225 Fm-3m 0.531,0.531,0.531,90,90,90 fluorite family - 8.29 X 54506
O-Tb TbO1.82 h *,hP*,* - 2.5836,2.5836,3.6672,90,90,120 - black - N 38090
O-Tb Tb11 O20 rt Tb11 O20-b,aP31,2 P-1 0.64878,0.65099,0.98298,95.881,90.019,99.966 - black 8.45 X 27696
O-Tb Tb2O3 ht1 La2O3,hP10,194 P63/mmc 0.386,0.386,0.613,90,90,120 - - 7.68 A 5888
O-Tb Tb2O3 mon Sm2 O3,mS30,12 C12/m1 1.403,0.3536,0.8717,90,100.1,90 - - 8.56 X 4305
O-Tb Tb2O3 trig La2O3,hP5,164 P-3m1 0.384,0.384,0.613,90,90,120 - - 7.76 A 2573
O-Tb Tb6O11 rt Tb6O11,aP68,1 P1 0.64,1.16723,1.224,73.367,79.97,79.438 - - 8.79 X 15339
O-Tb Tb7O12 rt Pr7O12,hR57,148 R-3 0.99229,0.99229,0.92637,90,90,120 fluorite family - 8.23 X 27696
O-Tc TcO2 VO2 ,mP12,14 P121/c1 0.54828,0.47546,0.55195,90,117.727,90 - black 6.78 X 48510
O-Tc Tc2O7 Tc2O7,oP36,61 Pbca 0.5617,1.3756,0.7439,90,90,90 - yellow 3.56 X 6315
O-Te TeO2 hp TeO2-a,oP12,19 P212121 0.46053,0.48557,0.7530,90,90,90 - - 6.30 X 9264
O-Te TeO2 m TeO2-b,oP12,19 P212121 0.4351,0.4898,0.8576,90,90,90 - - 5.80 X 37534
144 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

O-Te TeO2 rt TeO2,tP12,92 P41212 0.48082,0.48082,0.7612,90,90,90 paratellurite colorless 6.02 X 21440


O-Te TeO2 tel TeO2-b,oP24,61 Pbca 0.5464,0.5607,1.2035,90,90,90 tellurite yellow pale 5.75 X 3780
O-Te TeO3 hex *,hP*,* - 0.515,0.515,1.4296,90,90,120 - - - N 37093
O-Te TeO3 rt FeF3,hR24,167 R-3c 0.4901,0.4901,1.303,90,90,120 - whitish 6.45 X 21684
O-Te Te2O5 mon Te2O5,mP14,4 P1211 0.53680,0.46959,0.79551,90,104.82,90 - - 5.74 X 7191
O-Te Te2O5 tricl *,aP*,* - 0.4317,0.5932,0.74789,80.75,76.292,89.46 - - - N 37093
O-Te Te4O9 Te4O9,hR78,148 R-3 0.932,0.932,1.4486,90,90,120 - - 5.98 X 8731
O-Th ThO m NaCl,cF8,225 Fm-3m 0.5302,0.5302,0.5302,90,90,90 rocksalt family - 11.05 X 7522
O-Th ThO2 hp PbCl2,oP12,62 Pnma 0.5898,0.36,0.6862,90,90,90 - - 12.04 X 43762
O-Th ThO2 rt CaF2,cF12,225 Fm-3m 0.5604,0.5604,0.5604,90,90,90 thorianite white 9.97 X 16026
O-Ti TiO ht3 WC,hP2,187 P-6m2 0.3031,0.3031,0.32377,90,90,120 AlB2 family gray dark 4.12 X 29499
O-Ti TiO rt TiO,mS20,12 C12/m1 0.9340,0.4142,0.5855,90,107.53,90 - - 4.91 X 3367
O-Ti TiO0.2 rt Mg,hP2,194 P63 /mmc 0.2963,0.2963,0.47673,90,90,120 close-packed structure - 4.68 F 12449
O-Ti TiO2 ana TiO2,tI12,141 I41/amd 0.37892,0.37892,0.9537,90,90,90 anatase yellow 3.88 X 7090
O-Ti TiO2 bro TiO2,oP24,61 Pbca 0.5138,0.9174,0.5449,90,90,90 brookite - 4.13 X 12260
O-Ti TiO2 hol MnO2,oP12,62 Pnma 0.9459,0.29585,0.49022,90,90,90 - colorless 3.87 X 29174
O-Ti TiO2 hp1 ReO2,oP12,60 Pbcn 0.45271,0.54972,0.49001,90,90,90 - colorless 4.35 X 48279
O-Ti TiO2 hp2 ZrO2-b,mP12,14 P121/c1 0.4525,0.4767,0.4718,90,98.7,90 - - 5.28 X 45534
O-Ti TiO2 lt VO2-b,mS24,12 C12/m1 1.22078,0.37488,0.65296,90,107.065,90 - - 3.72 X 54019
O-Ti TiO2 rut TiO2,tP6,136 P42 /mnm 0.45924,0.45924,0.29575,90,90,90 rutile gray 4.25 X 25585
O-Ti Ti0.84 O0.84 ht1 Ti0.84 O0.84 ,mS24,12 C12/m1 0.9340,0.4141,0.5860,90,107.553,90 - - 4.95 X 11135
O-Ti Ti0.92 O ht2 NaCl,cF8,225 Fm-3m 0.4177,0.4177,0.4177,90,90,90 rocksalt family blue gray 5.47 X 23113
O-Ti Ti1.90 O3 Al2O3,hR30,167 R-3c 0.5157,0.5157,1.361,90,90,120 tistarite - 4.42 X 10354
O-Ti Ti15O29 *,aP88,2 P-1 0.71382,0.87867,1.54622,93.58,101.57,106.2 - - - N 5675
O-Ti Ti16O31 *,aP94,2 P-1 0.71382,0.87866,1.61302,84.893,89.49,73.799 - - - N 5675
O-Ti Ti17O33 *,aP100,2 P-1 0.71382,0.87867,1.75808,99.69,96.12,106.2 - - - N 5675
O-Ti Ti18O35 *,aP106,2 P-1 0.71382,0.87866,1.8171,88.253,86.59,73.799 - - - N 5675
O-Ti Ti19O37 *,aP112,2 P-1 0.71382,0.87867,1.96677,78.748,80.928,73.8 - - - N 5675
O-Ti Ti2O rt CdI2,hP3,164 P-3m1 0.296,0.296,0.483,90,90,120 CdI2 -PbI2 polytype - 5.07 X 5491
O-Ti Ti2O3 hp Th2S3,oP20,62 Pnma 0.78248,0.28507,0.80967,90,90,90 - - 5.29 X 59256
O-Ti Ti20O39 *,aP118,2 P-1 0.71382,0.87866,2.04374,82.839,83.52,73.799 - - - N 5675
O-Ti Ti21O41 *,aP124,2 P-1 0.71382,0.87867,2.13725,85.052,84.972,73.8 - - - N 5675
O-Ti Ti22O43 lt2 *,aP130,2 P-1 0.71382,0.87866,2.28052,100.726,92.728,106.201 - - - N 5675
O-Ti Ti3O rt Ti3O,hP24,149 P312 0.51418,0.51418,1.4308,90,90,120 - - 4.86 X 3825
O-Ti Ti3O5 ht Ti3O5-b,mS32,12 C12/m1 0.98377,0.37879,0.99737,90,91.269,90 - - 4.00 X 55836
O-Ti Ti3O5 lt *,mP32,13 P12/c1 0.721,0.5062,0.9966,90,109.34,90 - - - N 25306
O-Ti Ti3O5 rt mon1 Ti3O5-a,mS32,12 C12/m1 0.97568,0.38008,0.94389,90,91.547,90 - black 4.25 X 29193
O-Ti Ti3O5 rt mon2 V3O5,mS32,15 C12/c1 1.0115,0.50747,0.7181,90,112.024,90 - black 4.35 X 14944
O-Ti Ti3O5 stab Ta3N5,oS32,63 Cmcm 0.3798,0.9846,0.9988,90,90,90 - - 3.98 X 34777
O-Ti Ti4O5 ht1 Ti4O5,tI18,87 I4/m 0.6594,0.6594,0.4171,90,90,90 - - 4.97 X 4170
O-Ti Ti4O7 lt1 Ti4O7,aP110,2 P-1 0.6918,1.1142,1.5127,90.64,92.79,91.45 - - 4.33 X 17234
O-Ti Ti4O7 lt2 Ti4O7-b,aP22,2 P-1 0.5626,0.6892,0.7202,63.714,70.32,74.759 - - 4.32 X 17234
O-Ti Ti4O7 rt Ti4O7-a,aP22,2 P-1 0.5597,0.6903,0.7125,64.12,71.24,75.65 - - 4.33 X 17234
O-Ti Ti5O9 rt Ti5O9,aP28,2 P-1 0.5568,0.7115,0.8484,69.78,75.00,71.49 - - 4.32 X 10892
O-Ti Ti6O rt Ti6O,hP14,163 P-31c 0.506,0.506,0.948,90,90,120 - - 4.79 X 5491
O-Ti Ti6O11 lt1 Ti6O11,aP102,2 P-1 0.7517,1.1986,1.3397,98.29,105.52,107.79 - - 4.30 X 16279
O-Ti Ti6O11 rt Ti6O11,aP34,2 P-1 0.5552,0.7126,0.9714,89.82,79.75,71.49 - - 4.30 X 15374
O-Ti Ti7O13 Ti7O13,aP40,2 P-1 0.5537,0.7132,1.1306,83.70,89.53,71.50 - - 4.29 X 15374
O-Ti Ti8O15 Ti8O15,aP46,2 P-1 0.5526,0.7133,1.3390,100.57,96.51,108.51 - - 4.28 X 15374
O-Ti Ti9O17 Ti9O17,aP52,2 P-1 0.5524,0.7142,1.4746,96.62,90.42,108.53 - - 4.27 X 15374
O-Tl TlO cub1 CsCl,cP2,221 Pm-3m 0.3945,0.3945,0.3945,90,90,90 b.c.c. family - 5.96 X 39902
O-Tl Tl2O rt Tl2O,hR18,166 R-3m 0.32984,0.32984,3.7722,90,90,120 - black 11.91 X 23914
O-Tl Tl2O3 cub2 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.05344,1.05344,1.05344,90,90,90 avicennite black 10.38 X 27935
O-Tl Tl2O3 hp Al2O3,hR30,167 R-3c 0.57468,0.57468,1.4851,90,90,120 - black 10.71 A 4625
O-Tl Tl4O3 Tl4O3,mP14,11 P121/m1 0.761,0.345,1.088,90,109.58,90 - - 10.68 X 7335
O-Tm TmO1.5 tf CaF2,cF12,225 Fm-3m 0.512,0.512,0.512,90,90,90 fluorite family - 9.55 X 11547
O-Tm Tm2O3 mon Sm2O3,mS30,12 C12/m1 1.379,0.3445,0.849,90,100.26,90 - - 9.69 A 6612
O-Tm Tm2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.04908,1.04908,1.04908,90,90,90 - - 8.88 X 37503
O-U UO stab NaCl,cF8,225 Fm-3m 0.5,0.5,0.5,90,90,90 rocksalt family - 13.50 X 7522
O-U UO2 rt CaF2,cF12,225 Fm-3m 0.5468,0.5468,0.5468,90,90,90 uraninite black 10.97 X 52324
O-U UO2.25 ht1 UO2.25 ,cF76,216 F-43m 0.544,0.544,0.544,90,90,90 - - 11.31 X 22586
O-U UO3 cub ReO3,cP4,221 Pm-3m 0.4165,0.4165,0.4165,90,90,90 - red brick 6.57 X 21683
O-U UO3 hp UO3,oP16,19 P212121 0.5224,0.5466,0.7511,90,90,90 - - 8.86 X 2893
O-U UO3 ht UO3,tI64,141 I41/amd 0.69013,0.69013,1.99754,90,90,90 - yellow 7.99 X 10803
O-U UO3 mon UO3,mP40,4 P1211 0.3910,1.433,1.034,90,99.03,90 - - 8.30 X 2931
O-U UO3 rt UO3,oF128,70 Fddd 0.9705,0.9787,1.9932,90,90,90 - - 8.03 X 10803
O-U U13O34 U13O34,oS94,38 Amm2 0.4143,5.1532,0.6740,90,90,90 - - 8.40 X 12775
O-U U16O37 U16O37,tI848,122 I-42d 2.15898,2.15898,2.2229,90,90,90 - - 11.28 X 52324
O-U U2O5 hp *,mS28,* - 0.5675,0.5074,1.24,90,99.2,90 - - - N 6301
O-U U2O5 hp-ht *,hP14,194 P63 /mmc 0.3813,0.3813,1.318,90,90,120 - - 11.13 N 5371
O-U U2O5 m U2O5,oP112,62 Pnma 0.6849,0.8274,3.1706,90,90,90 - - 8.22 X 12775
O-U U2.63 O7.89 orth U2.63 O7.89 ,oS34,65 Cmmm 0.6842,1.185,0.4157,90,90,90 - brown 7.41 X 6472
O-U U3O8 ht1 U3O8-b,oS44,63 Cmcm 0.7069,1.1445,0.8303,90,90,90 - - 8.33 X 5020
O-U U3O8 ht2 U3O8,hP11,189 P-62m 0.6821,0.6821,0.41517,90,90,120 - red brown 8.36 X 52324
O-U U3O8 mon U3O8,mP44,11 P121/m1 0.672,0.829,1.193,90,91.,90 - - 8.42 X 926
O-U U3O8 orth U3O8-a,oS44,63 Cmcm 1.193,0.672,0.829,90,90,90 - - 8.42 X 926
O-U U3O8 rt U3O8-b,oS22,38 Amm2 0.4148,1.1966,0.6717,90,90,90 - black 8.39 X 2105
O-U U4O9 rt U4O9,aP408,1 P1 1.8727,1.89286,1.89286,109.686,109.256,109.256 - - 11.25 X 56360
Handbook of Inorganic Substances – Edition 2015 : Data 145

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

O-U U64O143 U64O143 ,cI864,220 I-43d 2.17666,2.17666,2.17666,90,90,90 - - 11.29 X 52324


O-V VO0.03 Ba0.25 Bi0.75 O1.375 ,cI8,229 Im-3m 0.3043,0.3043,0.3043,90,90,90 - - 6.06 X 35965
O-V VO0.33 ht CoO,tI4,139 I4/mmm 0.2912,0.2912,0.3407,90,90,90 rocksalt family - 6.46 X 707
O-V VO2 (Fe) MnO2,oP12,62 Pnma 0.939,0.293,0.489,90,90,90 paramontroseite - 4.09 X 676
O-V VO2 B m VO2 -b,mS24,12 C12/m1 1.20673,0.36892,0.64212,90,106.97,90 - black 4.03 X 46833
O-V VO2 ht M2 O+ VO2 -a,mS24,12 C12/m1 0.90664,0.57970,0.45255,90,91.88,90 - - 4.63 X 6936
O-V VO2 ht TiO2 ,tP6,136 P42/mnm 0.45546,0.45546,0.28514,90,90,90 - - 4.66 X 8486
O-V VO2 ht-A m VO2 ,tI24,87 I4/m 0.8476,0.8476,0.3824,90,90,90 - black 4.01 X 34900
O-V VO2 rt M3 O+ VO2 ,mP6,10 P12/m1 0.4506,0.2899,0.4617,90,91.79,90 - - 4.57 X 36518
O-V VO2 rt mon VO2 ,mP12,14 P121/c1 0.53528,0.45378,0.53825,90,115.208,90 - black 4.66 X 5061
O-V VO2 rt tricl VO2 ,aP12,2 P-1 0.45203,0.53640,0.53785,65.002,88.826,88.812 - - 4.66 X 10828
O-V VO2 rt-A m VO2 ,tP48,130 P4/ncc 0.84403,0.84403,0.7666,90,90,90 - black 4.04 X 34900
O-V V0.83 O0.87 ht NaCl,cF8,225 Fm-3m 0.4026,0.4026,0.4026,90,90,90 rocksalt family gray silver 5.72 X 52356
O-V V13O16 rt V13O16,tI116,141 I41/amd 1.1746,1.1746,0.82527,90,90,90 - - 5.36 X 56479
O-V V16O3 rt V16O3,tI76,139 I4/mmm 1.196,1.196,0.6604,90,90,90 - - 6.07 X 7631
O-V V2O3 lt V2O3,mS20,15 C12/c1 0.86138,0.50053,0.55514,90,123.011,90 - - 4.96 X 41969
O-V V2O3 m (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 0.93947,0.93947,0.93947,90,90,90 - - 4.80 X 56371
O-V V2O3 rt Al2O3,hR30,167 R-3c 0.49605,0.49605,1.39857,90,90,120 karelianite black 5.01 X 8725
O-V V2O5 hp1 V2O5,mP14,11 P121/m1 0.62846,0.35718,0.7114,90,90.069,90 - red dark 3.78 X 42714
O-V V2O5 hp2 Nb2O5,mS28,15 C12/c1 1.19719,0.47017,0.53253,90,104.41,90 - - 4.16 X 48577
O-V V2O5 m V2O5,oP28,62 Pnma 0.99461,0.35852,1.00423,90,90,90 - - 3.37 X 25087
O-V V2O5 rt V2O5,oP14,59 Pmmn 0.3564,1.1512,0.4368,90,90,90 shcherbinaite brown 3.37 X 18792
O-V V3O4 hp Fe3O4,cF56,227 Fd-3m 0.8457,0.8457,0.8457,90,90,90 spinel family - 4.76 A 9296
O-V V3O5 ht V3O5,mS32,15 C12/c1 1.0033,0.5039,0.6988,90,111.5,90 oxyvanite - 4.70 X 52160
O-V V3O5 m Ta3N5,oS32,63 Cmcm 0.37002,0.97187,0.99376,90,90,90 - black 4.33 X 58385
O-V V3O5 rt V3O5,mP32,13 P12/c1 0.9859,0.50416,0.6991,90,109.478,90 - - 4.72 X 12954
O-V V3O7 V3O7,mS120,15 C12/c1 2.1921,0.3679,1.8341,90,95.61,90 - black 3.58 X 7975
O-V V3O7.1 *,tP*,127 P4/mbm 0.89065,0.89065,0.55823,90,90,90 - - - N 34201
O-V V4O7 lt Ti4O7-a,aP22,2 P-1 0.5509,0.67847,0.7008,64.13,70.79,75.43 - - 4.75 X 7562
O-V V5O9 lt V5O9,aP56,2 P-1 0.7002,0.83516,1.09052,91.91,108.39,110.5 - - 4.73 X 25053
O-V V5O9 rt Ti5O9,aP28,2 P-1 0.5472,0.7003,0.83491,69.529,75.103,70.99 - - 4.73 X 8376
O-V V6O11 lt Ti6O11,aP34,2 P-1 0.5448,0.6998,0.96105,89.946,79.428,71.1 - - 4.70 X 9985
O-V V6O13 lt V6O13,mP38,7 P1c1 1.00605,0.37108,1.19633,90,100.927,90 - black 3.89 X 41290
O-V V6O13 orth V6O13,oF76,69 Fmmm 0.368,1.1922,1.9912,90,90,90 - - 3.91 X 18212
O-V V6O13 rt V6O13,mS38,12 C12/m1 1.1922,0.3680,1.0138,90,100.87,90 - black 3.91 X 5738
O-V V7O13 Ti7O13,aP40,2 P-1 0.5439,0.7005,1.1076,84.316,88.615,71. - - 4.72 X 9985
O-V V7O3 rt V7O3,mS20,12 C12/m1 0.95536,0.29184,0.77622,90,90.32,90 - - 6.21 X 49133
O-V V8O rt tet V8O,tP18,136 P42/mnm 0.8754,0.8754,0.2996,90,90,90 - - 6.13 X 9792
O-V V8O rt tricl *,aP*,* - 0.2994,0.311,0.311,90.,90.3,90.3 - - - N 8441
O-V V8O15 lt Ti8O15,aP46,2 P-1 0.543,0.699,1.30785,100.057,95.847,109. - - 4.72 X 42419
O-V V9O17 rt Ti9O17,aP52,2 P-1 0.5418,0.7009,1.45422,96.824,84.56,108.9 - - 4.68 X 42419
O-V [VO]2[V2O7] [VO]2[V2O7],oS104,63 Cmcm 1.0356,0.8174,1.6559,90,90,90 - - 3.30 X 54917
O-W WO2 hp WO2,oP36,62 Pnma 0.97164,0.84380,0.47564,90,90,90 - brownish 11.03 X 29647
O-W WO2 VO2 ,mP12,14 P121/c1 0.55635,0.48986,0.56644,90,120.444,90 - brown 10.77 X 29835
O-W WO2.95 WO2.95 ,tP16,113 P-421m 0.739,0.739,0.388,90,90,90 - blue dark 7.24 X 34682
O-W WO2.96 *,mP*,10 P12/m1 1.19,0.3826,2.982,90,98.4,90 - - - N 3063
O-W WO3 hex WO3,hP12,191 P6/mmm 0.7298,0.7298,0.3899,90,90,120 - white 6.42 X 12534
O-W WO3 ht1 WO3,mP32,14 P121/c1 0.73271,0.75644,1.06035,90,133.22,90 - black green 7.19 X 36173
O-W WO3 ht2 WO3,oP32,60 Pbcn 0.73331,0.77401,0.75733,90,90,90 - - 7.17 X 36173
O-W WO3 ht3 WO3,tP16,130 P4/ncc 0.52885,0.52885,0.78626,90,90,90 - - 7.00 X 35993
O-W WO3 ht4 WO3,tP8,129 P4/nmm 0.53031,0.53031,0.39348,90,90,90 - - 6.96 X 35993
O-W WO3 lt1 WO3,mP16,7 P1c1 0.52778,0.51559,0.76639,90,91.762,90 - yellow 7.39 X 33467
O-W WO3 m cub ReO3,cP4,221 Pm-3m 0.3838,0.3838,0.3838,90,90,90 - - 6.81 X 7417
O-W WO3 m hex WO3,hP30,193 P63/mcm 0.73244,0.73244,0.76628,90,90,120 - - 6.49 X 26358
O-W WO3 rt mon1 WO3-b,mP16,14 P121/c1 0.5261,0.5128,0.7650,90,92.05,90 - - 7.47 X 33470
O-W WO3 rt WO3,aP32,2 P-1 0.7309,0.7522,0.7678,88.81,89.08,89.07 - white 7.30 X 11176
O-W W0.75 O0.25 m Cr,cP8,223 Pm-3n 0.5036,0.5036,0.5036,90,90,90 Frank-Kasper phase - 14.76 X 560
O-W W10 O29 ht W10 O29,mP78,10 P12/m1 1.21,0.378,2.34,90,95.,90 - blue green 7.17 X 341
O-W W11 O12 hp W11 O12,oS46,35 Cmm2 0.516,1.716,0.378,90,90,90 - - 21.97 X 25856
O-W W17 O47 ht W17 O47,mP64,10 P12/m1 1.2326,0.3787,1.884,90,102.67,90 - pink mauve 7.50 X 21076
O-W W18 O49 ht W18 O49,mP67,10 P12/m1 1.40280,0.37828,1.77039,90,110.587,90 - red dark 7.73 X 20690
O-W W2O3 tf *,c**,* - 0.686,0.686,0.686,90,90,90 - - - N 7417
O-W W25 O73 ht W25 O73,mP196,13 P12/c1 1.193,0.3820,5.972,90,98.3,90 - blue dark 7.11 X 9583
O-W W3O8 hp1 W3O8,oP44,55 Pbam 1.035,1.399,0.378,90,90,90 - red dark 8.25 X 27145
O-W W3O8 hp2 U3O8,oS22,21 C222 0.6386,1.043,0.38,90,90,90 - red dark 8.92 X 27145
O-W W5O14 (Fe) W5O14,tP152,113 P-421m 2.333,2.333,0.3797,90,90,90 - purple 7.35 X 11689
O-W W6O17 *,mP*,* - 1.707,0.3781,1.931,90,104.4,90 - - - N 15334
O-W W8O21 hp W8O21,oP116,55 Pbam 1.7766,2.1431,0.3783,90,90,90 - - 8.33 X 27113
O-Xe XeO3 XeO3,oP16,19 P212121 0.5234,0.6163,0.8115,90,90,90 - colorless 4.55 X 1907
O-Y Y2O3 hp1 Sm2 O3,mS30,12 C12/m1 1.38714,0.34487,0.85862,90,100.12,90 - - 5.56 X 28591
O-Y Y2O3 hp2 La2O3,hP5,164 P-3m1 0.35687,0.35687,0.54131,90,90,120 - - 6.28 A 54335
O-Y Y2O3 ht La2O3,hP10,194 P63/mmc 0.381,0.381,0.609,90,90,120 - - 4.90 A 2582
O-Y Y2O3 ht-hp Cr3C2-b,oP20,62 Pnma 0.5846,0.32607,1.25723,90,90,90 - - 6.26 A 54335
O-Y Y2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.05981,1.05981,1.05981,90,90,90 yttriaite-(Y) colorless 5.04 X 31428
O-Yb YbO NaCl,cF8,225 Fm-3m 0.486,0.486,0.486,90,90,90 rocksalt family - 10.94 X 969
O-Yb YbO1.5 tf CaF2 ,cF12,225 Fm-3m 0.5115,0.5115,0.5115,90,90,90 fluorite family - 9.78 X 11547
O-Yb Yb2O3 hp Sm2 O3,mS30,12 C12/m1 1.326,0.341,0.813,90,98.6,90 - - 10.80 A 30876
O-Yb Yb2O3 rt (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.04342,1.04342,1.04342,90,90,90 - yellow 9.22 X 22373
146 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

O-Yb Yb3O4 Eu3O4,oP28,62 Pnma 0.9758,0.3333,1.162,90,90,90 - - 10.25 A 11416


O-Zn ZnO hp NaCl,cF8,225 Fm-3m 0.427,0.427,0.427,90,90,90 rocksalt family - 6.94 X 25212
O-Zn ZnO m ZnS,cF8,216 F-43m 0.5587,0.5587,0.5587,90,90,90 adamantane structure - 3.10 X 4816
O-Zn ZnO ZnO,hP4,186 P63 mc 0.32494,0.32494,0.52054,90,90,120 zincite red 5.68 X 46535
O-Zn ZnO2 FeS2,cP12,205 Pa-3 0.4871,0.4871,0.4871,90,90,90 pyrite-marcasite family - 5.60 X 1090
O-Zr ZrO NaCl,cF8,225 Fm-3m 0.462,0.462,0.462,90,90,90 rocksalt family - 7.22 X 595
O-Zr ZrO0.19 Mg,hP2,194 P63 /mmc 0.3253,0.3253,0.518,90,90,120 close-packed structure - 6.59 F 18181
O-Zr ZrO0.368 rt ZrO0.37 ,hP12,182 P6322 0.5631,0.5631,0.5191,90,90,120 - - 6.79 X 4165
O-Zr ZrO2 (Mg) ZrO2,oP12,29 Pca21 0.526,0.5068,0.5077,90,90,90 - brown dark 6.05 X 23448
O-Zr ZrO2 hp1 orth ZrO2,oP16,57 Pbcm 0.5005,0.5235,0.5051,90,90,90 - - 6.18 X 19432
O-Zr ZrO2 hp1 tet MnF2,tP12,111 P-42m 0.5046,0.5046,0.5129,90,90,90 - - 6.27 A 17735
O-Zr ZrO2 hp2 ZrO2,oP24,61 Pbca 0.5091,1.00861,0.52615,90,90,90 - - 6.06 X 23930
O-Zr ZrO2 hp3 PbCl2,oP12,62 Pnma 0.55873,0.33298,0.64847,90,90,90 - - 6.78 X 33090
O-Zr ZrO2 hp4 *,tP12,* - 0.452,0.452,0.501,90,90,90 - - - N 23944
O-Zr ZrO2 ht-hp *,hP24,* - 0.677,0.677,0.684,90,90,120 - - - N 29349
O-Zr ZrO2 ht1 ZrO2,tP6,137 P42 /nmc 0.36067,0.36067,0.51758,90,90,90 fluorite family - 6.08 X 27124
O-Zr ZrO2 ht2 CaF2,cF12,225 Fm-3m 0.4947,0.4947,0.4947,90,90,90 fluorite family - 6.76 X 37996
O-Zr ZrO2 nano ZrO2-c,mP12,14 P121/c1 0.5107,0.5107,0.5107,90,90.,90 - - 6.14 X 47451
O-Zr ZrO2 rt ZrO2-b,mP12,14 P121/c1 0.51499,0.51991,0.53267,90,99.124,90 baddeleyite colorless 5.81 X 46572
O-Zr Zr2O tf Cu2O,cP6,224 Pn-3m 0.5088,0.5088,0.5088,90,90,90 - - 5.00 X 18550
O-Zr Zr3O ht1 Fe3N,hP8,182 P6322 0.56172,0.56172,0.5185,90,90,120 - - 6.79 X 35965
O-Zr Zr3O rt Zr+ FeF3,hR24,167 R-3c 0.56295,0.56295,1.55925,90,90,120 - - 6.74 X 4002
O-Zr Zr3O rt Zr3O,hR48,155 R32 0.5563,0.5563,3.1185,90,90,120 - - 6.91 X 4552
O-Zr Zr3O0.89 rt Zr3O0.89 ,hP24,165 P-3c1 0.5634,0.5634,1.5555,90,90,120 - - 6.71 X 4165
Os-P OsP2 FeAs2,oP6,58 Pnnm 0.51001,0.59012,0.29182,90,90,90 pyrite-marcasite family - 9.53 X 3878
Os-P OsP4 ht RuP 4,aP15,2 P-1 0.4718,0.7153,0.754,111.2,90.34,100.38 - black 6.73 A 11970
Os-P OsP4 rt CdP 4,mP10,14 P121/c1 0.4694,0.4683,0.7096,90,99.57,90 - black 6.78 A 15270
Os-Pr PrOs2 cub MgCu2,cF24,227 Fd-3m 0.766,0.766,0.766,90,90,90 Friauf-Laves phase - 15.41 X 7478
Os-Pr PrOs2 hex MgZn2,hP12,194 P63 /mmc 0.5368,0.5368,0.8945,90,90,120 Friauf-Laves phase - 15.51 X 1059
Os-Pr Pr3Os Fe3C-b,oP16,62 Pnma 0.7452,0.961,0.6457,90,90,90 - - 8.80 A 13334
Os-Pt Os0.55Pt0.45 Cu,cF4,225 Fm-3m 0.3888,0.3888,0.3888,90,90,90 close-packed structure - 21.74 X 51048
Os-Pt Os0.89Pt0.11 Mg,hP2,194 P63 /mmc 0.2737,0.2737,0.434,90,90,120 close-packed structure - 22.50 X 51048
Os-Pu PuOs2 Pu+ MgZn2,hP12,194 P63 /mmc 0.5329,0.5329,0.8691,90,90,120 Friauf-Laves phase - 19.40 A 9062
Os-Pu PuOs2 MgCu2,cF24,227 Fd-3m 0.75299,0.75299,0.75299,90,90,90 Friauf-Laves phase - 19.43 X 9062
Os-Pu Pu12.35 Os0.65 ht Pu12(Pu0.35 Os0.65 ),oP52,52 Pnna 1.5839,0.7819,0.9151,90,90,90 - - 18.39 X 12126
Os-Pu Pu4.75 Os0.25 rt Pu4(Pu0.75 Os0.25),oS40,64 Cmce 0.5345,1.4884,1.0898,90,90,90 - - 18.49 X 11344
Os-Pu Pu5Os3 W5Si3,tI32,140 I4/mcm 1.08818,1.08818,0.56645,90,90,90 - - 17.73 X 8543
Os-Re Re0.5 Os0.5 Mg,hP2,194 P63 /mmc 0.2751,0.2751,0.4366,90,90,120 close-packed structure - 21.84 X 49124
Os-Rh Os0.36 Rh0.64 Cu,cF4,225 Fm-3m 0.3806,0.3806,0.3806,90,90,90 close-packed structure - 16.18 X 44148
Os-Rh Os0.5 Rh0.5 Mg,hP2,194 P63 /mmc 0.2717,0.2717,0.4326,90,90,120 close-packed structure - 17.60 X 40587
Os-Ru Os0.5 Ru0.5 Mg,hP2,194 P63 /mmc 0.2716,0.2716,0.4302,90,90,120 close-packed structure - 17.60 X 53539
Os-S OsS2 FeS2,cP12,205 Pa-3 0.56194,0.56194,0.56194,90,90,90 erlichmanite black 9.52 X 26936
Os-Sb OsSb2 FeAs2,oP6,58 Pnnm 0.59409,0.6688,0.32112,90,90,90 pyrite-marcasite family - 11.29 X 3878
Os-Sc ScOs2 MgZn2,hP12,194 P63 /mmc 0.5179,0.5179,0.8484,90,90,120 Friauf-Laves phase - 14.34 X 1059
Os-Sc Sc11Os4 Sc11Ir4,cF120,225 Fm-3m 1.3344,1.3344,1.3344,90,90,90 - - 7.02 X 13083
Os-Sc Sc44Os7 Mg44Rh7,cF408,216 F-43m 2.0771,2.0771,2.0771,90,90,90 - - 4.91 X 13001
Os-Se OsSe2 FeS2,cP12,205 Pa-3 0.5946,0.5946,0.5946,90,90,90 pyrite-marcasite family - 11.00 X 4005
Os-Si OsSi rt FeSi,cP8,198 P213 0.4729,0.4729,0.4729,90,90,90 - - 13.71 X 889
Os-Si OsSi stab CsCl,cP2,221 Pm-3m 0.296,0.296,0.296,90,90,90 b.c.c. family - 13.98 X 1679
Os-Si OsSi2 rt FeSi2,oS48,64 Cmce 1.01496,0.81168,0.8223,90,90,90 - - 9.66 X 5048
Os-Si OsSi2 stab OsGe2,mS12,12 C12/m1 0.8661,0.2984,0.7472,90,119.01,90 - - 9.69 A 21372
Os-Si Os2Si3 rt Ru2Ge3,oP40,60 Pbcn 1.1157,0.8964,0.558,90,90,90 chimney-ladder structure - 11.06 A 21372
Os-Sm SmOs2 MgZn2,hP12,194 P63 /mmc 0.5336,0.5336,0.8879,90,90,120 Friauf-Laves phase - 16.10 X 1059
Os-Sm Sm3Os Fe3C-b,oP16,62 Pnma 0.7419,0.9365,0.6372,90,90,90 - - 9.62 A 13334
Os-Sn Os3Sn7 hp-ht Ru3Sn7,cI40,229 Im-3m 0.9378,0.9378,0.9378,90,90,90 - gray silver 11.29 X 37396
Os-Sn Os4Sn17 Os4Sn17,oP84,57 Pbcm 0.6949,1.4281,1.9211,90,90,90 - - 9.68 X 31877
Os-Ta Ta0.2 Os0.8 Mg,hP2,194 P63 /mmc 0.27627,0.27627,0.44106,90,90,120 close-packed structure - 21.46 X 2681
Os-Ta Ta0.5 Os0.5 Mn,cI58,217 I-43m 0.97633,0.97633,0.97633,90,90,90 - - 19.21 A 2681
Os-Ta Ta0.6 Os0.4 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9842,0.9842,0.5121,90,90,90 Frank-Kasper phase - 18.54 A 2681
Os-Ta Ta0.9 Os0.1 W,cI2,229 Im-3m 0.32732,0.32732,0.32732,90,90,90 b.c.c. family - 17.22 X 2681
Os-Tb TbOs2 MgZn2,hP12,194 P63 /mmc 0.5314,0.5314,0.8802,90,90,120 Friauf-Laves phase - 16.64 A 3261
Os-Tb Tb3Os Fe3C-b,oP16,62 Pnma 0.7368,0.9123,0.6286,90,90,90 - - 10.49 A 13334
Os-Tc Tc0.5 Os0.5 Mg,hP2,194 P63 /mmc 0.274,0.274,0.4344,90,90,120 close-packed structure - 16.94 X 1682
Os-Te OsTe2 ht FeS2,cP12,205 Pa-3 0.6397,0.6397,0.6397,90,90,90 pyrite-marcasite family black 11.30 X 26937
Os-Te OsTe2 rt FeS2,oP6,58 Pnnm 0.528,0.6402,0.4048,90,90,90 pyrite-marcasite family - 10.81 A 8706
Os-Th ThOs2 MgCu2,cF24,227 Fd-3m 0.7715,0.7715,0.7715,90,90,90 Friauf-Laves phase - 17.72 X 2229
Os-Th Th0.99 Os0.01 rt Cu,cF4,225 Fm-3m 0.50873,0.50873,0.50873,90,90,90 close-packed structure - 11.69 X 2229
Os-Th Th7Os3 Th7Fe3,hP20,186 P63 mc 1.0031,1.0031,0.6296,90,90,120 - - 13.29 A 2229
Os-Ti TiOs CsCl,cP2,221 Pm-3m 0.308,0.308,0.308,90,90,90 b.c.c. family - 13.53 X 6238
Os-Tm TmOs2 MgZn2,hP12,194 P63 /mmc 0.5424,0.5424,0.8808,90,90,120 Friauf-Laves phase - 16.26 A 2437
Os-Tm Tm3Os Fe3C-b,oP16,62 Pnma 0.7339,0.8873,0.6136,90,90,90 - - 11.59 A 13335
Os-U UOs2 ht MgCu2,cF24,227 Fd-3m 0.7514,0.7514,0.7514,90,90,90 Friauf-Laves phase - 19.37 X 26269
Os-U UOs2 rt MgZn2,hP12,194 P63 /mmc 0.549,0.549,0.871,90,90,120 Friauf-Laves phase - 18.07 A 29209
Os-U U0.88 Os0.12 ht2 W,cI2,229 Im-3m 0.3485,0.3485,0.3485,90,90,90 b.c.c. family - 18.23 X 1941
Os-U U2Os *,mP12,* - 0.5167,0.3335,1.3366,90,96.68,90 - - - N 2820
Os-U U3Os *,t**,* - 0.9142,0.9142,0.5778,90,90,90 - - - N 26269
Os-V V0.4 Os0.6 Mg,hP2,194 P63 /mmc 0.2725,0.2725,0.442,90,90,120 close-packed structure - 15.72 X 12432
Os-V V0.8 Os0.2 W,cI2,229 Im-3m 0.3004,0.3004,0.3004,90,90,90 b.c.c. family - 9.65 X 12432
Handbook of Inorganic Substances – Edition 2015 : Data 147

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Os-V V1.2 Os0.8 rt CsCl,cP2,221 Pm-3m 0.3011,0.3011,0.3011,90,90,90 b.c.c. family - 12.97 X 12432
Os-V V2Os2 ht Cr3Si,cP8,223 Pm-3n 0.4812,0.4812,0.4812,90,90,90 Frank-Kasper phase - 14.38 X 12432
Os-W W0.35 Os0.65 Mg,hP2,194 P63/mmc 0.2766,0.2766,0.4445,90,90,120 close-packed structure - 21.20 X 1448
Os-W W0.7 Os0.3 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.96463,0.96463,0.49889,90,90,90 Frank-Kasper phase - 19.93 A 1448
Os-W W0.9 Os0.1 W,cI2,229 Im-3m 0.31573,0.31573,0.31573,90,90,90 b.c.c. family - 19.47 X 1448
Os-Y YOs2 MgZn2,hP12,194 P63/mmc 0.5307,0.5307,0.8786,90,90,120 Friauf-Laves phase - 14.55 X 1059
Os-Y Y3Os Fe3C-b,oP16,62 Pnma 0.7425,0.9132,0.6337,90,90,90 - - 7.06 A 13334
Os-Yb YbOs2 MgZn2,hP12,194 P63/mmc 0.5268,0.5268,0.869,90,90,120 Friauf-Laves phase - 17.60 A 10149
Os-Zr ZrOs CsCl,cP2,221 Pm-3m 0.3263,0.3263,0.3263,90,90,90 b.c.c. family - 13.45 X 31778
Os-Zr ZrOs2 MgZn2,hP12,194 P63/mmc 0.52,0.52,0.853,90,90,120 Friauf-Laves phase - 15.68 A 8416
Os-Zr Zr0.95 Os0.05 ht W,cI2,229 Im-3m 0.3558,0.3558,0.3558,90,90,90 b.c.c. family - 7.09 X 37300
Os-Zr Zr0.97 Os0.03 m Ti,hP3,191 P6/mmm 0.5038,0.5038,0.313,90,90,120 - - 6.82 X 37300
Os-Zr Zr0.9975 Os0.0025 rt Mg,hP2,194 P63/mmc 0.3232,0.3232,0.5148,90,90,120 close-packed structure - 6.52 X 37300
Os-Zr Zr11 Os4 Sc11 Ir4,cF120,225 Fm-3m 1.3414,1.3414,1.3414,90,90,90 - - 9.71 A 13083
Os-Zr Zr2Os ht Ti2Ni,cF96,227 Fd-3m 1.2365,1.2365,1.2365,90,90,90 - - 10.47 A 31778
Os-Zr Zr54 Os17 Hf54 Os17,oI142,71 Immm 1.4039,1.4195,1.4724,90,90,90 - - 9.24 A 31778
P-Pa PaP2 UAs2,tP6,129 P4/nmm 0.3838,0.3838,0.7845,90,90,90 - - 8.42 A 15235
P-Pa Pa3P 4 Th3P 4,cI28,220 I-43d 0.82424,0.82424,0.82424,90,90,90 - - 9.69 A 15235
P-Pd PdP2 PdP2 ,mS12,15 C12/c1 0.67787,0.5857,0.5874,90,121.769,90 - - 5.64 X 1809
P-Pd PdP3 CoAs3,cI32,204 Im-3 0.7705,0.7705,0.7705,90,90,90 - - 5.79 A 1279
P-Pd Pd15P 2 Pd15P 2,hR51,148 R-3 0.71067,0.71067,1.70867,90,90,120 - - 11.05 X 10328
P-Pd Pd3P 0.68 ht Pd3P 0.68 ,mP24,4 P1211 0.5004,0.7606,0.8416,90,95.63,90 - - 10.64 X 2969
P-Pd Pd3P 0.8 Fe3C-b,oP16,62 Pnma 0.57019,0.75366,0.51191,90,90,90 - - 10.39 X 13450
P-Pd Pd6P Pd6P,mP28,14 P121/c1 0.56740,0.94409,0.82100,90,110.414,90 - - 10.79 X 13998
P-Pd Pd7P 3 Pd7P 3,hR60,146 R3 1.1976,1.1976,0.7055,90,90,120 - - 9.52 X 10752
P-Pr PrP NaCl,cF8,225 Fm-3m 0.59143,0.59143,0.59143,90,90,90 rocksalt family - 5.52 X 9097
P-Pr PrP 2 NdAs2,mP12,14 P121/c1 0.403,0.653,1.014,90,105.8,90 - - 5.25 A 9097
P-Pr PrP 5 NdP 5,mP12,11 P121/m1 0.4938,0.9595,0.5482,90,103.64,90 - black 3.89 X 35313
P-Pt PtP 2 FeS2 ,cP12,205 Pa-3 0.56948,0.56948,0.56948,90,90,90 pyrite-marcasite family - 9.24 X 28380
P-Pt Pt5P2 Pt5P2,mS28,15 C12/c1 1.07642,0.53854,0.74378,90,99.17,90 - - 16.19 X 3397
P-Pu PuP NaCl,cF8,225 Fm-3m 0.555,0.555,0.555,90,90,90 rocksalt family - 10.68 X 20253
P-Rb RbP 11 RbP 11,mP48,11 P121/m1 0.6508,0.9699,1.8005,90,95.62,90 - - 2.50 X 14080
P-Rb RbP 15 KP 15 ,aP32,2 P-1 0.721,0.91065,1.22,89.072,78.6,71.532 - - 2.46 A 18400
P-Rb Rb2P 3 Rb2P 3,oF40,69 Fmmm 0.9010,0.9641,1.4629,90,90,90 - black 2.76 X 20846
P-Rb Rb3P 11 ht Cs3P 11,cF188,225 Fm-3m 1.1592,1.1592,1.1592,90,90,90 - red 2.55 A 25545
P-Rb Rb3P 11 rt Na3P 11,oP56,60 Pbcn 1.0754,1.4555,1.0512,90,90,90 - orange red 2.41 A 25545
P-Rb Rb3P 7 ht Rb3P 7,cF284,225 Fm-3m 1.0837,1.0837,1.0837,90,90,90 - - 2.47 X 18661
P-Re ReP3 TcP 3 ,oP16,62 Pnma 1.5354,0.3122,0.513,90,90,90 - black 7.54 A 14949
P-Re ReP4 ReP4,oP40,61 Pbca 0.6227,0.9231,1.0854,90,90,90 - black 6.60 X 12128
P-Re Re2P Co2P,oP12,62 Pnma 0.554,0.294,1.0039,90,90,90 - black 16.39 X 17253
P-Re Re2P 5 Re2P 5,aP28,2 P-1 0.7329,0.8229,0.8336,69.82,67.72,87.11 - black 8.06 X 15137
P-Re Re3P 4 Cr3S4,mS14,12 C12/m1 1.21787,0.30118,0.60418,90,114.073,90 - - 11.20 X 2967
P-Re Re6P 13 Re6P 13,hR114,148 R-3 1.56792,1.56792,0.83231,90,90,120 - black 8.55 X 12591
P-Rh RhP 2 CoSb2,mP12,14 P121/c1 0.57417,0.57951,0.58389,90,112.911,90 pyrite-marcasite family - 6.12 X 5748
P-Rh RhP 3 CoAs3,cI32,204 Im-3 0.79951,0.79951,0.79951,90,90,90 - - 5.09 X 4481
P-Rh Rh2P CaF2 ,cF12,225 Fm-3m 0.55021,0.55021,0.55021,90,90,90 fluorite family - 9.44 X 19180
P-Rh Rh3P 2 Rh3P 2,tP5,115 P-4m2 0.3327,0.3327,0.6151,90,90,90 - - 9.04 X 15825
P-Rh Rh4P 3 Rh4P 3,oP28,62 Pnma 1.1662,0.3317,0.9994,90,90,90 - - 8.67 X 1221
P-Ru RuP FeAs,oP8,62 Pnma 0.552,0.3168,0.612,90,90,90 AlB2 family - 8.20 A 1630
P-Ru RuP 2 FeAs2,oP6,58 Pnnm 0.51173,0.58932,0.28711,90,90,90 pyrite-marcasite family - 6.25 X 3878
P-Ru RuP 3 RuP 3,aP16,2 P-1 0.5866,0.5924,0.8076,68.76,70.15,72.59 - - 5.35 X 20875
P-Ru RuP 4 ht RuP 4,aP15,2 P-1 0.4713,0.7145,0.7519,111.08,90.35,100.48 - black 4.84 X 11970
P-Ru RuP 4 rt CdP 4,mP10,14 P121/c1 0.4686,0.4678,0.7102,90,99.47,90 - black 4.87 A 15270
P-Ru Ru2P Co2P,oP12,62 Pnma 0.5902,0.3859,0.6896,90,90,90 - - 9.86 A 1279
P-S PS rt AsS,mS32,15 C12/c1 0.9779,0.9055,0.8759,90,102.65,90 - - 2.21 X 11504
P-S P 2S3 mon1 P 2S3 ,mP40,14 P121/c1 0.7024,1.2056,1.1489,90,103.4,90 - yellow 2.22 X 31056
P-S P 2S3 mon2 P 2S3 ,mP20,11 P121/m1 0.6627,1.0504,0.6878,90,90.18,90 - yellow 2.19 X 57402
P-S P 2S5 rt P 2S5 ,aP28,2 P-1 0.9007,0.9208,0.9195,92.5,100.72,109.84 - yellow 2.11 X 35288
P-S P 2S7 mon P 2S7 ,mP36,14 P121/c1 0.6526,1.0817,1.258,90,93.24,90 - yellow 2.15 X 55616
P-S P 2S7 tricl P 2S7 ,aP18,2 P-1 0.6032,0.6512,1.1095,82.62,89.2,85.28 - yellow 2.21 X 55616
P-S P 4S3 ht *,hR*,146 R3 2.22688,2.22688,2.76027,90,90,120 - - - N 15757
P-S P 4S3 m As4S3-b,oP28,62 Pnma 1.0921,0.9843,0.6462,90,90,90 - yellow 2.10 X 33876
P-S P 4S3 rt P 4S3 ,oP56,62 Pnma 1.0596,0.9667,1.3670,90,90,90 - yellow 2.09 X 16738
P-S P 4S5 mon1 P 4S5 ,mP18,4 P1211 0.6412,1.0903,0.6694,90,111.66,90 - - 2.17 X 2504
P-S P 4S5 mon2 P 4S5 ,mP18,11 P121/m1 0.6389,1.0966,0.6613,90,115.65,90 - golden 2.26 X 8821
P-S P 4S6.76 orth P 4S7 ,oP44,60 Pbcn 0.814,1.143,1.139,90,90,90 - - 2.14 X 2450
P-S P 4S7 mon P 4S7 ,mP44,14 P121/c1 0.6779,1.744,1.092,90,125.58,90 - - 2.20 X 2504
P-S P 4S9 cub P 4S9 ,cI208,206 Ia-3 1.760,1.760,1.760,90,90,90 - colorless 2.01 X 4367
P-S P 4S9 mon P 4S9 ,mP52,14 P121/c1 0.8555,1.2637,1.31656,90,113.95,90 - - 2.11 X 24201
P-Sc ScP NaCl,cF8,225 Fm-3m 0.5313,0.5313,0.5313,90,90,90 rocksalt family black 3.36 X 2631
P-Sc Sc3P Fe3C-b,oP16,62 Pnma 0.6754,0.84149,0.57662,90,90,90 - - 3.36 A 13941
P-Sc Sc3P 2 orth1 Cr3C2-b,oP20,62 Pnma 0.69781,0.3757,1.43655,90,90,90 - - 3.47 A 12925
P-Sc Sc3P 2 orth2 Th2S3,oP20,62 Pnma 1.01075,0.36944,1.01793,90,90,90 - - 3.44 A 12925
P-Sc Sc7P 3 Th7Fe3,hP20,186 P63mc 0.8934,0.8934,0.57349,90,90,120 - - 3.42 A 13941
P-Se PSe ht PSe,mP32,14 P121/c1 1.1192,0.7282,1.1425,90,115.91,90 - amber 3.49 X 29532
P-Se PSe rt *,oP*,* - 0.7199,0.866,1.2619,90,90,90 - - - N 9428
P-Se P 2Se 5 rt P 2Se5,mP28,14 P121/c1 0.6944,2.0420,0.5836,90,114.15,90 - black 4.02 X 28447
P-Se P 4Se 3 ht1 *,cP*,* - 1.625,1.625,1.625,90,90,90 - - - N 8144
148 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

P-Se P 4Se3 ht2 *,cP*,* - 1.781,1.781,1.781,90,90,90 - - - N 8144


P-Se P 4Se3 rt orth1 P 4Se3,oP112,62 Pnma 1.1797,0.9739,2.6270,90,90,90 - - 3.18 X 1047
P-Se P 4Se3 rt orth2 P 4S3,oP56,62 Pnma 1.0997,0.9845,1.3803,90,90,90 - red 3.21 X 23369
P-Se P 4Se5 rt P 4Se5,oP36,33 Pna21 1.279,0.666,1.119,90,90,90 - red 3.61 X 6052
P-Se P 4.69 Se0.31 P 4.69 Se0.31 ,oP28,62 Pnma 0.9963,0.3231,1.3412,90,90,90 - - 2.61 X 45771
P-Si SiP hp1 *,c**,* - 1.362,1.362,1.362,90,90,90 - brown - N 3231
P-Si SiP hp2 ZnS,cF8,216 F-43m 0.5241,0.5241,0.5241,90,90,90 adamantane structure - 2.73 X 3231
P-Si SiP hp3 *,tP*,* - 0.6536,0.6536,0.76,90,90,90 - - - N 3231
P-Si SiP SiP,oS48,36 Cmc21 0.35118,2.0488,1.3607,90,90,90 - golden 2.40 X 8970
P-Si SiP 2 ht GeAs2,oP24,55 Pbam 1.008,1.397,0.3436,90,90,90 - - 2.47 A 3418
P-Si SiP 2 rt FeS2,cP12,205 Pa-3 0.5706,0.5706,0.5706,90,90,90 pyrite-marcasite family black 3.22 X 17659
P-Si Si6P2.5 Si6P2.5 ,hP11,162 P-31m 0.616,0.616,1.317,90,90,120 - - 0.94 X 33555
P-Sm SmP NaCl,cF8,225 Fm-3m 0.576,0.576,0.576,90,90,90 rocksalt family gray silver 6.30 X 25127
P-Sm SmP 5 NdP 5,mP12,11 P121/m1 0.4936,0.9508,0.5411,90,102.9,90 - black 4.10 X 35313
P-Sn SnP hp cub NaCl,cF8,225 Fm-3m 0.5535,0.5535,0.5535,90,90,90 rocksalt family - 5.86 X 5246
P-Sn SnP hp tet GeP,tI4,107 I4mm 0.3831,0.3831,0.5963,90,90,90 - - 5.68 X 5246
P-Sn SnP 0.94 SnP,hP10,164 P-3m1 0.43922,0.43922,0.6040,90,90,120 - gray dark 4.86 X 23756
P-Sn SnP 3 SnP 3,hR24,166 R-3m 0.73785,0.73785,1.05125,90,90,120 - gray 4.25 X 6846
P-Sn Sn3P 4 Sn3P 4,hR57,166 R-3m 0.4429,0.4429,2.836,90,90,120 - gray 4.96 X 50142
P-Sn Sn4P 3 Sn3.6 As3,hR21,166 R-3m 0.39677,0.39677,3.5331,90,90,120 - - 5.87 X 5037
P-Sr SrP 3 mon1 SrP 3,mS32,12 C12/m1 1.1432,0.7387,0.8561,90,103.45,90 - black 3.41 X 7713
P-Sr SrP 3 mon2 SrAs3,mS16,12 C12/m1 0.9199,0.7288,0.569,90,113.45,90 - black 3.43 X 41942
P-Sr Sr2P2 Na2[O2],hP12,189 P-62m 0.804,0.804,0.6031,90,90,120 - black 3.50 X 7467
P-Sr Sr3P14 Sr3P14,mP34,14 P121/c1 0.6352,1.2759,1.1642,90,123.0,90 - red 2.92 X 6923
P-Sr Sr3P4 Sr3As4,oF56,43 Fdd2 1.43,1.7372,0.5839,90,90,90 - black 3.54 X 17584
P-Sr Sr4P2.67 Th3P 4,cI28,220 I-43d 0.932,0.932,0.932,90,90,90 - brown 3.55 A 5580
P-Ta TaP tet1 NbAs,tI8,109 I41md 0.33184,0.33184,1.1363,90,90,90 - - 11.25 A 17152
P-Ta TaP tet2 *,t**,* - 0.332,0.332,1.138,90,90,90 - - - N 590
P-Ta TaP 2 OsGe2,mS12,12 C12/m1 0.88608,0.32677,0.74882,90,119.308,90 - - 8.53 A 3213
P-Ta Ta2P Ta2P,oP36,58 Pnnm 1.1543,1.4407,0.3396,90,90,90 - - 13.86 X 34912
P-Ta Ta3P ht V3S,tP32,133 P42 /nbc 1.01542,1.01542,0.50137,90,90,90 - - 14.75 A 11169
P-Ta Ta3P rt Ti3P,tP32,86 P42 /n 1.0155,1.0155,0.50128,90,90,90 - - 14.75 X 11169
P-Ta Ta5P 3 Nb5P 3,oP64,62 Pnma 2.5321,0.34013,1.14614,90,90,90 - - 13.43 X 13277
P-Tb TbP rt NaCl,cF8,225 Fm-3m 0.5686,0.5686,0.5686,90,90,90 rocksalt family black 6.86 X 4826
P-Tc TcP 3 TcP 3,oP16,62 Pnma 1.5359,0.3092,0.5142,90,90,90 - black 5.19 X 14949
P-Tc TcP 4 ReP4,oP40,61 Pbca 0.6238,0.9215,1.0837,90,90,90 - - 4.73 X 15370
P-Tc Tc2P 3 Tc2As3,aP20,2 P-1 0.6266,0.6325,0.7683,95.79,101.76,104.34 - - 6.73 X 19289
P-Tc Tc3P Ni3P,tI32,82 I-4 0.9568,0.9568,0.4736,90,90,90 - - 9.96 X 15370
P-Th ThP rt NaCl,cF8,225 Fm-3m 0.5827,0.5827,0.5827,90,90,90 rocksalt family gray 8.83 X 21157
P-Th ThP 2 PbCl2,oP12,62 Pnma 0.695,0.39,0.942,90,90,90 - - 7.65 A 3212
P-Th ThP 7 ThP 7,oP40,19 P212121 0.5671,1.0218,1.0402,90,90,90 - black 4.95 X 19074
P-Th Th2P 11 Th2P 11,mP156,14 P121/c1 1.7384,1.0104,1.9193,90,117.62,90 - black 5.37 X 13357
P-Th Th3P 4 rt Th3P 4,cI28,220 I-43d 0.86,0.86,0.86,90,90,90 - - 8.56 X 172
P-Ti TiP TiP,hP8,194 P63 /mmc 0.3499,0.3499,1.1700,90,90,120 - - 4.22 X 3408
P-Ti TiP 2 PbCl2,oP12,62 Pnma 0.61812,0.33455,0.82578,90,90,90 - - 4.27 X 3870
P-Ti Ti2P Ti2P,hP81,189 P-62m 1.9969,1.9969,0.34589,90,90,120 Fe2P family - 4.76 X 41118
P-Ti Ti3P Ti3P,tP32,86 P42 /n 0.99592,0.99592,0.49869,90,90,90 - - 4.69 X 3403
P-Ti Ti3P 2 *,t*40,* - 0.7483,0.7483,1.0495,90,90,90 - - - N 2594
P-Ti Ti4P 3 Th3P 4,cI28,220 I-43d 0.74298,0.74298,0.74298,90,90,90 - - 4.61 A 3870
P-Ti Ti5P 3 hex Mn5Si3,hP16,193 P63 /mcm 0.7234,0.7234,0.509,90,90,120 - - 4.79 X 2136
P-Ti Ti5P 3 orth Yb5Sb3,oP32,62 Pnma 0.97475,0.74403,0.65056,90,90,90 - - 4.68 X 12926
P-Ti Ti7P 4 Nb7P 4,mS44,12 C12/m1 1.4614,0.3406,1.36196,90,104.65,90 - - 4.65 A 12047
P-Tl TlP 5 TlP 5,oP24,26 Pmc21 0.6465,0.69249,1.2118,90,90,90 - - 4.40 X 5723
P-Tl Tl0.5 P 1.5 ZnS,cF8,216 F-43m 0.59437,0.59437,0.59437,90,90,90 adamantane structure gray 4.70 X 9847
P-Tm TmP NaCl,cF8,225 Fm-3m 0.5573,0.5573,0.5573,90,90,90 rocksalt family - 7.67 X 2059
P-Tm TmP 5 NdP 5,mP12,11 P121/m1 0.4876,0.9327,0.5299,90,102.55,90 - black 4.57 X 35316
P-U UP hp1 NiO,hR6,166 R-3m 0.37899,0.37899,0.94295,90,90,120 - - 11.43 X 21698
P-U UP hp2 *,o**,* - 0.347,0.379,1.075,90,90,90 - - - N 21698
P-U UP NaCl,cF8,225 Fm-3m 0.55844,0.55844,0.55844,90,90,90 rocksalt family gray 10.26 X 21698
P-U UP 0.1 stab Cu,cF4,225 Fm-3m 0.489,0.489,0.489,90,90,90 close-packed structure - 13.70 F 7286
P-U UP 2 ht UAs2,tP6,129 P4/nmm 0.381,0.381,0.7764,90,90,90 - - 8.84 X 3219
P-U UP 2 rt UP 2,tI24,107 I4mm 0.5386,0.5386,1.5563,90,90,90 - - 8.83 X 5778
P-U U3P4 lt *,hR84,* - 1.15908,1.15908,1.42256,90,90,120 - - - N 9958
P-U U3P4 rt Th3P 4,cI28,220 I-43d 0.8214,0.8214,0.8214,90,90,90 - - 10.04 X 7731
P-V VP NiAs,hP4,194 P63 /mmc 0.3177,0.3177,0.6222,90,90,120 AlB2 family - 5.00 X 19375
P-V VP 2 OsGe2,mS12,12 C12/m1 0.84641,0.31054,0.71698,90,119.264,90 - - 4.56 X 8710
P-V VP 4 CrP4,mS20,15 C12/c1 0.5259,1.0997,0.5879,90,110.87,90 - - 3.66 X 17225
P-V V12P 7 V12P 7,hP26,176 P63 /m 0.9299,0.9299,0.3279,90,90,120 - - 5.60 X 5049
P-V V2P Co2P,oP12,62 Pnma 0.62045,0.33052,0.7544,90,90,90 - - 5.70 X 9510
P-V V3P ht Ni3P,tI32,82 I-4 0.94,0.94,0.477,90,90,90 - - 5.79 A 21216
P-V V3P rt Ti3P,tP32,86 P42 /n 0.9387,0.9387,0.4756,90,90,90 - - 5.83 X 6206
P-V V4P 3 Nb4As3,oS56,63 Cmcm 0.3267,1.322,1.726,90,90,90 - - 5.29 A 53401
P-V V8P 13.96 V8P 15,tP29,115 P-4m2 0.63237,0.63237,0.72671,90,90,90 - black 4.80 X 9545
P-W WP FeAs,oP8,62 Pnma 0.5731,0.3248,0.6227,90,90,90 AlB2 family - 12.31 X 9243
P-W WP 2 ht MoP 2,oS12,36 Cmc21 0.31649,1.11599,0.49732,90,90,90 - black 9.29 X 16363
P-W WP 2 rt OsGe2,mS12,12 C12/m1 0.85,0.3168,0.7466,90,119.35,90 - - 9.32 X 16363
P-W WP 4 hp *,tI20,* - 0.5702,0.5702,0.9352,90,90,90 - black - N 16290
P-W W3P V3S,tI32,121 I-42m 0.9858,0.9858,0.48,90,90,90 - - 16.59 A 3213
Handbook of Inorganic Substances – Edition 2015 : Data 149

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

P-Y YP NaCl,cF8,225 Fm-3m 0.5652,0.5652,0.5652,90,90,90 rocksalt family - 4.41 X 25127


P-Y YP 5 NdP 5,mP12,11 P121/m1 0.4911,0.9384,0.5344,90,102.5,90 - black 3.37 X 35311
P-Yb YbP 0.84 NaCl,cF8,225 Fm-3m 0.5545,0.5545,0.5545,90,90,90 rocksalt family - 7.76 X 24333
P-Yb YbP 5 mon1 NdP 5,mP12,11 P121/m1 0.4873,0.9308,0.5287,90,102.57,90 - black 4.65 X 35315
P-Yb YbP 5 mon2 YbP 5,mP24,4 P1211 0.5249,1.6877,0.5317,90,102.53,90 - black 4.74 X 35315
P-Zn ZnP 2 hp *,oP342,18 P21212 2.069,2.17,1.485,90,90,90 - - - N 22202
P-Zn ZnP 2 ht ZnP 2,tP24,92 P41212 0.50661,0.50661,1.8532,90,90,90 - red 3.56 X 42036
P-Zn ZnP 2 rt ZnAs2,mP24,14 P121/c1 0.88632,0.72883,0.756,90,102.31,90 - black 3.55 X 42036
P-Zn ZnP 4 hp MgAs4,tP20,92 P41212 0.50154,0.50154,1.45398,90,90,90 - - 3.44 X 22376
P-Zn Zn3P 2 ht (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.142,1.142,1.142,90,90,90 - - 4.60 A 69
P-Zn Zn3P 2 rt Zn3P 2,tP40,137 P42/nmc 0.80785,0.80785,1.13966,90,90,90 fluorite family gray iron 4.61 X 43569
P-Zn Zn7P 10 hp Cd7P 10,oF136,43 Fdd2 2.1608,2.5236,0.4425,90,90,90 - - 4.23 A 16017
P-Zr ZrP rt TiP,hP8,194 P63/mmc 0.3684,0.3684,1.2554,90,90,120 - - 5.50 X 1945
P-Zr ZrP 0.9 ht NaCl,cF8,225 Fm-3m 0.5268,0.5268,0.5268,90,90,90 rocksalt family - 5.41 X 59415
P-Zr ZrP 2 PbCl2,oP12,62 Pnma 0.6505,0.35169,0.8757,90,90,90 - black 5.08 X 29624
P-Zr Zr14P 9 Zr14P 9,oP92,58 Pnnm 1.6715,2.7572,0.36742,90,90,90 - - 6.10 X 13944
P-Zr Zr2P Zr2P,oS108,65 Cmmm 1.90634,2.95099,0.36076,90,90,90 - - 6.29 X 23056
P-Zr Zr3P Ti3P,tP32,86 P42/n 1.07994,1.07994,0.53553,90,90,90 - - 6.48 X 23547
P-Zr Zr4P3 hp *,hP*,* - 0.3706,0.3706,0.9111,90,90,120 - - - N 15159
P-Zr Zr7P4 Nb7P 4,mS44,12 C12/m1 1.5814,0.36053,1.4738,90,104.843,90 - - 6.24 X 23060
Pa-Pt PaPt3 Mg3 Cd,hP8,194 P63/mmc 0.5704,0.5704,0.4957,90,90,120 close-packed structure - 19.41 A 9952
Pa-Pt PaPt5 Be5Au,cF24,216 F-43m 0.7413,0.7413,0.7413,90,90,90 Friauf-Laves phase - 19.67 A 9952
Pa-Rh PaRh3 Cu3Au,cP4,221 Pm-3m 0.4037,0.4037,0.4037,90,90,90 close-packed structure - 13.62 X 9952
Pa-Th Th0.93Pa0.07 rt Cu,cF4,225 Fm-3m 0.5048,0.5048,0.5048,90,90,90 close-packed structure - 11.98 X 5386
Pb-Pd PdPb rt PdPb,aP32,2 P-1 0.5552,0.5571,2.1464,95.85,95.91,99.98 - - 12.91 X 13332
Pb-Pd PdPb2 CuAl2,tI12,140 I4/mcm 0.6865,0.6865,0.5844,90,90,90 - - 12.56 X 6743
Pb-Pd Pd0.88Pb0.12 Cu,cF4,225 Fm-3m 0.3955,0.3955,0.3955,90,90,90 close-packed structure - 12.72 X 14267
Pb-Pd Pd1.44Pb ht Co1.75 Ge,hP6,194 P63/mmc 0.4493,0.4493,0.5762,90,90,120 AlB2 family - 11.88 X 13323
Pb-Pd Pd1.67Pb ht Co1.75 Ge,hP6,194 P63/mmc 0.4434,0.4434,0.5739,90,90,120 AlB2 family - 13.08 X 31735
Pb-Pd Pd13Pb9 rt Pd13Pb9,mS88,15 C12/c1 1.56027,0.90599,1.3908,90,124.106,90 AlB2 family - 13.25 X 13323
Pb-Pd Pd3Pb Cu3Au,cP4,221 Pm-3m 0.4035,0.4035,0.4035,90,90,90 close-packed structure - 13.31 X 14267
Pb-Pd Pd5Pb3 rt Ni5Ge3,mS32,5 C121 1.2303,0.7667,0.7258,90,121.075,90 - - 13.07 A 7831
Pb-Po PbPo NaCl,cF8,225 Fm-3m 0.659,0.659,0.659,90,90,90 rocksalt family - 9.66 X 1261
Pb-Pr PrPb2 tet1 CuZr2,tI6,139 I4/mmm 0.3305,0.3305,1.606,90,90,90 close-packed structure - 10.51 A 34407
Pb-Pr PrPb2 tet2 HfGa2,tI24,141 I41/amd 0.466,0.466,3.2,90,90,90 close-packed structure - 10.62 A 9906
Pb-Pr PrPb3 Cu3Au,cP4,221 Pm-3m 0.4867,0.4867,0.4867,90,90,90 close-packed structure - 10.98 X 7425
Pb-Pr Pr11Pb10 Ho11 Ge10,tI84,139 I4/mmm 1.187,1.187,1.73,90,90,90 - - 9.87 A 9906
Pb-Pr Pr3Pb Cu3Au,cP4,221 Pm-3m 0.4949,0.4949,0.4949,90,90,90 close-packed structure - 8.63 X 6195
Pb-Pr Pr5Pb3 Mn5 Si3,hP16,193 P63/mcm 0.9337,0.9337,0.6814,90,90,120 - - 8.56 X 2882
Pb-Pr Pr5Pb4 Sm5 Ge4,oP36,62 Pnma 0.8377,1.604,0.8532,90,90,90 - - 8.88 A 9906
Pb-Pt PtPb NiAs,hP4,194 P63/mmc 0.424,0.424,0.548,90,90,120 AlB2 family - 15.66 X 50357
Pb-Pt PtPb2 hp CuAl2,tI12,140 I4/mcm 0.6934,0.6934,0.5764,90,90,90 - - 14.61 X 24750
Pb-Pt PtPb4 PtPb4,tP10,125 P4/nbm 0.6667,0.6667,0.5978,90,90,90 - yellow 12.80 X 407
Pb-Pt Pt0.97 Pb0.03 Cu,cF4,225 Fm-3m 0.3926,0.3926,0.3926,90,90,90 close-packed structure - 21.45 X 14267
Pb-Pt Pt3Pb Cu3Au,cP4,221 Pm-3m 0.4058,0.4058,0.4058,90,90,90 close-packed structure - 19.69 X 14267
Pb-Pt Pt6Pb *,cF*,* - 0.405,0.405,0.405,90,90,90 - - - N 572
Pb-Pu PuPb2 rt HfGa2,tI24,141 I41/amd 0.4621,0.4621,3.129,90,90,90 close-packed structure - 13.09 A 4761
Pb-Pu PuPb3 Cu3Au,cP4,221 Pm-3m 0.48071,0.48071,0.48071,90,90,90 close-packed structure - 12.94 X 4761
Pb-Pu Pu3Pb Cu3Au,cP4,221 Pm-3m 0.4737,0.4737,0.4737,90,90,90 close-packed structure - 14.67 X 4761
Pb-Pu Pu4Pb5 *,hP*,182 P6322 1.652,1.652,0.644,90,90,120 - - - N 4761
Pb-Pu Pu5Pb3 W5Si3,tI32,140 I4/mcm 1.231,1.231,0.6084,90,90,90 - - 13.27 A 4761
Pb-Pu Pu5Pb4 Ti5Ga4,hP18,193 P63/mcm 0.9523,0.9523,0.6482,90,90,120 AlB2 family - 13.37 A 4761
Pb-Rb RbPb NaPb,tI64,142 I41/acd 1.1892,1.1892,1.9429,90,90,90 - gray silver 5.66 X 36762
Pb-Rb Rb4Pb9 K4Pb9,mP52,11 P121/m1 0.9888,1.3393,1.6224,90,102.987,90 - black 7.00 X 40677
Pb-Rh RhPb CoSn,hP6,191 P6/mmm 0.5678,0.5678,0.4428,90,90,120 AlB2 family - 12.50 X 7070
Pb-Rh RhPb2 CuAl2,tI12,140 I4/mcm 0.6674,0.6674,0.5831,90,90,90 - - 13.23 X 6743
Pb-Rh Rh1.5 Pb Co1.75 Ge,hP6,194 P63/mmc 0.433,0.433,0.5639,90,90,120 AlB2 family - 13.11 X 7070
Pb-Rh Rh3Pb stab Cu3Au,cP4,221 Pm-3m 0.402,0.402,0.402,90,90,90 close-packed structure - 13.19 X 7070
Pb-Rh Rh4Pb5 Rh4Pb5,oF72,69 Fmmm 0.5711,0.9840,2.6510,90,90,90 - - 12.91 X 7501
Pb-S PbS hp1 TlI,oS8,63 Cmcm 0.4008,1.1246,0.4154,90,90,90 CrB(TlI)-FeB - 8.49 X 54677
Pb-S PbS hp2 CsCl,cP2,221 Pm-3m 0.3289,0.3289,0.3289,90,90,90 b.c.c. family - 11.17 X 19438
Pb-S PbS tf BiF3 ,cF16,225 Fm-3m 0.59395,0.59395,0.59395,90,90,90 b.c.c. family - 7.58 X 59307
Pb-S PbS NaCl,cF8,225 Fm-3m 0.5934,0.5934,0.5934,90,90,90 galena black 7.61 X 15945
Pb-S PbS2 tet SrS2 ,tI12,140 I4/mcm 0.61,0.61,0.748,90,90,90 - - 6.48 A 3075
Pb-S PbS2 trig CdI2 ,hP3,164 P-3m1 0.389,0.389,0.591,90,90,120 CdI2-PbI2 polytype - 5.82 A 3075
Pb-Sb PbSb m NaCl,cF8,225 Fm-3m 0.6226,0.6226,0.6226,90,90,90 rocksalt family - 9.05 X 4110
Pb-Sb Pb0.11 Sb0.89 As,hR6,166 R-3m 0.4284,0.4284,1.138,90,90,120 - - 7.22 A 4110
Pb-Sb Pb0.65 Sb0.35 hp W,cI2,229 Im-3m 0.3892,0.3892,0.3892,90,90,90 b.c.c. family - 9.99 X 4110
Pb-Sb Pb0.8 Sb0.2 hp Mg,hP2,194 P63/mmc 0.3461,0.3461,0.5714,90,90,120 close-packed structure - 10.65 X 11914
Pb-Sb Pb0.96 Sb0.04 Cu,cF4,225 Fm-3m 0.4947,0.4947,0.4947,90,90,90 close-packed structure - 11.18 X 44868
Pb-Sc Sc5Pb3 Mn5 Si3,hP16,193 P63/mcm 0.8473,0.8473,0.6162,90,90,120 - - 7.34 A 30197
Pb-Sc Sc6Pb5 V6Si5,oI44,72 Ibam 0.8889,1.9274,0.6177,90,90,90 - - 8.20 X 29776
Pb-Se PbSe hp1 GeS,oP8,62 Pnma 1.161,0.4,0.439,90,90,90 - - 9.32 A 3431
Pb-Se PbSe hp2 CsCl,cP2,221 Pm-3m 0.3379,0.3379,0.3379,90,90,90 b.c.c. family - 12.32 X 19438
Pb-Se PbSe NaCl,cF8,225 Fm-3m 0.61213,0.61213,0.61213,90,90,90 clausthalite black 8.29 X 19830
Pb-Se PbSe 2 SrS2 ,tI12,140 I4/mcm 0.64269,0.64269,0.77025,90,90,90 - gray 7.62 X 57337
Pb-Sm SmPb3 Cu3Au,cP4,221 Pm-3m 0.4835,0.4835,0.4835,90,90,90 close-packed structure - 11.34 X 7781
Pb-Sm Sm5 Pb3 Mn5 Si3,hP16,193 P63/mcm 0.9163,0.9163,0.6687,90,90,120 - - 9.38 X 2882
150 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Pb-Sm Sm5Pb4 Sm5Ge4,oP36,62 Pnma 0.8244,1.578,0.8363,90,90,90 - - 9.65 A 4345


Pb-Sn Pb0.015 Sn0.985 rt Sn,tI4,141 I41/amd 0.5839,0.5839,0.3184,90,90,90 - - 7.34 X 636
Pb-Sn Pb0.26 Sn0.74 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.322,0.322,0.3027,90,90,120 - - 8.66 X 2985
Pb-Sn Pb0.3 Sn0.7 m Sn,tI4,141 I41/amd 0.61325,0.61325,0.35204,90,90,90 - - 7.29 X 8157
Pb-Sn Pb0.951 Sn0.049 Cu,cF4,225 Fm-3m 0.49425,0.49425,0.49425,90,90,90 close-packed structure - 11.16 X 567
Pb-Sr SrPb TlI,oS8,63 Cmcm 0.5018,1.223,0.4648,90,90,90 CrB(TlI)-FeB - 6.87 X 3597
Pb-Sr SrPb3 SrPb3,tP4,123 P4/mmm 0.4966,0.4966,0.5025,90,90,90 close-packed structure - 9.50 X 7542
Pb-Sr Sr2Pb Co2Si-b,oP12,62 Pnma 0.8445,0.5391,1.0139,90,90,90 - - 5.50 X 11596
Pb-Sr Sr2Pb3 Sr2Pb3,tP10,127 P4/mbm 0.8367,0.8367,0.4883,90,90,90 - - 7.74 X 17483
Pb-Sr Sr31Pb20 Pu31Pt20,tI204,140 I4/mcm 1.32839,1.32839,4.2704,90,90,90 - - 6.05 A 27308
Pb-Sr Sr5Pb3 Cr5B3,tI32,140 I4/mcm 0.867,0.867,1.594,90,90,90 - - 5.87 A 11624
Pb-Sr Sr5Pb4 Sm5Ge4,oP36,62 Pnma 0.848,1.727,0.901,90,90,90 - - 6.38 A 14284
Pb-Sr Sr7.02 Pb11.76 Sr7Pb11.67 ,tP42,127 P4/mbm 1.617,1.617,0.4886,90,90,90 - - 7.93 X 17483
Pb-Tb TbPb3 Cu3Au,cP4,221 Pm-3m 0.481,0.481,0.481,90,90,90 close-packed structure - 11.65 X 2175
Pb-Tb Tb5Pb3 Mn5Si3,hP16,193 P63 /mcm 0.9019,0.9019,0.6596,90,90,120 - - 10.12 X 2882
Pb-Tb Tb5Pb4 Sm5Ge4,oP36,62 Pnma 0.8169,1.555,0.8218,90,90,90 - - 10.33 A 4345
Pb-Te PbTe hp1 FeB-b,oP8,62 Pnma 0.8157,0.4492,0.6294,90,90,90 CrB(TlI)-FeB - 9.64 X 45471
Pb-Te PbTe hp2 CsCl,cP2,221 Pm-3m 0.357,0.357,0.357,90,90,90 b.c.c. family - 12.22 X 19438
Pb-Te PbTe NaCl,cF8,225 Fm-3m 0.6462,0.6462,0.6462,90,90,90 altaite black 8.24 X 15945
Pb-Te Pb0.5 Te0.5 ht Po,cP1,221 Pm-3m 0.323,0.323,0.323,90,90,90 - - 8.25 X 8562
Pb-Th ThPb UPb,tI8,141 I41/amd 0.4545,0.4545,1.1288,90,90,90 close-packed structure black gray 12.51 X 1395
Pb-Th ThPb2 *,o**,* - 0.4525,0.4561,1.707,90,90,90 - - - N 16166
Pb-Th ThPb3 Cu3Au,cP4,221 Pm-3m 0.4859,0.4859,0.4859,90,90,90 close-packed structure black gray 12.36 X 16166
Pb-Th Th5Pb3 Mn5Si3,hP16,193 P63 /mcm 0.9411,0.9411,0.6521,90,90,120 - - 11.83 A 16166
Pb-Th Th5Pb4 Ti5Ga4,hP18,193 P63 /mcm 0.9741,0.9741,0.6585,90,90,120 AlB2 family - 12.21 A 16166
Pb-Ti Ti3.2 Pb0.8 Mg3Cd,hP8,194 P63 /mmc 0.5985,0.5985,0.4846,90,90,120 close-packed structure - 7.05 X 392
Pb-Ti Ti6Pb4.8 Ti6Sn5,hP22,194 P63 /mmc 0.93923,0.93923,0.57901,90,90,120 AlB2 family - 9.63 X 39139
Pb-Tl Tl0.4 Pb0.6 Cu,cF4,225 Fm-3m 0.49194,0.49194,0.49194,90,90,90 close-packed structure - 11.50 X 3680
Pb-Tm TmPb3 Cu3Au,cP4,221 Pm-3m 0.4799,0.4799,0.4799,90,90,90 close-packed structure - 11.88 X 7486
Pb-Tm Tm5Pb3 Mn5Si3,hP16,193 P63 /mcm 0.88214,0.88214,0.64787,90,90,120 - - 11.15 X 54571
Pb-Tm Tm5Pb4 Sm5Ge4,oP36,62 Pnma 0.8049,1.526,0.809,90,90,90 - - 11.19 A 4345
Pb-U UPb UPb,tI8,141 I41/amd 0.4579,0.4579,1.0518,90,90,90 close-packed structure black gray 13.41 X 1395
Pb-U UPb3 Cu3Au,cP4,221 Pm-3m 0.4791,0.4791,0.4791,90,90,90 close-packed structure black gray 12.98 X 18008
Pb-V V3Pb hp *,t**,* - 0.6175,0.6175,0.9344,90,90,90 - - - N 8278
Pb-V V3Pb Cr3Si,cP8,223 Pm-3n 0.4937,0.4937,0.4937,90,90,90 Frank-Kasper phase - 9.94 X 51451
Pb-Y YPb2 ZrSi2,oS12,63 Cmcm 0.455,1.646,0.445,90,90,90 close-packed structure - 10.03 X 3437
Pb-Y YPb3 Cu3Au,cP4,221 Pm-3m 0.4814,0.4814,0.4814,90,90,90 close-packed structure - 10.58 X 2175
Pb-Y Y5Pb3 Mn5Si3,hP16,193 P63 /mcm 0.8971,0.8971,0.6614,90,90,120 - - 7.68 A 3437
Pb-Y Y5Pb4 Gd5Si4,oP36,62 Pnma 0.7994,1.51,0.8241,90,90,90 - - 8.50 X 3437
Pb-Yb YbPb rt CuAu,tP2,123 P4/mmm 0.3596,0.3596,0.445,90,90,90 close-packed structure - 10.97 X 27457
Pb-Yb YbPb3 Cu3Au,cP4,221 Pm-3m 0.4865,0.4865,0.4865,90,90,90 close-packed structure - 11.46 X 27457
Pb-Yb Yb0.5 Pb0.5 ht W,cI2,229 Im-3m 0.3931,0.3931,0.3931,90,90,90 b.c.c. family - 10.39 X 27457
Pb-Yb Yb2Pb Co2Si-b,oP12,62 Pnma 0.7478,0.5225,0.9549,90,90,90 - - 9.85 X 3752
Pb-Yb Yb31Pb20 Pu31Pt20,tI204,140 I4/mcm 1.2527,1.2527,4.0453,90,90,90 - - 9.95 A 27308
Pb-Yb Yb5Pb3 Mn5Si3,hP16,193 P63 /mcm 0.9325,0.9325,0.6929,90,90,120 - - 9.46 X 3752
Pb-Zr Zr3.33Pb0.67 Cr3Si,cP8,223 Pm-3n 0.56619,0.56619,0.56619,90,90,90 Frank-Kasper phase - 8.10 X 27376
Pb-Zr Zr5Pb3 Mn5Si3,hP16,193 P63 /mcm 0.8529,0.8529,0.5864,90,90,120 - - 9.69 X 525
Pb-Zr Zr5Pb3.87 Ti5Ga4,hP18,193 P63 /mcm 0.8828,0.8828,0.5991,90,90,120 AlB2 family - 10.33 X 27376
Pd-Pr PrPd ht TlI,oS8,63 Cmcm 0.388,1.089,0.4571,90,90,90 CrB(TlI)-FeB - 8.51 A 26124
Pd-Pr PrPd3 Cu3Au,cP4,221 Pm-3m 0.4146,0.4146,0.4146,90,90,90 close-packed structure - 10.72 X 26124
Pd-Pr PrPd5 *,oP72,* - 0.5278,0.9239,2.575,90,90,90 - - - N 49545
Pd-Pr Pr0.08 Pd0.92 Cu,cF4,225 Fm-3m 0.3939,0.3939,0.3939,90,90,90 close-packed structure - 11.86 X 26124
Pd-Pr Pr3Pd4 Pu3Pd4,hR42,148 R-3 1.3595,1.3595,0.5804,90,90,120 b.c.c. family - 9.10 A 8276
Pd-Pr Pr7Pd3 Th7Fe3,hP20,186 P63 mc 1.0176,1.0176,0.6415,90,90,120 - - 7.54 A 7492
Pd-Pt Pt0.2Pd0.8 Cu,cF4,225 Fm-3m 0.3912,0.3912,0.3912,90,90,90 close-packed structure - 13.77 X 56801
Pd-Pu PuPd ht FeB-b,oP8,62 Pnma 0.7036,0.455,0.5663,90,90,90 CrB(TlI)-FeB - 12.84 X 8756
Pd-Pu PuPd3 Cu3Au,cP4,221 Pm-3m 0.4102,0.4102,0.4102,90,90,90 close-packed structure - 13.55 X 55293
Pd-Pu Pu0.064Pd0.936 Cu,cF4,225 Fm-3m 0.3995,0.3995,0.3995,90,90,90 close-packed structure - 12.00 X 3306
Pd-Pu Pu3Pd4 Pu3Pd4,hR42,148 R-3 1.3344,1.3344,0.5744,90,90,120 b.c.c. family - 13.02 X 7185
Pd-Pu Pu3Pd5 Pu3Pd5,oS32,63 Cmcm 0.9201,0.7159,0.9771,90,90,90 - - 13.05 X 9572
Pd-Re Re0.12Pd0.88 Cu,cF4,225 Fm-3m 0.363,0.363,0.363,90,90,90 close-packed structure - 16.11 X 1741
Pd-Rh Rh0.41Pd0.59 Cu,cF4,225 Fm-3m 0.3856,0.3856,0.3856,90,90,90 close-packed structure - 12.16 X 59019
Pd-Ru Ru0.1 Pd0.9 Cu,cF4,225 Fm-3m 0.3873,0.3873,0.3873,90,90,90 close-packed structure - 12.10 X 1139
Pd-Ru Ru0.75Pd0.25 Mg,hP2,194 P63 /mmc 0.2718,0.2718,0.4338,90,90,120 close-packed structure - 12.25 X 56963
Pd-S PdS PdS,tP16,84 P42 /m 0.6429,0.6429,0.6611,90,90,90 - black 6.73 X 17799
Pd-S PdS2 PdSe2,oP12,61 Pbca 0.546,0.5541,0.7531,90,90,90 pyrite-marcasite family - 4.97 X 837
Pd-S Pd16S7 rt Pd16S7,cI46,217 I-43m 0.8954,0.8954,0.8954,90,90,90 - - 8.91 X 9511
Pd-S Pd3S ht Pd3S,oS16,40 Ama2 0.6088,0.5374,0.7453,90,90,90 - - 9.57 X 3885
Pd-S Pd4S Pd4Se,tP10,114 P-42 1c 0.51147,0.51147,0.55903,90,90,90 - - 10.39 X 1572
Pd-Sb PdSb NiAs,hP4,194 P63 /mmc 0.40753,0.40753,0.5591,90,90,120 sudburyite yellow 9.42 X 24540
Pd-Sb PdSb2 FeS2,cP12,205 Pa-3 0.6464,0.6464,0.6464,90,90,90 pyrite-marcasite family - 8.61 X 29567
Pd-Sb PdSb3 *,hR96,* - 0.759,0.759,4.326,90,90,120 - - - N 4255
Pd-Sb Pd0.165 Sb0.835 m Po,cP1,221 Pm-3m 0.2995,0.2995,0.2995,90,90,90 - - 7.37 X 4280
Pd-Sb Pd0.91 Sb0.09 Cu,cF4,225 Fm-3m 0.39188,0.39188,0.39188,90,90,90 close-packed structure - 11.90 X 48616
Pd-Sb Pd1.5 Sb0.5 ht NaTl,cF16,227 Fd-3m 0.63905,0.63905,0.63905,90,90,90 b.c.c. family - 11.22 X 12000
Pd-Sb Pd2Sb rt Pd2As,oS24,36 Cmc21 0.3366,1.7523,0.6929,90,90,90 naldrettite white 10.87 A 32203
Pd-Sb Pd20Sb7 rt Pd20Sb7,hR81,148 R-3 1.1734,1.1734,1.1021,90,90,120 - white 11.30 X 10732
Pd-Sb Pd3Sb5 ht *,h**,* - 0.759,0.759,1.386,90,90,120 - - - N 4255
Handbook of Inorganic Substances – Edition 2015 : Data 151

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Pd-Sb Pd31 Sb12 *,h*129,* - 0.76006,0.76006,4.1945,90,90,120 - white 11.30 N 32203


Pd-Sb Pd5Sb2 sti *,hP84,194 P63/mmc 0.7598,0.7598,2.8112,90,90,120 stibiopalladinite white - N 9688
Pd-Sb Pd5Sb2 syn Pd5Sb2,hP42,185 P63cm 0.7606,0.7606,1.3863,90,90,120 - white 11.12 X 5334
Pd-Sb Pd5Sb3 ht1 *,h**,* - 0.445,0.445,0.583,90,90,120 - - - N 531
Pd-Sb Pd5Sb3 ht2 *,oP*,* - 0.3362,0.6934,1.7484,90,90,90 - pink - N 32203
Pd-Sb Pd8Sb3 rt Yb8In3,hR132,167 R-3c 0.76152,0.76152,4.3032,90,90,120 - yellow 11.22 X 28381
Pd-Sc ScPd CsCl,cP2,221 Pm-3m 0.328,0.328,0.328,90,90,90 b.c.c. family - 7.12 X 13681
Pd-Sc ScPd3 Cu3Au,cP4,221 Pm-3m 0.39579,0.39579,0.39579,90,90,90 close-packed structure - 9.75 X 4704
Pd-Sc Sc0.1Pd0.9 Cu,cF4,225 Fm-3m 0.3916,0.3916,0.3916,90,90,90 close-packed structure - 11.09 X 27393
Pd-Sc Sc2Pd Ti2Ni,cF96,227 Fd-3m 1.2442,1.2442,1.2442,90,90,90 - - 5.42 A 2764
Pd-Se PdSe rt Pd(Se0.5 S0.5),tP48,135 P42/mbc 1.15646,1.15646,0.69978,90,90,90 - black 7.89 X 39639
Pd-Se PdSe 2 hp1-ht FeS2 ,oP6,58 Pnnm 0.4873,0.6013,0.393,90,90,90 pyrite-marcasite family - 7.62 A 11550
Pd-Se PdSe 2 hp2-ht FeS2 ,cP12,205 Pa-3 0.5928,0.5928,0.5928,90,90,90 pyrite-marcasite family - 8.43 A 42955
Pd-Se PdSe 2 PdSe 2,oP12,61 Pbca 0.57457,0.58679,0.76946,90,90,90 pyrite-marcasite family - 6.77 X 42955
Pd-Se Pd17 Se15 Pd17 Se15,cP64,221 Pm-3m 1.0606,1.0606,1.0606,90,90,90 palladseite - 8.33 X 1611
Pd-Se Pd34 Se11 Pd34 Se11,mP90,14 P121/c1 1.2030,0.5504,2.2776,90,111.96,90 - - 10.65 X 22046
Pd-Se Pd4Se rt Pd4Se,tP10,114 P-421c 0.52324,0.52324,0.56470,90,90,90 - - 10.84 X 1572
Pd-Se Pd7Se2 Pd7Se2,mP18,14 P121/c1 0.5495,0.5370,0.9441,90,93.61,90 - - 10.78 X 22046
Pd-Se Pd7Se4 Pd7Se4,oP22,18 P21212 0.6863,1.0162,0.5375,90,90,90 - - 9.40 X 11616
Pd-Si PdSi ht FeAs,oP8,62 Pnma 0.56173,0.33909,0.61534,90,90,90 AlB2 family - 7.62 X 5040
Pd-Si Pd0.975 Si0.025 Cu,cF4,225 Fm-3m 0.3894,0.3894,0.3894,90,90,90 close-packed structure - 11.75 X 12765
Pd-Si Pd2Si Fe2P,hP9,189 P-62m 0.6496,0.6496,0.3433,90,90,120 Fe2P family - 9.57 X 2972
Pd-Si Pd3Si Fe3C-b,oP16,62 Pnma 0.5735,0.7555,0.526,90,90,90 - - 10.12 X 1206
Pd-Si Pd3Si0.6 ht Pd3P 0.68 ,mP24,4 P1211 0.5555,0.7485,0.8465,90,100.7,90 - - 9.68 A 14502
Pd-Si Pd4Si cub *,c**,* - 0.4,0.4,0.4,90,90,90 - - - N 33114
Pd-Si Pd4Si tf *,aP20,2 P-1 0.4402,0.77,0.899,68.98,83.48,89.15 - - - N 12412
Pd-Si Pd9Si2 ht Pd9Si2,oP44,62 Pnma 0.90528,0.74165,0.94009,90,90,90 - - 10.67 X 21110
Pd-Sm SmPd rt TlI,oS8,63 Cmcm 0.377,1.065,0.456,90,90,90 CrB(TlI)-FeB - 9.32 A 7474
Pd-Sm SmPd3 Cu3Au,cP4,221 Pm-3m 0.4109,0.4109,0.4109,90,90,90 close-packed structure - 11.24 X 34488
Pd-Sm SmPd5 *,oP*,* - 0.5253,0.9015,2.568,90,90,90 - - - N 21053
Pd-Sm Sm0.1Pd0.9 Cu,cF4,225 Fm-3m 0.3972,0.3972,0.3972,90,90,90 close-packed structure - 11.74 X 7474
Pd-Sm Sm10 Pd21 Sm10 Pd21,mS124,12 C12/m1 2.4853,0.5765,1.6509,90,90.88,90 - - 10.50 X 12127
Pd-Sm Sm3 Pd4 Pu3Pd4,hR42,148 R-3 1.3387,1.3387,0.5758,90,90,120 b.c.c. family - 9.78 A 8276
Pd-Sm Sm7 Pd3 Th7Fe3,hP20,186 P63mc 1.0014,1.0014,0.6301,90,90,120 - - 8.33 A 7492
Pd-Sn PdSn FeAs,oP8,62 Pnma 0.61388,0.38923,0.63377,90,90,90 AlB2 family - 9.87 X 47298
Pd-Sn PdSn2 rt PdSn2,tI48,142 I41/acd 0.649,0.649,2.4327,90,90,90 - gray silver 8.91 X 37396
Pd-Sn PdSn3 PdSn3,oS32,64 Cmce 1.7147,0.6458,0.6488,90,90,90 - - 8.55 X 43858
Pd-Sn PdSn4 PtSn4,oS20,68 Ccce 0.6442,1.1445,0.6389,90,90,90 - - 8.20 X 43858
Pd-Sn Pd0.08 Sn0.92 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3215,0.3215,0.2979,90,90,120 - - 7.33 X 2985
Pd-Sn Pd0.83 Sn0.17 Cu,cF4,225 Fm-3m 0.3943,0.3943,0.3943,90,90,90 close-packed structure - 11.76 X 4102
Pd-Sn Pd0.88 Sn2 ht PdSn2,oS24,41 Aea2 0.6478,0.6478,1.2155,90,90,90 - - 8.62 X 360
Pd-Sn Pd1.5 Sn ht Pd+ Co1.75 Ge,hP6,194 P63/mmc 0.4389,0.4389,0.5703,90,90,120 AlB2 family - 9.71 X 258
Pd-Sn Pd1.5 Sn0.5 ht CuAu,tP2,123 P4/mmm 0.288,0.288,0.3723,90,90,90 close-packed structure - 11.77 X 892
Pd-Sn Pd13 Sn9 Pd13 Sn9,hP66,152 P3121 0.87985,0.87985,1.69837,90,90,120 - - 10.73 X 14778
Pd-Sn Pd2Sn Co2Si-b,oP12,62 Pnma 0.5647,0.4294,0.8103,90,90,90 paolovite - 11.21 X 49204
Pd-Sn Pd3Sn Cu3Au,cP4,221 Pm-3m 0.3975,0.3975,0.3975,90,90,90 close-packed structure - 11.58 X 3584
Pd-Sn Pd5Sn7 Pd5Sn7,mS26,12 C12/m1 1.29475,0.43764,0.95659,90,111.576,90 - gray silver 8.98 X 54557
Pd-Sr SrPd TlI,oS8,63 Cmcm 0.419,1.131,0.452,90,90,90 CrB(TlI)-FeB - 6.02 A 8298
Pd-Sr SrPd2 MgCu2,cF24,227 Fd-3m 0.7826,0.7826,0.7826,90,90,90 Friauf-Laves phase - 8.33 X 938
Pd-Sr SrPd5 CaCu5,hP6,191 P6/mmm 0.5383,0.5383,0.4392,90,90,120 - - 9.34 X 6163
Pd-Ta TaPd rt CuTi,tP4,129 P4/nmm 0.3279,0.3279,0.6036,90,90,90 b.c.c. family - 14.71 A 2017
Pd-Ta TaPd2 MoPt2,oI6,71 Immm 0.2896,0.379,0.8397,90,90,90 close-packed structure - 14.19 X 2667
Pd-Ta TaPd3 TiAl3,tI8,139 I4/mmm 0.388,0.388,0.7978,90,90,90 close-packed structure - 13.83 X 2017
Pd-Ta Ta0.09Pd0.91 Cu,cF4,225 Fm-3m 0.38995,0.38995,0.38995,90,90,90 close-packed structure - 12.67 X 44058
Pd-Ta Ta0.75Pd0.25 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9978,0.9978,0.5208,90,90,90 Frank-Kasper phase - 15.59 A 2017
Pd-Ta Ta0.88Pd0.12 W,cI2,229 Im-3m 0.3285,0.3285,0.3285,90,90,90 b.c.c. family - 16.11 X 11779
Pd-Tb TbPd ht FeB-b,oP8,62 Pnma 0.7192,0.4344,0.5599,90,90,90 CrB(TlI)-FeB - 10.08 A 8406
Pd-Tb TbPd rt TlI,oS8,63 Cmcm 0.3722,1.0523,0.4554,90,90,90 CrB(TlI)-FeB - 9.88 A 9389
Pd-Tb TbPd3 Cu3Au,cP4,221 Pm-3m 0.4068,0.4068,0.4068,90,90,90 close-packed structure - 11.79 X 25721
Pd-Tb Tb0.08Pd0.92 Cu,cF4,225 Fm-3m 0.3952,0.3952,0.3952,90,90,90 close-packed structure - 11.90 X 27393
Pd-Tb Tb2.12Pd0.88 Dy2.12Pd0.88 ,cF144,227 Fd-3m 1.3597,1.3597,1.3597,90,90,90 - - 9.10 X 59663
Pd-Tb Tb3Pd4 Pu3Pd4,hR42,148 R-3 1.3178,1.3178,0.5708,90,90,120 b.c.c. family - 10.47 A 8276
Pd-Tc Tc0.25Pd0.75 Cu,cF4,225 Fm-3m 0.3874,0.3874,0.3874,90,90,90 close-packed structure - 11.92 X 1861
Pd-Tc Tc0.53Pd0.47 Mg,hP2,194 P63/mmc 0.2749,0.2749,0.4389,90,90,120 close-packed structure - 11.79 X 1861
Pd-Te PdTe NiAs,hP4,194 P63/mmc 0.413,0.413,0.5661,90,90,120 kotulskite - 9.29 X 23574
Pd-Te PdTe 2 CdI2 ,hP3,164 P-3m1 0.4024,0.4024,0.5113,90,90,120 merenskyite black 8.37 X 31322
Pd-Te Pd0.75 Te0.25 ht W,cI2,229 Im-3m 0.3226,0.3226,0.3226,90,90,90 b.c.c. family - 11.05 X 12000
Pd-Te Pd0.9 Te0.1 Cu,cF4,225 Fm-3m 0.3937,0.3937,0.3937,90,90,90 close-packed structure - 11.81 X 18750
Pd-Te Pd13 Te3 rt Li13In3,cF128,227 Fd-3m 1.26681,1.26681,1.26681,90,90,90 b.c.c. family gray silver 11.54 X 47677
Pd-Te Pd20 Te7 rt Pd20 Sb7,hR81,148 R-3 1.1797,1.1797,1.1172,90,90,120 keithconnite - 11.18 A 10732
Pd-Te Pd3Te 2 rt *,oP45,17 P222 1 0.905,1.354,0.755,90,90,90 - - - N 4049
Pd-Te Pd3Te 2 Rh3Te2,oS20,63 Cmcm 0.3858,1.2687,0.79,90,90,90 - - 9.87 X 10737
Pd-Te Pd3.5 Te rt Pd3.5 Te,cF120,227 Fd-3m 1.269,1.269,1.269,90,90,90 - - 9.75 X 5545
Pd-Te Pd8Te 3 ht *,oP*,* - 1.1304,1.2843,1.5126,90,90,90 - - - N 23574
Pd-Te Pd9Te 4 ht Pd9Te4,mP52,14 P121/c1 0.7458,1.3938,0.8839,90,91.97,90 telluropalladinite - 10.62 X 11610
Pd-Th ThPd FeB-b,oP8,62 Pnma 0.7249,0.4571,0.5856,90,90,90 CrB(TlI)-FeB - 11.59 X 2103
Pd-Th ThPd3 TiNi3,hP16,194 P63/mmc 0.5858,0.5858,0.9814,90,90,120 close-packed structure - 12.55 A 1859
Pd-Th Th0.14Pd0.86 Cu,cF4,225 Fm-3m 0.406,0.406,0.406,90,90,90 close-packed structure - 12.31 X 17464
152 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Pd-Th Th0.8 Pd3.2 Cu3Au,cP4,221 Pm-3m 0.411,0.411,0.411,90,90,90 close-packed structure - 12.58 X 1859
Pd-Th Th2Pd CuAl2,tI12,140 I4/mcm 0.7313,0.7313,0.5942,90,90,90 - - 11.92 X 6743
Pd-Th Th3Pd4 Pu3Pd4,hR42,148 R-3 1.3646,1.3646,0.5847,90,90,120 b.c.c. family - 11.85 A 8276
Pd-Th Th3Pd5 Th3Pd5,hP8,189 P-62m 0.7149,0.7149,0.3899,90,90,120 AlB2 family - 11.82 X 1815
Pd-Ti TiPd ht CsCl,cP2,221 Pm-3m 0.318,0.318,0.318,90,90,90 b.c.c. family - 7.97 X 33160
Pd-Ti TiPd rt AuCd,oP4,51 Pmma 0.459,0.28,0.484,90,90,90 close-packed structure - 8.24 A 16426
Pd-Ti TiPd2 rt orth ReSi2,oI6,71 Immm 0.307,0.341,0.856,90,90,90 b.c.c. family - 9.66 A 4315
Pd-Ti TiPd2 rt tet MoSi2,tI6,139 I4/mmm 0.324,0.324,0.848,90,90,90 b.c.c. family - 9.73 A 4315
Pd-Ti TiPd3 cub Cu3Au,cP4,221 Pm-3m 0.382,0.382,0.382,90,90,90 close-packed structure - 10.94 X 22404
Pd-Ti TiPd3 hex TiNi3,hP16,194 P63 /mmc 0.54893,0.54893,0.86143,90,90,120 close-packed structure - 10.85 A 5327
Pd-Ti Ti0.10 Pd0.90 Cu,cF4,225 Fm-3m 0.38875,0.38875,0.38875,90,90,90 close-packed structure - 11.37 X 43617
Pd-Ti Ti0.8 Pd0.2 ht W,cI2,229 Im-3m 0.321,0.321,0.321,90,90,90 b.c.c. family - 5.98 X 16610
Pd-Ti Ti2Pd rt CuZr2,tI6,139 I4/mmm 0.309,0.309,1.0054,90,90,90 close-packed structure - 7.00 X 1765
Pd-Ti Ti2Pd3 rt Ti2Pd3,oS20,63 Cmcm 1.4329,0.4643,0.4606,90,90,90 - - 9.00 X 4315
Pd-Ti Ti3Pd5 Ti3Pd5,tP8,123 P4/mmm 0.3263,0.3263,1.1436,90,90,90 b.c.c. family - 9.22 X 4315
Pd-Ti Ti3.2 Pd0.8 rt Cr3Si,cP8,223 Pm-3n 0.5055,0.5055,0.5055,90,90,90 Frank-Kasper phase - 6.13 X 4308
Pd-Tl TlPd2 rt Co2Si-b,oP12,62 Pnma 0.571,0.422,0.836,90,90,90 - - 13.76 A 4696
Pd-Tl TlPd3 ht TiAl3,tI8,139 I4/mmm 0.4146,0.4146,0.7497,90,90,90 close-packed structure - 13.49 X 4213
Pd-Tl TlPd3 rt ZrAl3,tI16,139 I4/mmm 0.41066,0.41066,1.53028,90,90,90 close-packed structure - 13.48 X 55426
Pd-Tl Tl0.09 Pd0.91 Cu,cF4,225 Fm-3m 0.3936,0.3936,0.3936,90,90,90 close-packed structure - 12.55 X 11627
Pd-Tl Tl2Pd CuAl2,tI12,140 I4/mcm 0.6712,0.6712,0.5748,90,90,90 - - 13.21 X 6743
Pd-Tl Tl9Pd13 Tl9Pd13,hP22,164 P-3m1 0.8958,0.8958,0.5623,90,90,120 AlB2 family - 13.69 X 4699
Pd-Tm TmPd CsCl,cP2,221 Pm-3m 0.3435,0.3435,0.3435,90,90,90 b.c.c. family - 11.28 X 13362
Pd-Tm TmPd3 Cu3Au,cP4,221 Pm-3m 0.4038,0.4038,0.4038,90,90,90 close-packed structure - 12.31 X 25721
Pd-Tm Tm0.12 Pd0.88 Cu,cF4,225 Fm-3m 0.3971,0.3971,0.3971,90,90,90 close-packed structure - 12.08 X 27396
Pd-Tm Tm2.12 Pd0.88 Dy2.12Pd0.88 ,cF144,227 Fd-3m 1.329,1.329,1.329,90,90,90 - - 10.23 A 8305
Pd-Tm Tm3Pd4 Pu3Pd4,hR42,148 R-3 1.2946,1.2946,0.5657,90,90,120 b.c.c. family - 11.31 A 8276
Pd-U UPd3 rt TiNi3,hP16,194 P63 /mmc 0.57759,0.57759,0.95916,90,90,120 close-packed structure - 13.36 X 54679
Pd-U UPd5 Pd+ *,hP*,* - 0.5506,0.5506,0.7034,90,90,120 - - - N 20255
Pd-U U0.11 Pd0.89 rt In,tI2,139 I4/mmm 0.2745,0.2745,0.4083,90,90,90 close-packed structure - 13.05 X 6932
Pd-U U0.17 Pd0.83 Cu,cF4,225 Fm-3m 0.4061,0.4061,0.4061,90,90,90 close-packed structure - 12.77 X 20255
Pd-U U0.8Pd3.2 Cu3Au,cP4,221 Pm-3m 0.4067,0.4067,0.4067,90,90,90 close-packed structure - 13.11 X 9269
Pd-U U0.96 Pd0.04 rt U,oS4,63 Cmcm 0.2852,0.5897,0.4962,90,90,90 close-packed structure - 18.53 A 54679
Pd-V VPd2 rt MoPt2,oI6,71 Immm 0.275,0.3751,0.825,90,90,90 close-packed structure - 10.29 X 2667
Pd-V VPd3 rt TiAl3,tI8,139 I4/mmm 0.385,0.385,0.775,90,90,90 close-packed structure - 10.70 X 1033
Pd-V V0.10 Pd0.90 ht Cu,cF4,225 Fm-3m 0.38751,0.38751,0.38751,90,90,90 close-packed structure - 11.51 X 43617
Pd-V V3Pd rt Cr3Si,cP8,223 Pm-3n 0.48254,0.48254,0.48254,90,90,90 Frank-Kasper phase - 7.66 X 3823
Pd-W W0.4Pd0.6 Cu,cF4,225 Fm-3m 0.3918,0.3918,0.3918,90,90,90 close-packed structure - 15.17 X 4095
Pd-W W0.95Pd0.05 W,cI2,229 Im-3m 0.31642,0.31642,0.31642,90,90,90 b.c.c. family - 18.87 X 2231
Pd-Y YPd rt TlI,oS8,63 Cmcm 0.3733,1.0522,0.4552,90,90,90 CrB(TlI)-FeB - 7.26 A 51930
Pd-Y YPd3 Cu3Au,cP4,221 Pm-3m 0.40694,0.40694,0.40694,90,90,90 close-packed structure - 10.06 X 52471
Pd-Y Y0.1 Pd0.9 ht Cu,cF4,225 Fm-3m 0.3957,0.3957,0.3957,90,90,90 close-packed structure - 11.22 X 23680
Pd-Y Y2.14 Pd0.86 Dy2.12Pd0.88 ,cF144,227 Fd-3m 1.362,1.362,1.362,90,90,90 - - 5.93 A 18053
Pd-Y Y3Pd rt Fe3C-b,oP16,62 Pnma 0.7063,0.9734,0.6453,90,90,90 - - 5.59 A 13334
Pd-Y Y3Pd2 Er3Ni2,hR45,148 R-3 0.8747,0.8747,1.643,90,90,120 - - 6.58 A 18053
Pd-Y Y3Pd4 Pu3Pd4,hR42,148 R-3 1.313,1.313,0.569,90,90,120 b.c.c. family - 8.12 A 18053
Pd-Yb YbPd ht CsCl,cP2,221 Pm-3m 0.3436,0.3436,0.3436,90,90,90 b.c.c. family - 11.44 X 54245
Pd-Yb YbPd rt FeB-b,oP8,62 Pnma 0.722,0.4123,0.5578,90,90,90 CrB(TlI)-FeB - 11.18 A 8406
Pd-Yb YbPd3 Cu3Au,cP4,221 Pm-3m 0.404,0.404,0.404,90,90,90 close-packed structure - 12.40 X 25721
Pd-Yb Yb0.08 Pd0.92 Cu,cF4,225 Fm-3m 0.3935,0.3935,0.3935,90,90,90 close-packed structure - 12.18 X 27393
Pd-Yb Yb3Pd Fe3C-b,oP16,62 Pnma 0.7662,0.968,0.651,90,90,90 - - 8.61 A 54245
Pd-Yb Yb3Pd4 Pu3Pd4,hR42,148 R-3 1.2863,1.2863,0.5634,90,90,120 b.c.c. family - 11.66 X 28981
Pd-Yb Yb5Pd1.94 rt Mn5C2,mS28,15 C12/c1 1.63188,0.65678,0.76506,90,97.317,90 - - 8.75 X 54891
Pd-Zn ZnPd rt CuTi,tP2,123 P4/mmm 0.28992,0.28992,0.33331,90,90,90 b.c.c. family - 10.18 X 56483
Pd-Zn ZnPd2 rt Co2Si-b,oP12,62 Pnma 0.535,0.414,0.765,90,90,90 - - 10.91 A 1560
Pd-Zn Zn0.18Pd0.82 Cu,cF4,225 Fm-3m 0.3868,0.3868,0.3868,90,90,90 close-packed structure - 11.37 X 391
Pd-Zn Zn1.2 Pd0.8 ht CsCl,cP2,221 Pm-3m 0.3049,0.3049,0.3049,90,90,90 b.c.c. family - 9.58 X 391
Pd-Zn Zn10.65Pd2.35 Zn9(Zn0.5 Fe0.5)2Fe2,cI52,217 I-43m 0.90906,0.90906,0.90906,90,90,90 γ-brass - 8.37 X 46206
Pd-Zn Zn5.33Pd2.67 rt Zn5(Zn0.33Pd0.67)Pd2,oS48,65 Cmmm 0.7363,0.7525,1.2307,90,90,90 - - 9.24 X 11615
Pd-Zn Zn52.32Pd16.68 Zn45(Zn0.46Pd0.54 )16Pd8,oS276,64 Cmce 1.2929,0.9112,3.332,90,90,90 - black 8.79 X 46206
Pd-Zn Zn74.86Pd20.14 Zn58(Zn0.46Pd0.54 )37,oS380,63 Cmcm 1.2909,0.9115,4.6893,90,90,90 - black 8.47 X 52348
Pd-Zr ZrPd ht1 TlI,oS8,63 Cmcm 0.33319,1.0301,0.44111,90,90,90 CrB(TlI)-FeB - 8.67 X 31734
Pd-Zr ZrPd ht2 CsCl,cP2,221 Pm-3m 0.33597,0.33597,0.33597,90,90,90 b.c.c. family - 8.65 X 31734
Pd-Zr ZrPd rt TlI,oS8,63 Cmcm 0.33305,1.0304,0.43745,90,90,90 - - 8.74 X 31734
Pd-Zr ZrPd2 MoSi2,tI6,139 I4/mmm 0.3407,0.3407,0.8597,90,90,90 b.c.c. family - 10.12 A 1783
Pd-Zr ZrPd3 TiNi3,hP16,194 P63 /mmc 0.562,0.562,0.925,90,90,120 close-packed structure - 10.77 A 34519
Pd-Zr Zr0.1Pd0.9 Cu,cF4,225 Fm-3m 0.3927,0.3927,0.3927,90,90,90 close-packed structure - 11.50 X 23680
Pd-Zr Zr0.17Pd0.83 rt In,tI2,139 I4/mmm 0.28093,0.28093,0.39142,90,90,90 close-packed structure - 11.16 X 4704
Pd-Zr Zr0.8Pd0.2 ht W,cI2,229 Im-3m 0.347,0.347,0.347,90,90,90 b.c.c. family - 7.49 X 16610
Pd-Zr Zr2Pd tet CuZr2,tI6,139 I4/mmm 0.33086,0.33086,1.08918,90,90,90 close-packed structure - 8.05 X 20185
Pd-Zr Zr3Pd4 rt Pu3Pd4,hR42,148 R-3 1.2497,1.2497,0.55409,90,90,120 b.c.c. family - 9.30 X 27453
Pd-Zr Zr9Pd11 rt Zr9Ni11,tP44,83 P4/m 1.0313,1.0313,0.69405,90,90,90 - - 8.96 A 50733
Pm-Po PmPo NaCl,cF8,225 Fm-3m 0.636,0.636,0.636,90,90,90 rocksalt family - 9.14 X 5369
Po-Sc ScPo NiAs,hP4,194 P63 /mmc 0.4206,0.4206,0.692,90,90,120 AlB2 family - 7.96 X 11022
Po-Sm SmPo NaCl,cF8,225 Fm-3m 0.6724,0.6724,0.6724,90,90,90 rocksalt family - 7.85 X 3160
Po-Sr SrPo NaCl,cF8,225 Fm-3m 0.6796,0.6796,0.6796,90,90,90 rocksalt family gray 6.28 X 1261
Po-Tb TbPo NaCl,cF8,225 Fm-3m 0.6254,0.6254,0.6254,90,90,90 rocksalt family - 9.99 X 3160
Po-Ti TiPo NiAs,hP4,194 P63 /mmc 0.3992,0.3992,0.6569,90,90,120 AlB2 family - 9.41 X 11923
Handbook of Inorganic Substances – Edition 2015 : Data 153

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Po-Tm TmPo NaCl,cF8,225 Fm-3m 0.6256,0.6256,0.6256,90,90,90 rocksalt family - 10.25 X 3160


Po-Y YPo NaCl,cF8,225 Fm-3m 0.6251,0.6251,0.6251,90,90,90 rocksalt family - 8.10 X 9020
Po-Yb YbPo NaCl,cF8,225 Fm-3m 0.6542,0.6542,0.6542,90,90,90 rocksalt family - 9.06 X 3160
Po-Zn ZnPo ZnS,cF8,216 F-43m 0.6309,0.6309,0.6309,90,90,90 adamantane structure - 7.26 X 1261
Po-Zr ZrPo NiAs,hP4,194 P63/mmc 0.4031,0.4031,0.6907,90,90,120 AlB2 family - 10.26 X 11923
Pr-Pt PrPt ht TlI,oS8,63 Cmcm 0.3891,1.0899,0.4569,90,90,90 CrB(TlI)-FeB - 11.52 X 15600
Pr-Pt PrPt rt FeB-b,oP8,62 Pnma 0.7282,0.4594,0.5696,90,90,90 CrB(TlI)-FeB - 11.71 A 11925
Pr-Pt PrPt2 MgCu2,cF24,227 Fd-3m 0.7709,0.7709,0.7709,90,90,90 Friauf-Laves phase - 15.40 X 14816
Pr-Pt PrPt3 Cu3Au,cP4,221 Pm-3m 0.4065,0.4065,0.4065,90,90,90 close-packed structure - 17.95 X 2945
Pr-Pt PrPt5 CaCu5,hP6,191 P6/mmm 0.5348,0.5348,0.4385,90,90,120 - - 17.07 X 3583
Pr-Pt Pr3Pt2 Er3Ni2,hR45,148 R-3 0.8959,0.8959,1.698,90,90,120 - - 10.29 A 10402
Pr-Pt Pr3Pt4 Pu3Pd4,hR42,148 R-3 1.359,1.359,0.5769,90,90,120 b.c.c. family - 12.99 A 10744
Pr-Pt Pr7Pt3 Th7Fe3,hP20,186 P63mc 1.0137,1.0137,0.6376,90,90,120 - - 9.20 A 7500
Pr-Pu Pr0.85 Pu0.15 rt Nd,hP4,194 P63/mmc 0.3633,0.3633,1.171,90,90,120 close-packed structure - 7.76 X 4759
Pr-Re PrRe 2 ht MgCu2,cF24,227 Fd-3m 0.7572,0.7572,0.7572,90,90,90 Friauf-Laves phase - 15.71 X 2635
Pr-Re PrRe 2 rt MgZn2,hP12,194 P63/mmc 0.5336,0.5336,0.8805,90,90,120 Friauf-Laves phase - 15.70 A 2635
Pr-Rh PrRh TlI,oS8,63 Cmcm 0.3905,1.091,0.421,90,90,90 CrB(TlI)-FeB - 9.03 A 2469
Pr-Rh PrRh2 MgCu2,cF24,227 Fd-3m 0.7576,0.7576,0.7576,90,90,90 Friauf-Laves phase - 10.59 X 17065
Pr-Rh Pr3Rh2 Er3Ni2,hR45,148 R-3 0.8784,0.8784,1.668,90,90,120 - - 8.43 A 10402
Pr-Rh Pr7Rh3 Th7Fe3,hP20,186 P63mc 1.0012,1.0012,0.6346,90,90,120 - - 7.81 A 7500
Pr-Ru PrRu2 MgCu2,cF24,227 Fd-3m 0.7622,0.7622,0.7622,90,90,90 Friauf-Laves phase - 10.29 X 2670
Pr-Ru Pr3Ru Fe3C-b,oP16,62 Pnma 0.7379,0.9768,0.6435,90,90,90 - - 7.50 A 13334
Pr-Ru Pr5Ru2 Mn5 C2,mS28,15 C12/c1 1.6424,0.6545,0.7341,90,96.46,90 - - 7.68 A 12457
Pr-Ru Pr5Ru3 *,oP1794,* - 1.569,1.569,18.715,90,90,90 - - - N 23566
Pr-Ru Pr7Ru3 Sr7Pt3,oP40,62 Pnma 0.7319,2.2961,0.6558,90,90,90 - - 7.77 A 23566
Pr-S PrS NaCl,cF8,225 Fm-3m 0.5729,0.5729,0.5729,90,90,90 rocksalt family golden 6.11 X 11574
Pr-S PrS1.75 tet1 NdS2,tP24,117 P-4b2 0.798,0.798,0.807,90,90,90 - - 5.09 A 11830
Pr-S PrS2 cub *,c*24,* - 0.8076,0.8076,0.8076,90,90,90 - brown - N 24571
Pr-S PrS2 orth LaS2 ,oP24,62 Pnma 0.8044,1.6161,0.4073,90,90,90 - red dark 5.14 X 53589
Pr-S PrS2 rt CeSe 2,mP12,14 P121/c1 0.8079,0.4054,0.8058,90,90.08,90 - red dark 5.16 X 38267
Pr-S PrS2 tet2 UAs2,tP6,129 P4/nmm 0.4147,0.4147,0.8176,90,90,90 - - 4.84 A 11830
Pr-S Pr1.5 S3 ht-hp Cr3C2-b,oP20,62 Pnma 0.8025,0.4062,1.6152,90,90,90 - - 3.88 A 19394
Pr-S Pr10 S15 rt Pr10S14O,tI200,142 I41/acd 1.51,1.51,2.005,90,90,90 - - 5.49 A 33698
Pr-S Pr10 S19 Ce10 Se19,tP58,86 P42/n 0.8947,0.8947,1.6054,90,90,90 - - 5.22 X 49625
Pr-S Pr2S3 cub *,cF*,227 Fd-3m 2.,2.,2.,90,90,90 - - - N 5510
Pr-S Pr2S3 ht Cr3C2-b,oP20,62 Pnma 0.74822,0.40551,1.56074,90,90,90 - - 5.30 X 32695
Pr-S Pr2.67 S4 ht Th3P 4,cI28,220 I-43d 0.85768,0.85768,0.85768,90,90,90 - orange 5.31 X 40917
Pr-S Pr3S4 lt *,t**,* - 0.8539,0.8539,0.8552,90,90,90 - - - N 9178
Pr-S Pr3S4 rt Th3P 4,cI28,220 I-43d 0.855,0.855,0.855,90,90,90 - black 5.86 A 11834
Pr-Sb PrSb hp CuTi,tP2,123 P4/mmm 0.386,0.386,0.3187,90,90,90 b.c.c. family - 9.19 X 38036
Pr-Sb PrSb rt NaCl,cF8,225 Fm-3m 0.6368,0.6368,0.6368,90,90,90 rocksalt family - 6.76 X 11574
Pr-Sb PrSb2 SmSb2,oS24,64 Cmce 0.6224,0.6127,1.8144,90,90,90 - - 7.38 A 50560
Pr-Sb Pr2Sb La2Sb,tI12,139 I4/mmm 0.45321,0.45321,1.7707,90,90,90 - - 7.37 X 57414
Pr-Sb Pr4Sb3 Th3P 4,cI28,220 I-43d 0.9436,0.9436,0.9436,90,90,90 - gray 7.34 X 54538
Pr-Sb Pr5Sb3 Mn5 Si3,hP16,193 P63/mcm 0.9233,0.9233,0.651,90,90,120 - - 7.39 X 3842
Pr-Sb Pr8.33 Sb20 Pr8.33 Sb20,mS62,8 C1m1 2.8591,0.4263,1.3561,90,95.52,90 - - 7.29 X 41926
Pr-Se PrSe NaCl,cF8,225 Fm-3m 0.5932,0.5932,0.5932,90,90,90 rocksalt family red 7.00 X 11574
Pr-Se PrSe 1.75 *,mP24,14 P121/c1 0.8426,0.832,0.832,90,90.,90 - gray - N 3542
Pr-Se PrSe 1.85 ht UAs2,tP6,129 P4/nmm 0.4147,0.4147,0.8419,90,90,90 - gray silver 6.58 X 49090
Pr-Se PrSe 2 rt CeSe 2,mP12,14 P121/c1 0.8431,0.4184,0.8396,90,89.92,90 - gray silver 6.70 X 45644
Pr-Se Pr10 Se19 Ce10 Se19,tP58,86 P42/n 0.9296,0.9296,1.686,90,90,90 - - 6.63 X 22528
Pr-Se Pr2.67 Se4 ht Th3P 4,cI28,220 I-43d 0.89117,0.89117,0.89117,90,90,90 - red ruby 6.50 X 39449
Pr-Se Pr3Se4 lt *,t*28,* - 0.8844,0.8844,0.889,90,90,90 - - - N 9178
Pr-Se Pr3Se 4 rt Th3P 4,cI28,220 I-43d 0.89038,0.89038,0.89038,90,90,90 - blue 6.95 A 9178
Pr-Si PrSi FeB-b,oP8,62 Pnma 0.8244,0.3943,0.5928,90,90,90 CrB(TlI)-FeB gray 5.83 A 57891
Pr-Si PrSi1.63 rt orth GdSi1.4 ,oI12,74 Imma 0.4103,0.4162,1.3827,90,90,90 - gray 5.25 A 57891
Pr-Si PrSi1.95 rt tet ThSi2,tI12,141 I41/amd 0.4205,0.4205,1.373,90,90,90 - - 5.35 X 24915
Pr-Si Pr2Si2.67 Ho2Si2.67 ,oS24,63 Cmcm 0.43922,2.474,0.39375,90,90,90 - - 5.54 A 41616
Pr-Si Pr2Si2.7 rt V2B3,oS20,63 Cmcm 0.43834,2.472,0.39326,90,90,90 - - 5.57 X 26282
Pr-Si Pr3Si2 U3Si2,tP10,127 P4/mbm 0.7772,0.7772,0.4337,90,90,90 - - 6.07 A 57891
Pr-Si Pr5Si3 rt Cr5B3,tI32,140 I4/mcm 0.78172,0.78172,1.3816,90,90,90 - - 6.21 X 43263
Pr-Si Pr5Si4 Zr5Si4,tP36,92 P41212 0.79092,0.79092,1.49437,90,90,90 - - 5.80 X 40203
Pr-Sn PrSn2 ZrGa2,oS12,65 Cmmm 0.4482,1.58973,0.45901,90,90,90 close-packed structure - 7.68 A 26419
Pr-Sn PrSn3 Cu3Au,cP4,221 Pm-3m 0.473,0.473,0.473,90,90,90 close-packed structure - 7.80 X 28969
Pr-Sn Pr2Sn3 Nd2Sn3,aP20,2 P-1 0.6405,0.8452,1.114,107.33,96.76,99.99 - - 7.60 A 42507
Pr-Sn Pr2Sn5 Ce2Sn5,oS28,65 Cmmm 0.45848,3.51784,0.46338,90,90,90 close-packed structure - 7.78 A 26419
Pr-Sn Pr3Sn Cu3Au,cP4,221 Pm-3m 0.499,0.499,0.499,90,90,90 close-packed structure gray 7.24 X 3204
Pr-Sn Pr3Sn5 rt Pu3Pd5,oS32,63 Cmcm 1.018,0.821,1.054,90,90,90 - - 7.66 A 21797
Pr-Sn Pr3Sn7 Tb3Sn7,oS28,65 Cmmm 0.45108,2.58235,0.46037,90,90,90 close-packed structure - 7.76 A 26419
Pr-Sn Pr5Sn3 ht Mn5 Si3,hP16,193 P63/mcm 0.9281,0.9281,0.6779,90,90,120 - - 6.97 A 3333
Pr-Sn Pr5Sn4 Sm5 Ge4,oP36,62 Pnma 0.82,1.58,0.838,90,90,90 - - 7.21 A 21797
Pr-Tb Pr0.25 Tb0.75 lt1 Mg,hP2,194 P63/mmc 0.36279,0.36279,0.57539,90,90,120 close-packed structure - 7.82 X 4096
Pr-Tb Pr0.4 Tb0.6 lt2 Sm,hR9,166 R-3m 0.36209,0.36209,2.6119,90,90,120 close-packed structure - 7.65 A 4096
Pr-Tb Pr0.6 Tb0.4 rt Nd,hP4,194 P63/mmc 0.36322,0.36322,1.171,90,90,120 close-packed structure - 7.35 X 4096
Pr-Te PrTe hp CsCl,cP2,221 Pm-3m 0.3761,0.3761,0.3761,90,90,90 b.c.c. family - 8.38 X 6939
Pr-Te PrTe rt NaCl,cF8,225 Fm-3m 0.6315,0.6315,0.6315,90,90,90 rocksalt family red violet 7.08 X 6294
Pr-Te PrTe 1.89 tet1 UAs2,tP6,129 P4/nmm 0.4459,0.4459,0.9072,90,90,90 - - 7.03 A 3552
Pr-Te PrTe 2 tet2 CeTe 2,tP72,75 P4 0.8968,0.8968,1.8119,90,90,90 - black 7.22 X 38245
154 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Pr-Te PrTe3 CeTe3,oS16,40 Ama2 0.43606,2.58878,0.43566,90,90,90 - - 7.07 X 44787


Pr-Te Pr2Te5 ht Nd2Te5,oS28,63 Cmcm 0.4426,4.43,0.4426,90,90,90 - brown 7.04 A 3452
Pr-Te Pr2.67 Te4 Th3P 4,cI28,220 I-43d 0.9483,0.9483,0.9483,90,90,90 - gray silver 6.91 A 9274
Pr-Te Pr3Te4 Th3P 4,cI28,220 I-43d 0.9482,0.9482,0.9482,90,90,90 - - 7.27 A 3552
Pr-Te Pr4Te6.8 *,tP22,127 P4/mbm 0.8858,0.8858,0.9064,90,90,90 - - - N 3552
Pr-Th Th0.05Pr0.95 rt Nd,hP4,194 P63 /mmc 0.3645,0.3645,1.1848,90,90,120 close-packed structure - 7.09 X 3720
Pr-Th Th0.2 Pr0.8 rt Cu,cF4,225 Fm-3m 0.512,0.512,0.512,90,90,90 close-packed structure - 7.88 X 4836
Pr-Tl TlPr lt CuTi,tP2,123 P4/mmm 0.362,0.362,0.433,90,90,90 b.c.c. family - 10.10 X 14458
Pr-Tl TlPr rt CsCl,cP2,221 Pm-3m 0.3871,0.3871,0.3871,90,90,90 b.c.c. family - 9.88 X 14458
Pr-Tl TlPr2 Co1.75 Ge,hP6,194 P63 /mmc 0.5522,0.5522,0.6869,90,90,120 AlB2 family - 8.90 X 5195
Pr-Tl TlPr3 rt Cu3Au,cP4,221 Pm-3m 0.4926,0.4926,0.4926,90,90,90 close-packed structure - 8.71 X 6941
Pr-Tl Tl0.25 Pr0.75 ht Cu,cF4,225 Fm-3m 0.50309,0.50309,0.50309,90,90,90 close-packed structure - 8.18 X 6195
Pr-Tl Tl3Pr Cu3Au,cP4,221 Pm-3m 0.4753,0.4753,0.4753,90,90,90 close-packed structure - 11.66 X 16023
Pr-Tl Tl3Pr5 W5Si3,tI32,140 I4/mcm 1.2553,1.2553,0.6172,90,90,90 - - 9.00 X 4709
Pr-Tl Tl5Pr3 rt *,o**,* - 0.3869,0.828,1.026,90,90,90 - - - N 14274
Pr-Y Y0.3 Pr0.7 rt Nd,hP4,194 P63 /mmc 0.36562,0.36562,1.17821,90,90,120 close-packed structure - 6.10 X 3146
Pr-Y Y0.4 Pr0.6 rt Sm,hR9,166 R-3m 0.36629,0.36629,2.6416,90,90,120 close-packed structure - 5.85 A 3146
Pr-Y Y0.5 Pr0.5 rt Mg,hP2,194 P63 /mmc 0.3682,0.3682,0.58294,90,90,120 close-packed structure - 5.58 X 3146
Pr-Zn ZnPr lt CuTi,tP2,123 P4/mmm 0.3658,0.3658,0.3685,90,90,90 b.c.c. family - 6.95 X 9275
Pr-Zn ZnPr rt CsCl,cP2,221 Pm-3m 0.36865,0.36865,0.36865,90,90,90 b.c.c. family - 6.84 X 9066
Pr-Zn Zn11Pr BaCd11,tI48,141 I41/amd 1.0646,1.0646,0.685,90,90,90 - - 7.36 A 5489
Pr-Zn Zn11Pr3 La3Al11,oI28,71 Immm 0.4502,0.8956,1.3384,90,90,90 - - 7.03 A 5489
Pr-Zn Zn17Pr2 ht Zn17Th2,hR57,166 R-3m 0.90711,0.90711,1.32592,90,90,120 CaCu5-Zr4Al3 gray 7.35 X 20156
Pr-Zn Zn17Pr2 rt Th2Ni17,hP38,194 P63 /mmc 0.9064,0.9064,0.8845,90,90,120 CaCu5-Zr4Al3 - 7.35 A 3117
Pr-Zn Zn2Pr rt KHg2,oI12,74 Imma 0.464,0.747,0.755,90,90,90 AlB2 family - 6.90 X 30407
Pr-Zn Zn22Pr3 Zn22Ce3,tI100,141 I41/amd 0.8908,0.8908,2.1303,90,90,90 - - 7.31 A 5489
Pr-Zn Zn3Pr Zn3Y,oP16,62 Pnma 0.6655,0.4595,1.0383,90,90,90 - - 7.05 A 5489
Pr-Zn Zn5Pr CaCu5,hP6,191 P6/mmm 0.5414,0.5414,0.4211,90,90,120 - - 7.27 X 7490
Pr-Zn Zn58Pr13 Zn58Gd13,hP142,194 P63 /mmc 1.4585,1.4585,1.4133,90,90,120 - - 7.17 X 47696
Pt-Pu PuPt TlI,oS8,63 Cmcm 0.3816,1.0694,0.4428,90,90,90 CrB(TlI)-FeB - 16.14 A 3725
Pt-Pu PuPt2 MgCu2,cF24,227 Fd-3m 0.76,0.76,0.76,90,90,90 Friauf-Laves phase - 19.19 X 11668
Pt-Pu PuPt3 ht1 Ni3P,tI32,82 I-4 1.039,1.039,0.46,90,90,90 - - 22.19 A 11668
Pt-Pu PuPt3 rt Cu3Au,cP4,221 Pm-3m 0.4107,0.4107,0.4107,90,90,90 close-packed structure - 19.88 X 11668
Pt-Pu PuPt4 PuPt4,oS10,65 Cmmm 0.5258,0.8759,0.4563,90,90,90 - - 16.19 X 11668
Pt-Pu PuPt5 CaCu5,hP6,191 P6/mmm 0.5262,0.5262,0.4393,90,90,120 - - 19.22 X 11668
Pt-Pu Pu2Pt Co2Si-b,oP12,62 Pnma 0.7046,0.4707,0.8865,90,90,90 - - 15.43 X 11237
Pt-Pu Pu31Pt20 Pu31Pt20,tI204,140 I4/mcm 1.1302,1.1302,3.7388,90,90,90 - - 15.95 X 10411
Pt-Pu Pu5Pt3 Mn5Si3,hP16,193 P63 /mcm 0.849,0.849,0.6084,90,90,120 - - 15.79 X 8755
Pt-Rb Rb0.5Pt Rb0.5 Pt,hR30,160 R3m 0.26415,0.26415,1.7871,90,90,120 - gray 10.97 X 47678
Pt-Re Re0.3 Pt0.7 Cu,cF4,225 Fm-3m 0.39016,0.39016,0.39016,90,90,90 close-packed structure - 21.52 X 3585
Pt-Re Re0.75Pt0.25 Mg,hP2,194 P63 /mmc 0.2767,0.2767,0.4441,90,90,120 close-packed structure - 21.25 X 49126
Pt-Rh Rh0.108 Pt0.892 Cu,cF4,225 Fm-3m 0.39108,0.39108,0.39108,90,90,90 close-packed structure - 20.56 X 30195
Pt-Ru Ru0.5 Pt0.5 Cu,cF4,225 Fm-3m 0.3857,0.3857,0.3857,90,90,90 close-packed structure - 17.14 X 49415
Pt-Ru Ru0.96Pt0.03 Mg,hP2,194 P63 /mmc 0.2709,0.2709,0.4299,90,90,120 close-packed structure - 12.51 X 56963
Pt-S PtS PtS,tP4,131 P42 /mmc 0.34700,0.34700,0.61096,90,90,90 cooperite black gray 10.26 X 1212
Pt-S PtS2 CdI2,hP3,164 P-3m1 0.35431,0.35431,0.50389,90,90,120 CdI2 -PbI2 polytype gray 7.86 X 1079
Pt-Sb PtSb rt NiAs,hP4,194 P63 /mmc 0.413,0.413,0.547,90,90,120 stumpflite yellow 13.02 X 50357
Pt-Sb PtSb2 FeS2,cP12,205 Pa-3 0.64423,0.64423,0.64423,90,90,90 geversite white 10.90 X 29567
Pt-Sb Pt0.94 Sb0.06 Cu,cF4,225 Fm-3m 0.39466,0.39466,0.39466,90,90,90 close-packed structure - 20.61 X 48616
Pt-Sb Pt3Sb ZrAl3,tI16,139 I4/mmm 0.39455,0.39455,1.6959,90,90,90 close-packed structure yellow 17.79 A 33132
Pt-Sb Pt3Sb2 Pt3Sb2,oI20,72 Ibam 0.6446,1.0939,0.5319,90,90,90 - yellow 14.68 X 4711
Pt-Sb Pt3.28 Sb0.72 Cu3Au,cP4,221 Pm-3m 0.399,0.399,0.399,90,90,90 close-packed structure - 19.02 X 4213
Pt-Sb Pt7Sb rt CuPt7,cF32,225 Fm-3m 0.7948,0.7948,0.7948,90,90,90 close-packed structure - 19.68 X 24756
Pt-Sc ScPt CsCl,cP2,221 Pm-3m 0.3268,0.3268,0.3268,90,90,90 b.c.c. family - 11.42 X 2764
Pt-Sc ScPt3 Cu3Au,cP4,221 Pm-3m 0.3954,0.3954,0.3954,90,90,90 close-packed structure - 16.93 X 3583
Pt-Sc Sc2Pt Co2Si-b,oP12,62 Pnma 0.6592,0.4491,0.8206,90,90,90 - - 7.79 X 12117
Pt-Sc Sc57Pt13 Sc57Rh13,cP140,200 Pm-3 1.4415,1.4415,1.4415,90,90,90 - - 5.65 A 17804
Pt-Se PtSe2 CdI2,hP3,164 P-3m1 0.37278,0.37278,0.50813,90,90,120 sudovikovite gray 9.59 X 1079
Pt-Se Pt0.67 Se0.33 Cu,cF4,225 Fm-3m 0.3736,0.3736,0.3736,90,90,90 close-packed structure - 19.97 X 48909
Pt-Se Pt5Se4 Pt5Se4,mP18,14 P121/c1 0.6577,0.4610,1.1122,90,101.59,90 luberoite - 12.98 X 10753
Pt-Si PtSi FeAs,oP8,62 Pnma 0.5577,0.3587,0.5916,90,90,90 AlB2 family - 12.53 X 7137
Pt-Si Pt0.985 Si0.015 Cu,cF4,225 Fm-3m 0.3922,0.3922,0.3922,90,90,90 close-packed structure - 21.20 X 14267
Pt-Si Pt12Si5 ht Pt12Si5,tP68,85 P4/n 1.3404,1.3404,0.5451,90,90,90 - - 16.83 X 4933
Pt-Si Pt12Si5 rt Ni12P 5,tI34,87 I4/m 0.9607,0.9607,0.5542,90,90,90 - - 16.11 X 12001
Pt-Si Pt2Si ht Fe2P,hP9,189 P-62m 0.64567,0.64567,0.35772,90,90,120 Fe2P family - 16.13 A 50979
Pt-Si Pt2Si rt ThH2,tI6,139 I4/mmm 0.3931,0.3931,0.59231,90,90,90 fluorite family - 15.18 X 50979
Pt-Si Pt2Si3 m Pt2Sn3,hP10,194 P63 /mmc 0.3841,0.3841,1.1924,90,90,120 - - 10.34 X 13284
Pt-Si Pt3Si ht1 Fe3C-b,oP16,62 Pnma 0.5579,0.7697,0.552,90,90,90 - - 17.19 X 12001
Pt-Si Pt3Si ht2 U3Si,tI16,140 I4/mcm 0.546,0.546,0.786,90,90,90 close-packed structure - 17.39 A 2428
Pt-Si Pt3Si rt Pt3Ge,mS16,12 C12/m1 0.77769,0.7767,0.55694,90,136.127,90 close-packed structure - 17.47 X 50979
Pt-Si Pt6Si5 rt Pt6Si5,mP22,11 P121/m1 0.6169,0.3499,1.5462,90,93.68,90 - - 13.07 X 2428
Pt-Sm SmPt FeB-b,oP8,62 Pnma 0.7148,0.451,0.5638,90,90,90 CrB(TlI)-FeB - 12.63 A 11925
Pt-Sm SmPt2 MgCu2,cF24,227 Fd-3m 0.766,0.766,0.766,90,90,90 Friauf-Laves phase - 15.98 X 7597
Pt-Sm SmPt3 Cu3Au,cP4,221 Pm-3m 0.40633,0.40633,0.40633,90,90,90 close-packed structure - 18.21 X 2945
Pt-Sm SmPt5 *,o*72,* - 0.5305,0.911,2.642,90,90,90 - - - N 7793
Pt-Sm Sm3Pt4 Pu3Pd4,hR42,148 R-3 1.3372,1.3372,0.5725,90,90,120 b.c.c. family - 13.84 A 10744
Pt-Sm Sm7Pt3 Th7Fe3,hP20,186 P63 mc 1.0017,1.0017,0.6298,90,90,120 - - 9.94 A 11341
Pt-Sn PtSn NiAs,hP4,194 P63 /mmc 0.41,0.41,0.544,90,90,120 niggliite - 13.16 X 50357
Handbook of Inorganic Substances – Edition 2015 : Data 155

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Pt-Sn PtSn2 hp *,tP24,* - 0.7146,0.7146,0.9861,90,90,90 - - - N 17042


Pt-Sn PtSn2 CaF2 ,cF12,225 Fm-3m 0.6445,0.6445,0.6445,90,90,90 fluorite family - 10.73 X 38766
Pt-Sn PtSn3 hp *,cP32,* - 0.9002,0.9002,0.9002,90,90,90 - - - N 17042
Pt-Sn PtSn4 PtSn4,oS20,68 Ccce 0.6418,1.1366,0.6384,90,90,90 - gray silver 9.55 X 37396
Pt-Sn Pt0.67 Sn0.33 m Cu,cF4,225 Fm-3m 0.39756,0.39756,0.39756,90,90,90 close-packed structure - 17.96 X 48802
Pt-Sn Pt0.9 Sn0.1 Cu,cF4,225 Fm-3m 0.39416,0.39416,0.39416,90,90,90 close-packed structure - 20.33 X 4106
Pt-Sn Pt2Sn3 Pt2Sn3,hP10,194 P63/mmc 0.4334,0.4334,1.2966,90,90,120 - - 11.75 X 326
Pt-Sn Pt3Sn Cu3Au,cP4,221 Pm-3m 0.4,0.4,0.4,90,90,90 close-packed structure - 18.27 X 14267
Pt-Sr SrPt2 MgCu2,cF24,227 Fd-3m 0.7777,0.7777,0.7777,90,90,90 Friauf-Laves phase - 13.49 X 938
Pt-Sr SrPt5 CaCu5,hP6,191 P6/mmm 0.5397,0.5397,0.4364,90,90,120 - - 16.04 X 913
Pt-Sr Sr3Pt2 Er3Ni2,hR45,148 R-3 0.9337,0.9337,1.7762,90,90,120 - - 7.28 A 14268
Pt-Sr Sr5Pt4 Sm5 Ge4,oP36,62 Pnma 0.7879,1.5606,0.8147,90,90,90 - - 8.08 A 14268
Pt-Sr Sr7Pt3 Sr7Pt3,oP40,62 Pnma 0.7929,2.4326,0.7100,90,90,90 - - 5.81 X 16273
Pt-Sr Sr9Pt *,cF*,* - 0.6091,0.6091,0.6091,90,90,90 - - - N 14268
Pt-Ta TaPt ht *,tI2,* - 0.3353,0.3353,0.2801,90,90,90 - - - N 2822
Pt-Ta TaPt2 Au2 V,oS12,63 Cmcm 0.8403,0.4785,0.4744,90,90,90 close-packed structure - 19.89 X 2822
Pt-Ta TaPt3 rt NbPt3,mP16,11 P121/m1 0.4869,0.5537,0.9269,90,100.62,90 close-packed structure - 20.72 X 2822
Pt-Ta TaPt3 stab Cu3Ti,oP8,59 Pmmn 0.456,0.5538,0.4874,90,90,90 close-packed structure - 20.67 A 2822
Pt-Ta Ta0.09Pt0.91 Cu,cF4,225 Fm-3m 0.39298,0.39298,0.39298,90,90,90 close-packed structure - 21.21 X 44058
Pt-Ta Ta0.8 Pt0.2 (Cr0.49 Fe0.51),tP30,136 P42/mnm 1.002,1.002,0.52,90,90,90 Frank-Kasper phase - 17.54 A 1439
Pt-Ta Ta0.8 Pt3.2 TiAl3,tI8,139 I4/mmm 0.391,0.391,0.794,90,90,90 close-packed structure - 21.04 X 2430
Pt-Tb TbPt FeB-b,oP8,62 Pnma 0.7013,0.449,0.5564,90,90,90 CrB(TlI)-FeB - 13.42 X 13425
Pt-Tb TbPt2 ht MgCu2,cF24,227 Fd-3m 0.7612,0.7612,0.7612,90,90,90 Friauf-Laves phase - 16.54 X 17109
Pt-Tb TbPt3 rt Cu3Au,cP4,221 Pm-3m 0.40824,0.40824,0.40824,90,90,90 close-packed structure - 18.16 X 4087
Pt-Tb TbPt5 *,o*72,* - 0.5248,0.9092,2.644,90,90,90 - - - N 7793
Pt-Tb Tb0.75Pt2.25 ht MgCu2,cF24,227 Fd-3m 0.75388,0.75388,0.75388,90,90,90 Friauf-Laves phase - 17.31 X 7477
Pt-Tb Tb2Pt Co2Si-b,oP12,62 Pnma 0.7147,0.4772,0.8763,90,90,90 - - 11.40 X 15492
Pt-Tb Tb3Pt Fe3C-b,oP16,62 Pnma 0.7077,0.9541,0.6444,90,90,90 - - 10.26 A 12087
Pt-Tb Tb3Pt4 Pu3Pd4,hR42,148 R-3 1.3163,1.3163,0.5689,90,90,120 b.c.c. family - 14.67 A 10744
Pt-Tb Tb5Pt3 Mn5 Si3,hP16,193 P63/mcm 0.8415,0.8415,0.623,90,90,120 - - 12.00 A 11341
Pt-Tb Tb5Pt4 Sm5 Ge4,oP36,62 Pnma 0.7495,1.4602,0.7565,90,90,90 - - 12.64 A 11278
Pt-Tc Tc0.38Pt0.62 Cu,cF4,225 Fm-3m 0.389,0.389,0.389,90,90,90 close-packed structure - 17.85 X 1861
Pt-Tc Tc0.67Pt0.33 Mg,hP2,194 P63/mmc 0.276,0.276,0.4385,90,90,120 close-packed structure - 14.93 X 1920
Pt-Te PtTe ZrCl,hR12,166 R-3m 0.3963,0.3963,1.998,90,90,120 - gray 11.83 X 24276
Pt-Te PtTe 2 CdI2 ,hP3,164 P-3m1 0.4009,0.4009,0.51,90,90,120 CdI2-PbI2 polytype white 10.53 X 45158
Pt-Te Pt2Te 3 rt Pt2Te3,hR30,166 R-3m 0.4003,0.4003,5.089,90,90,120 - yellow 10.91 X 24276
Pt-Te Pt3Te 4 Pt3Te4,hR21,166 R-3m 0.3988,0.3988,3.539,90,90,120 - yellow pale 11.20 X 24276
Pt-Th ThPt TlI,oS8,63 Cmcm 0.39,1.109,0.4454,90,90,90 CrB(TlI)-FeB - 14.73 X 1583
Pt-Th ThPt5 *,o**,* - 0.5364,0.9157,2.66,90,90,90 - - - N 7597
Pt-Th Th0.99Pt0.01 rt Cu,cF4,225 Fm-3m 0.50942,0.50942,0.50942,90,90,90 close-packed structure - 11.64 X 2229
Pt-Th Th3Pt5 Th3Pd5,hP8,189 P-62m 0.7162,0.7162,0.3908,90,90,120 AlB2 family - 15.99 A 2229
Pt-Th Th7Pt3 Th7Fe3,hP20,186 P63mc 1.0126,1.0126,0.6346,90,90,120 - - 13.02 A 2229
Pt-Ti TiPt ht CsCl,cP2,221 Pm-3m 0.3192,0.3192,0.3192,90,90,90 b.c.c. family - 12.41 X 5319
Pt-Ti TiPt rt AuCd,oP4,51 Pmma 0.45915,0.27607,0.48359,90,90,90 close-packed structure - 13.17 A 15723
Pt-Ti TiPt3 Pt- TiNi3,hP16,194 P63/mmc 0.552,0.552,0.9019,90,90,120 close-packed structure - 17.67 A 4876
Pt-Ti TiPt8 rt TiPt8,tI18,139 I4/mmm 0.8312,0.8312,0.3897,90,90,90 close-packed structure - 19.84 X 2753
Pt-Ti Ti0.25 Pt0.75 m Cu,cF4,225 Fm-3m 0.3925,0.3925,0.3925,90,90,90 close-packed structure - 17.39 X 54865
Pt-Ti Ti0.75 Pt0.25 m Cu,cF4,225 Fm-3m 0.3917,0.3917,0.3917,90,90,90 close-packed structure - 9.36 X 48804
Pt-Ti Ti2Pt2 ht Cu3Au,cP4,221 Pm-3m 0.3923,0.3923,0.3923,90,90,90 close-packed structure - 13.37 X 54865
Pt-Ti Ti3Pt Cr3Si,cP8,223 Pm-3n 0.50327,0.50327,0.50327,90,90,90 Frank-Kasper phase - 8.83 X 3823
Pt-Ti Ti3Pt5 ht Au5(Zn0.67 Ga0.33 )3,oI32,72 Ibam 0.5441,1.0953,0.8169,90,90,90 close-packed structure - 15.27 X 4315
Pt-Tl TlPt CoSn,hP6,191 P6/mmm 0.5605,0.5605,0.4639,90,90,120 AlB2 family - 15.77 X 101
Pt-Tl Tl0.06 Pt0.94 Cu,cF4,225 Fm-3m 0.3941,0.3941,0.3941,90,90,90 close-packed structure - 21.23 X 11627
Pt-Tl Tl2Pt CuAl2,tI12,140 I4/mcm 0.6822,0.6822,0.5565,90,90,90 - - 15.49 X 6743
Pt-Tl Tl2Pt3 Tl2Pt3,hP20,194 P63/mmc 0.5645,0.5645,1.3851,90,90,120 - - 17.27 X 4105
Pt-Tm TmPt FeB-b,oP8,62 Pnma 0.6855,0.4446,0.5496,90,90,90 CrB(TlI)-FeB - 14.44 A 13425
Pt-Tm TmPt2 MgCu2,cF24,227 Fd-3m 0.7556,0.7556,0.7556,90,90,90 Friauf-Laves phase - 17.22 X 2945
Pt-Tm TmPt3 Cu3Au,cP4,221 Pm-3m 0.4044,0.4044,0.4044,90,90,90 close-packed structure - 18.94 X 3583
Pt-Tm TmPt5 hex *,hP36,* - 0.522,0.522,2.647,90,90,120 - gray silver - N 33094
Pt-Tm TmPt5 orth *,o*72,* - 0.5213,0.9071,2.641,90,90,90 - - - N 7793
Pt-Tm Tm2 Pt Co2Si-b,oP12,62 Pnma 0.7008,0.4688,0.8619,90,90,90 - - 12.50 A 11341
Pt-Tm Tm3 Pt Fe3C-b,oP16,62 Pnma 0.6981,0.9314,0.6349,90,90,90 - - 11.29 A 12087
Pt-Tm Tm3 Pt4 Pu3Pd4,hR42,148 R-3 1.2933,1.2933,0.5635,90,90,120 b.c.c. family - 15.71 A 10744
Pt-Tm Tm5 Pt3 Mn5 Si3,hP16,193 P63/mcm 0.8252,0.8252,0.6128,90,90,120 - - 13.14 A 11341
Pt-Tm Tm5 Pt4 Sm5 Ge4,oP36,62 Pnma 0.7385,1.4378,0.746,90,90,90 - - 13.63 A 11278
Pt-U UPt rt PdBi,mP16,4 P1211 0.5727,1.078,0.576,90,99.6,90 CrB(TlI)-FeB - 16.41 X 21852
Pt-U UPt2 UPt2 ,oS12,63 Cmcm 0.412,0.968,0.560,90,90,90 AlB2 family - 18.68 X 1060
Pt-U UPt3 rt Mg3 Cd,hP8,194 P63/mmc 0.5764,0.5764,0.4899,90,90,120 close-packed structure - 19.40 X 662
Pt-U UPt5 Be5Au,cF24,216 F-43m 0.7427,0.7427,0.7427,90,90,90 Friauf-Laves phase - 19.68 A 21412
Pt-U U0.076Pt0.924 Cu,cF4,225 Fm-3m 0.3956,0.3956,0.3956,90,90,90 close-packed structure - 21.28 X 1257
Pt-V VPt rt AuCd,oP4,51 Pmma 0.4413,0.2693,0.4767,90,90,90 close-packed structure - 14.42 X 7705
Pt-V VPt2 ht MoPt2,oI6,71 Immm 0.273,0.38,0.8323,90,90,90 close-packed structure - 16.97 X 2667
Pt-V VPt3 ht Cu3Au,cP4,221 Pm-3m 0.3887,0.3887,0.3887,90,90,90 close-packed structure - 17.99 X 7705
Pt-V VPt3 rt TiAl3,tI8,139 I4/mmm 0.3839,0.3839,0.7796,90,90,90 close-packed structure - 18.39 X 7705
Pt-V V0.05 Pt0.95 ht Cu,cF4,225 Fm-3m 0.3916,0.3916,0.3916,90,90,90 close-packed structure - 20.78 X 52524
Pt-V V0.9375Pt0.0625 W,cI2,229 Im-3m 0.3034,0.3034,0.3034,90,90,90 b.c.c. family - 7.13 X 51255
Pt-V V3Pt rt Cr3Si,cP8,223 Pm-3n 0.48155,0.48155,0.48155,90,90,90 Frank-Kasper phase - 10.35 X 19477
Pt-V V3Pt stab Cu3Au,cP4,221 Pm-3m 0.3918,0.3918,0.3918,90,90,90 close-packed structure - 9.61 X 2084
156 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Pt-W WPt2 rt MoPt2,oI6,71 Immm 0.2762,0.3907,0.8251,90,90,90 close-packed structure - 21.41 A 4876


Pt-W W0.5Pt0.5 Cu,cF4,225 Fm-3m 0.39223,0.39223,0.39223,90,90,90 close-packed structure - 20.86 X 48908
Pt-Y YPt FeB-b,oP8,62 Pnma 0.7018,0.4476,0.5547,90,90,90 CrB(TlI)-FeB - 10.83 A 6004
Pt-Y YPt2 MgCu2,cF24,227 Fd-3m 0.75936,0.75936,0.75936,90,90,90 Friauf-Laves phase - 14.54 X 6004
Pt-Y YPt3 Cu3Au,cP4,221 Pm-3m 0.4069,0.4069,0.4069,90,90,90 close-packed structure - 16.62 X 7597
Pt-Y YPt5 *,o*72,* - 0.5239,0.9123,2.6533,90,90,90 - - - N 6004
Pt-Y Y2Pt Co2Si-b,oP12,62 Pnma 0.7141,0.4764,0.8753,90,90,90 - - 8.32 A 11341
Pt-Y Y3Pt Fe3C-b,oP16,62 Pnma 0.7101,0.9584,0.6454,90,90,90 - - 6.98 X 12087
Pt-Y Y5Pt3 Mn5Si3,hP16,193 P63 /mcm 0.837,0.837,0.6276,90,90,120 - - 8.98 A 11341
Pt-Y Y5Pt4 Sm5Ge4,oP36,62 Pnma 0.7458,1.4546,0.7519,90,90,90 - - 9.97 X 11278
Pt-Y Y7Pt3 Th7Fe3,hP20,186 P63 mc 0.9864,0.9864,0.6299,90,90,120 - - 7.56 A 2764
Pt-Yb YbPt FeB-b,oP8,62 Pnma 0.6805,0.4416,0.5492,90,90,90 CrB(TlI)-FeB - 14.82 X 6021
Pt-Yb YbPt2 ht MgCu2,cF24,227 Fd-3m 0.7546,0.7546,0.7546,90,90,90 Friauf-Laves phase - 17.41 X 9108
Pt-Yb YbPt3 Cu3Au,cP4,221 Pm-3m 0.4081,0.4081,0.4081,90,90,90 close-packed structure blue silver 18.53 X 20264
Pt-Yb Yb2Pt PbCl2,oP12,62 Pnma 0.7614,0.44,0.8957,90,90,90 - - 11.98 A 9108
Pt-Yb Yb3Pt4 Pu3Pd4,hR42,148 R-3 1.28687,1.28687,0.5616,90,90,120 b.c.c. family - 16.08 X 55229
Pt-Yb Yb3Pt5 rt *,mS32,12 C12/m1 0.7009,0.8889,0.9488,90,94.8,90 - gray silver - N 20223
Pt-Yb Yb5Pt2 Mn5C2,mS28,15 C12/c1 1.5896,0.6486,0.7576,90,97.62,90 - - 10.77 A 9108
Pt-Yb Yb5Pt3 rt Mn5Si3,hP16,193 P63 /mcm 0.8337,0.8337,0.6251,90,90,120 - - 12.80 A 9108
Pt-Yb Yb5Pt4 Sm5Ge4,oP36,62 Pnma 0.739,1.4319,0.7506,90,90,90 - - 13.76 A 9108
Pt-Yb Yb5Pt9 Yb5Pt9,oS56,65 Cmmm 1.3372,1.3555,0.5654,90,90,90 - - 16.99 X 47376
Pt-Zn ZnPt CuAu,tP2,123 P4/mmm 0.2858,0.2858,0.3465,90,90,90 close-packed structure - 15.28 X 50336
Pt-Zn ZnPt3 rt Cu3Au,cP4,221 Pm-3m 0.3893,0.3893,0.3893,90,90,90 close-packed structure - 18.31 X 449
Pt-Zn Zn0.25Pt0.75 Cu,cF4,225 Fm-3m 0.3964,0.3964,0.3964,90,90,90 close-packed structure - 17.35 X 449
Pt-Zn Zn1.7 Pt ht2 Zn1.7 Pt,hP6,164 P-3m1 0.41113,0.41113,0.27445,90,90,120 - yellowish 12.66 X 449
Pt-Zn Zn10.72Pt2 Zn9(Zn0.5 Fe0.5)2Fe2,cI52,217 I-43m 0.90819,0.90819,0.90819,90,90,90 γ-brass - 9.67 X 40942
Pt-Zn Zn12Pt7 ht1 Zn12Pt7,oP38,55 Pbam 0.694,2.879,0.276,90,90,90 - - 12.95 X 4717
Pt-Zn Zn20.34Pt4.25 Zn20.34Pt4.25 ,cF448,216 F-43m 1.814,1.814,1.814,90,90,90 - - 9.61 X 42253
Pt-Zn Zn20.47Pt5.12 Zn20.47Pt5.12 ,cF464,216 F-43m 1.8091,1.8091,1.8091,90,90,90 - - 10.49 X 42253
Pt-Zn Zn36.17Pt10.83 Zn30(Zn0.56Pt0.44)11Pt6,cF392,216 F-43m 1.81128,1.81128,1.81128,90,90,90 - - 10.01 X 5057
Pt-Zn Zn49Pt29 Zn49Pt29,oS156,38 Amm2 0.279,11.8952,0.698,90,90,90 - golden 12.70 X 46649
Pt-Zr ZrPt ht CsCl,cP2,221 Pm-3m 0.3385,0.3385,0.3385,90,90,90 b.c.c. family - 12.26 X 48579
Pt-Zr ZrPt rt TlI,oS8,63 Cmcm 0.34082,1.03,0.42806,90,90,90 CrB(TlI)-FeB - 12.66 X 48579
Pt-Zr ZrPt3 hex TiNi3,hP16,194 P63 /mmc 0.5644,0.5644,0.9225,90,90,120 close-packed structure - 17.66 A 7864
Pt-Zr ZrPt8 TiPt8,tI18,139 I4/mmm 0.8386,0.8386,0.4027,90,90,90 close-packed structure - 19.37 A 4315
Pt-Zr Zr0.10Pt0.90 Cu,cF4,225 Fm-3m 0.394,0.394,0.394,90,90,90 close-packed structure - 20.06 X 7864
Pt-Zr Zr1.2Pt2.8 Pt+ Cu3Au,cP4,221 Pm-3m 0.4051,0.4051,0.4051,90,90,90 close-packed structure - 16.38 X 48579
Pt-Zr Zr2Pt stab Ti2Ni,cF96,227 Fd-3m 1.2574,1.2574,1.2574,90,90,90 - - 10.09 A 1019
Pt-Zr Zr3Pt4 ht Pu3Pd4,hR42,148 R-3 1.2558,1.2558,0.5545,90,90,120 b.c.c. family - 13.87 X 48579
Pt-Zr Zr3Pt4 lt *,aP28,2 P-1 0.7368,0.7535,1.0527,101.71,97.1,116. - - 14.03 N 48579
Pt-Zr Zr3Pt4 rt *,aP14,2 P-1 0.55212,0.7388,0.7485,111.7,106.481,104.412 - - 14.02 N 48579
Pt-Zr Zr5Pt3 Mn5Si3,hP16,193 P63 /mcm 0.821,0.821,0.5385,90,90,120 - - 11.00 X 52871
Pt-Zr Zr7Pt10 Zr7Ni10,oS68,64 Cmce 1.3087,0.9613,0.9612,90,90,90 - - 14.22 A 48579
Pt-Zr Zr9Pt11 Zr9Ni11,tP44,83 P4/m 1.0356,1.0356,0.6913,90,90,90 - - 13.29 A 50733
Pu-Re PuRe2 MgZn2,hP12,194 P63 /mmc 0.53956,0.53956,0.87228,90,90,120 Friauf-Laves phase - 18.62 A 9493
Pu-Rh PuRh2 MgCu2,cF24,227 Fd-3m 0.7488,0.7488,0.7488,90,90,90 Friauf-Laves phase - 14.23 X 7597
Pu-Rh PuRh3 Cu3Au,cP4,221 Pm-3m 0.404,0.404,0.404,90,90,90 close-packed structure - 13.92 X 5382
Pu-Rh Pu31Rh20 Pu31Pt20,tI204,140 I4/mcm 1.1076,1.1076,3.6933,90,90,90 - - 14.11 X 10411
Pu-Rh Pu5Rh3 Pu5Rh3,tP32,130 P4/ncc 1.0941,1.0941,0.60203,90,90,90 - - 14.09 X 8543
Pu-Rh Pu5Rh4 Sm5Ge4,oP36,62 Pnma 0.7276,1.4332,0.7419,90,90,90 - - 14.01 X 10390
Pu-Ru PuRu CsCl,cP2,221 Pm-3m 0.33635,0.33635,0.33635,90,90,90 b.c.c. family - 15.06 X 3725
Pu-Ru PuRu2 MgCu2,cF24,227 Fd-3m 0.7472,0.7472,0.7472,90,90,90 Friauf-Laves phase - 14.21 X 3725
Pu-Ru Pu3Ru *,oP16,47 Pmmm 0.6216,0.6924,0.8093,90,90,90 - - - N 1858
Pu-Ru Pu5Ru3 W5Si3,tI32,140 I4/mcm 1.0745,1.0745,0.5719,90,90,90 - - 15.32 X 8754
Pu-S PuS NaCl,cF8,225 Fm-3m 0.55437,0.55437,0.55437,90,90,90 rocksalt family yellow 10.76 X 30189
Pu-S PuS1.9 UAs2,tP6,129 P4/nmm 0.3943,0.3943,0.7962,90,90,90 - black 8.18 X 3022
Pu-S PuS2 UAs2,tP6,129 P4/nmm 0.3981,0.3981,0.7962,90,90,90 - - 8.11 A 3163
Pu-S Pu2S3 ht1 *,o**,* - 0.718,1.05,1.298,90,90,90 - - - N 3022
Pu-S Pu2S3 rt *,oP*,* - 0.769,0.841,1.515,90,90,90 - - - N 3022
Pu-S Pu2.67 S4 ht2 Th3P 4,cI28,220 I-43d 0.84584,0.84584,0.84584,90,90,90 - - 8.56 A 4944
Pu-Sb PuSb hp1 CsCl,cP2,221 Pm-3m 0.366,0.366,0.366,90,90,90 b.c.c. family - 12.39 X 23537
Pu-Sb PuSb hp2 CuTi,tP2,123 P4/mmm 0.361,0.361,0.322,90,90,90 b.c.c. family - 14.47 X 23537
Pu-Sb PuSb rt NaCl,cF8,225 Fm-3m 0.62375,0.62375,0.62375,90,90,90 rocksalt family - 10.01 X 23537
Pu-Sb PuSb2 SmSb2,oS24,64 Cmce 0.619,0.605,1.758,90,90,90 - - 9.84 A 10957
Pu-Sb Pu4Sb3 Th3P 4,cI28,220 I-43d 0.92394,0.92394,0.92394,90,90,90 - - 11.30 A 30189
Pu-Sc Sc0.08Pu0.92 ht W,cI2,229 Im-3m 0.3657,0.3657,0.3657,90,90,90 b.c.c. family - 15.49 X 2277
Pu-Sc Sc0.08Pu0.92 stab Cu,cF4,225 Fm-3m 0.4655,0.4655,0.4655,90,90,90 close-packed structure - 15.02 X 2277
Pu-Sc Sc0.41Pu0.59 rt Nd,hP4,194 P63 /mmc 0.331,0.331,1.0715,90,90,120 close-packed structure - 10.61 X 3725
Pu-Se PuSe rt NaCl,cF8,225 Fm-3m 0.57992,0.57992,0.57992,90,90,90 rocksalt family - 11.00 X 30189
Pu-Se PuSe2 Pu+ UAs2,tP6,129 P4/nmm 0.4132,0.4132,0.8343,90,90,90 - - 9.37 A 4944
Pu-Se Pu2Se3 rt Th2S3,oP20,62 Pnma 1.11,0.41,1.132,90,90,90 - - 9.35 A 3022
Pu-Se Pu2.67 Se4 ht Th3P 4,cI28,220 I-43d 0.8802,0.8802,0.8802,90,90,90 - - 9.42 A 4944
Pu-Si PuSi FeB-b,oP8,62 Pnma 0.7933,0.3847,0.5727,90,90,90 CrB(TlI)-FeB - 10.34 A 2702
Pu-Si PuSi1.67 AlB2,hP3,191 P6/mmm 0.3875,0.3875,0.4102,90,90,120 AlB2 family - 9.06 X 2702
Pu-Si PuSi1.86 GdSi1.4 ,oI12,74 Imma 0.3964,0.3978,1.36,90,90,90 - - 9.18 A 2702
Pu-Si PuSi2 ThSi2,tI12,141 I41/amd 0.398,0.398,1.358,90,90,90 - - 9.27 X 311
Pu-Si Pu0.99 Si0.01 ht3 Cu,cF4,225 Fm-3m 0.4626,0.4626,0.4626,90,90,90 close-packed structure - 16.23 X 2702
Pu-Si Pu3Si2 U3Si2,tP10,127 P4/mbm 0.7483,0.7483,0.4048,90,90,90 - - 11.55 A 2702
Handbook of Inorganic Substances – Edition 2015 : Data 157

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Pu-Si Pu5Si3 W5Si3,tI32,140 I4/mcm 1.1409,1.1409,0.5448,90,90,90 - - 12.22 X 2118


Pu-Sm Pu0.1 Sm0.9 rt Sm,hR9,166 R-3m 0.3607,0.3607,2.6068,90,90,120 close-packed structure - 8.13 A 4759
Pu-Sm Pu0.2 Sm0.8 rt Nd,hP4,194 P63/mmc 0.358,0.358,1.1556,90,90,120 close-packed structure - 8.76 X 4759
Pu-Sn PuSn2 HfGa2,tI24,141 I41/amd 0.443,0.443,3.1,90,90,90 close-packed structure - 10.51 A 8332
Pu-Sn PuSn3 Cu3Au,cP4,221 Pm-3m 0.463,0.463,0.463,90,90,90 close-packed structure - 10.04 X 28969
Pu-Te PuTe hp CsCl,cP2,221 Pm-3m 0.357,0.357,0.357,90,90,90 b.c.c. family - 13.56 X 23537
Pu-Te PuTe NaCl,cF8,225 Fm-3m 0.61774,0.61774,0.61774,90,90,90 rocksalt family - 10.47 X 23537
Pu-Te PuTe 2 UAs2,tP6,129 P4/nmm 0.4391,0.4391,0.8938,90,90,90 - - 9.62 A 4944
Pu-Te PuTe 3 NdTe 3,oS16,63 Cmcm 0.4338,2.56,0.4338,90,90,90 - - 8.64 A 9495
Pu-Te Pu2.67 Te4 Th3P 4,cI28,220 I-43d 0.9355,0.9355,0.9355,90,90,90 - - 9.43 A 4944
Pu-Th Th0.55Pu0.45 rt Cu,cF4,225 Fm-3m 0.4956,0.4956,0.4956,90,90,90 close-packed structure - 12.96 X 886
Pu-Th Th3Pu7 *,o*20,* - 0.622,0.709,1.162,90,90,90 - - - N 4148
Pu-U U0.002Pu0.998 ht3 Cu,cF4,225 Fm-3m 0.463,0.463,0.463,90,90,90 close-packed structure - 16.33 X 2277
Pu-U U0.02 Pu0.98 ht1 Pu,mS34,12 C12/m1 1.1818,1.0418,0.7815,90,128.83,90 - - 18.37 X 1817
Pu-U U0.097Pu0.903 ht W,cI2,229 Im-3m 0.3608,0.3608,0.3608,90,90,90 b.c.c. family - 17.21 X 2277
Pu-U U0.4Pu0.6 rt (U0.4 Pu0.6),hR174,166 R-3m 1.50764,1.50764,1.85926,90,90,120 - - 19.08 X 31425
Pu-U U0.85 Pu0.15 ht1 U,tP30,136 P42/mnm 1.061,1.061,0.5605,90,90,90 Frank-Kasper phase - 18.86 A 1116
Pu-U U0.855Pu0.145 rt U,oS4,63 Cmcm 0.28624,0.58561,0.49627,90,90,90 close-packed structure - 19.08 A 1942
Pu-Zn Zn0.0292Pu0.9708 ht3 Cu,cF4,225 Fm-3m 0.4621,0.4621,0.4621,90,90,90 close-packed structure - 16.07 X 1345
Pu-Zn Zn17 Pu2 ht Zn+ Zn17 Th2,hR57,166 R-3m 0.895,0.895,1.31,90,90,120 CaCu5-Zr4Al3 - 8.77 A 3588
Pu-Zn Zn17 Pu2 rt Zn+ Th2Ni17,hP38,194 P63/mmc 0.898,0.898,0.885,90,90,120 CaCu5-Zr4Al3 - 8.59 A 3588
Pu-Zn Zn2Pu MgCu2,cF24,227 Fd-3m 0.776,0.776,0.776,90,90,90 Friauf-Laves phase - 10.65 X 1173
Pu-Zn Zn22 Pu3 Zn22 Ce3,tI100,141 I41/amd 0.885,0.885,2.118,90,90,90 - - 8.69 X 3845
Pu-Zn Zn58 Pu13 Zn58 Gd13,hP142,194 P63/mmc 1.443,1.443,1.414,90,90,120 - - 9.07 X 3381
Pu-Zr Pu0.1 Zr0.9 rt Mg,hP2,194 P63/mmc 0.32351,0.32351,0.51892,90,90,120 close-packed structure - 7.52 X 6203
Pu-Zr Pu0.5 Zr0.5 ht3 Cu,cF4,225 Fm-3m 0.4585,0.4585,0.4585,90,90,90 close-packed structure - 11.55 X 6203
Pu-Zr Pu0.72 Zr2.28 rt Hg2U,hP3,191 P6/mmm 0.5055,0.5055,0.3123,90,90,120 AlB2 family - 9.22 X 1346
Pu-Zr Pu0.80 Zr0.20 ht W,cI2,229 Im-3m 0.3648,0.3648,0.3648,90,90,90 b.c.c. family - 14.60 X 2277
Pu-Zr Pu28 Zr rt Pu28 Zr,tI116,88 I41/a 1.81899,1.81899,0.78576,90,90,90 - - 17.69 X 12081
Pu-Zr Pu4Zr rt *,tP80,130 P4/ncc 1.0893,1.0893,1.4889,90,90,90 - - - N 3586
Ra-S RaS NaCl,cF8,225 Fm-3m 0.6575,0.6575,0.6575,90,90,90 rocksalt family - 6.03 X 4828
Ra-Se RaSe NaCl,cF8,225 Fm-3m 0.68,0.68,0.68,90,90,90 rocksalt family - 6.44 X 4828
Rb-S Rb2S hp1 Cs2S,oP12,62 Pnma 0.8167,0.5101,0.9957,90,90,90 - white 3.25 X 55811
Rb-S Rb2S hp2 Co1.75 Ge,hP6,194 P63/mmc 0.53076,0.53076,0.68061,90,90,120 AlB2 family white 4.06 X 55811
Rb-S Rb2S CaF2 ,cF12,225 Fm-3m 0.7726,0.7726,0.7726,90,90,90 fluorite family white 2.92 X 55811
Rb-S Rb2S2 ht Na2[O2],hP12,189 P-62m 0.887,0.887,0.6071,90,90,120 - yellow 2.83 X 28184
Rb-S Rb2S2 rt Rb2[O2],oI8,71 Immm 0.4994,0.6857,0.8656,90,90,90 - - 2.63 X 28184
Rb-S Rb2S3 K2S3 ,oS20,36 Cmc21 0.7513,1.0375,0.7769,90,90,90 - - 2.93 X 13765
Rb-S Rb2S5 Tl2S5,oP28,19 P212121 0.6633,0.6837,1.7845,90,90,90 - orange red 2.72 X 12844
Rb-Sb RbSb mon LiAs,mP16,14 P121/c1 0.73566,0.71341,1.3793,90,114.28,90 - black 4.17 X 38397
Rb-Sb RbSb orth NaP,oP16,19 P212121 0.7197,0.7315,1.2815,90,90,90 - black 4.08 X 12874
Rb-Sb RbSb2 rt RbSb2,mS12,12 C12/m1 1.403,0.414,0.8557,90,104.45,90 - gray dark 4.54 X 51500
Rb-Sb Rb1.5 Sb0.5 Sb+ NaTl,cF16,227 Fd-3m 0.884,0.884,0.884,90,90,90 b.c.c. family - 3.64 X 1470
Rb-Sb Rb3Sb rt Na3As,hP8,194 P63/mmc 0.6283,0.6283,1.118,90,90,120 - gray dark 3.29 X 1546
Rb-Sb Rb5Sb4 Rb5As4,mS20,12 C12/m1 1.27803,0.57518,1.1631,90,113.701,90 - - 3.88 X 38697
Rb-Se Rb2Se CaF2 ,cF12,225 Fm-3m 0.8019,0.8019,0.8019,90,90,90 fluorite family yellow 3.22 X 11031
Rb-Se Rb2Se 2 Na2[O2],hP12,189 P-62m 0.9305,0.9305,0.6202,90,90,120 - red rusty 3.52 X 28184
Rb-Se Rb2Se 3 K2S3 ,oS20,36 Cmc21 0.7856,1.0858,0.7977,90,90,90 - black 3.98 X 13765
Rb-Se Rb2Se 5 Tl2S5,oP28,19 P212121 0.691,0.7135,1.8299,90,90,90 - black 4.17 X 12844
Rb-Si RbSi hp NaPb,tI64,142 I41/acd 1.083,1.083,1.758,90,90,90 - - 2.93 A 16888
Rb-Si RbSi KGe,cP64,218 P-43n 1.3042,1.3042,1.3042,90,90,90 - black 2.72 X 45829
Rb-Si Rb12 Si17 Rb12 Si17,mP464,14 P121/c1 2.4445,1.4017,4.6038,90,91.32,90 - - 2.53 X 34392
Rb-Si Rb3.075 Si23 rt Na4Si23,cP54,223 Pm-3n 1.02719,1.02719,1.02719,90,90,90 clathrate - 2.78 X 37725
Rb-Sn RbSn NaPb,tI64,142 I41/acd 1.1757,1.1757,1.9215,90,90,90 - gray silver 4.08 X 36763
Rb-Sn Rb12 Sn17 Rb12 Sn17,oP136,19 P212121 1.5041,1.5393,2.1478,90,90,90 - gray dark 4.07 X 41732
Rb-Sn Rb2Sn11 Rb2Sn11,cI592,230 Ia-3d 2.41162,2.41162,2.41162,90,90,90 clathrate black 5.59 X 44784
Rb-Sn Rb4Sn22 ht Cs4Sn22,cP78,223 Pm-3n 1.20645,1.20645,1.20645,90,90,90 - - 5.59 X 50796
Rb-Te RbTe CsTe,oP8,55 Pbam 0.5854,1.1151,0.4821,90,90,90 - black violet4.50 X 32602
Rb-Te RbTe 6 RbTe 6,mS28,15 C12/c1 1.1300,0.7443,1.2702,90,109.37,90 - black 5.61 X 29740
Rb-Te Rb2Te ht1 Co1.75 Ge,hP6,194 P63/mmc 0.6111,0.6111,0.919,90,90,120 AlB2 family - 3.34 X 39713
Rb-Te Rb2Te m CaF2 ,cF12,225 Fm-3m 0.84902,0.84902,0.84902,90,90,90 fluorite family green 3.24 X 39713
Rb-Te Rb2Te rt PbCl2,oP12,62 Pnma 0.8966,0.55715,1.09543,90,90,90 - yellow 3.62 X 39713
Rb-Te Rb2Te 2 m Na2[O2],hP12,189 P-62m 0.9935,0.9935,0.6627,90,90,120 - - 3.75 X 28184
Rb-Te Rb2Te 3 K2Te3,oP20,62 Pnma 1.6109,1.0591,0.4786,90,90,90 - gray 4.50 X 13316
Rb-Te Rb2Te 5 Rb2Te5,mS14,12 C12/m1 1.1633,0.9124,0.5750,90,116.67,90 - gray 4.93 X 16185
Rb-Tl Rb15 Tl27 Rb15 Tl27,hP42,189 P-62m 1.03248,1.03248,1.7558,90,90,120 - - 6.97 X 31609
Rb-Tl Rb8Tl11 K8In11,hR114,167 R-3c 1.028,1.028,5.2305,90,90,120 - - 6.10 X 28222
Rb-Zn RbZn13 NaZn13,cF112,226 Fm-3c 1.24519,1.24519,1.24519,90,90,90 - - 6.44 X 46673
Re-Rh Re0.15 Rh0.85 Cu,cF4,225 Fm-3m 0.38158,0.38158,0.38158,90,90,90 close-packed structure - 13.80 X 56971
Re-Rh Re0.5 Rh0.5 m Mg,hP2,194 P63/mmc 0.273,0.273,0.4354,90,90,120 close-packed structure - 17.08 X 49695
Re-Rh Re0.75 Rh0.25 Mg,hP2,194 P63/mmc 0.2749,0.2749,0.4395,90,90,120 close-packed structure - 19.10 X 49128
Re-Ru Re0.5 Ru0.5 Mg,hP2,194 P63/mmc 0.2735,0.2735,0.4354,90,90,120 close-packed structure - 16.91 X 53539
Re-S ReS2 ReS2,aP24,2 P-1 0.6352,0.6446,1.25982,76.071,89.481,61.03 rheneiite - 7.65 X 31780
Re-Sc ScRe 2 MgZn2,hP12,194 P63/mmc 0.5271,0.5271,0.8592,90,90,120 Friauf-Laves phase - 13.41 X 1895
Re-Sc Sc5Re24 Ti5Re24,cI58,217 I-43m 0.965,0.965,0.965,90,90,90 - - 17.35 X 1895
Re-Se ReSe 2 hp *,hP12,* - 0.33,0.33,2.55,90,90,120 - - - N 9850
Re-Se ReSe 2 ReSe 2,aP12,2 P-1 0.66065,0.67196,0.67272,91.826,104.930,118.937 - - 9.21 X 2523
Re-Si ReSi ht FeSi,cP8,198 P213 0.4775,0.4775,0.4775,90,90,90 - - 13.07 X 686
158 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Re-Si Re0.9 Si0.1 Mg,hP2,194 P63 /mmc 0.2757,0.2757,0.4439,90,90,120 close-packed structure - 19.37 X 15262
Re-Si Re2Si Re2Si,mP24,14 P121/c1 0.64444,0.96019,0.53898,90,94.214,90 close-packed structure - 16.00 X 24870
Re-Si Re4Si7 Re4Si7,mS44,8 C1m1 2.3164,0.31367,0.8288,90,92.77,90 - gray 10.40 X 51944
Re-Sm SmRe2 MgZn2,hP12,194 P63 /mmc 0.5303,0.5303,0.8804,90,90,120 Friauf-Laves phase - 16.20 A 2437
Re-Ta Ta0.01 Re0.99 Mg,hP2,194 P63 /mmc 0.27554,0.27554,0.4446,90,90,120 close-packed structure - 21.15 X 4835
Re-Ta Ta0.25 Re0.75 Mn,cI58,217 I-43m 0.965,0.965,0.965,90,90,90 - - 19.82 A 21127
Re-Ta Ta0.39 Re0.61 m W,cI2,229 Im-3m 0.318,0.318,0.318,90,90,90 b.c.c. family - 19.02 X 24686
Re-Ta Ta0.43 Re0.57 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9771,0.9771,0.5089,90,90,90 Frank-Kasper phase - 18.86 A 8533
Re-Ta Ta0.6 Re0.4 W,cI2,229 Im-3m 0.3175,0.3175,0.3175,90,90,90 b.c.c. family - 18.99 X 21127
Re-Tb TbRe2 MgZn2,hP12,194 P63 /mmc 0.5402,0.5402,0.8819,90,90,120 Friauf-Laves phase - 15.84 A 5527
Re-Tc Re0.5 Tc0.5 Mg,hP2,194 P63 /mmc 0.275,0.275,0.4434,90,90,120 close-packed structure - 16.25 X 1682
Re-Te ReTe2 hp ReS2,aP12,2 P-1 0.6548,0.68682,0.7512,71.363,67.55,64.66 - - 10.58 A 9850
Re-Te Re2Te5 Re2Te5,oP84,61 Pbca 1.2958,1.424,1.3034,90,90,90 Chevrel phase gray 8.37 X 19383
Re-Th ThRe2 MgZn2,hP12,194 P63 /mmc 0.5493,0.5493,0.91019,90,90,120 Friauf-Laves phase - 16.88 A 19158
Re-Ti TiRe CsCl,cP2,221 Pm-3m 0.3118,0.3118,0.3118,90,90,90 b.c.c. family - 12.82 X 4878
Re-Ti Ti0.01 Re0.99 Mg,hP2,194 P63 /mmc 0.27555,0.27555,0.4446,90,90,120 close-packed structure - 21.00 X 4835
Re-Ti Ti5Re24 Ti5Re24,cI58,217 I-43m 0.9609,0.9609,0.9609,90,90,90 - - 17.63 X 703
Re-Tm TmRe2 MgZn2,hP12,194 P63 /mmc 0.5359,0.5359,0.8761,90,90,120 Friauf-Laves phase - 16.50 A 2437
Re-U URe2 ht MgZn2,hP12,194 P63 /mmc 0.5405,0.5405,0.8682,90,90,120 Friauf-Laves phase - 18.46 X 1355
Re-U URe2 rt URe2,oS24,63 Cmcm 0.5600,0.9178,0.8463,90,90,90 Friauf-Laves phase - 18.64 X 1355
Re-V V0.03 Re0.97 Mg,hP2,194 P63 /mmc 0.27541,0.27541,0.4442,90,90,120 close-packed structure - 20.73 X 4835
Re-V V0.24 Re0.76 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.944,0.944,0.489,90,90,90 Frank-Kasper phase - 17.58 X 16019
Re-V V0.8 Re0.2 W,cI2,229 Im-3m 0.3035,0.3035,0.3035,90,90,90 b.c.c. family - 9.27 X 20676
Re-V V1.16 Re2.84 ht Cr3Si,cP8,223 Pm-3n 0.48783,0.48783,0.48783,90,90,90 Frank-Kasper phase - 16.82 X 16019
Re-W W0.25 Re0.75 rt Mn,cI58,217 I-43m 0.95987,0.95987,0.95987,90,90,90 - - 20.22 X 57212
Re-W W0.25 Re0.75 Mg,hP2,194 P63 /mmc 0.277,0.277,0.45207,90,90,120 close-packed structure - 20.52 X 57212
Re-W W0.5 Re0.5 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.96274,0.96274,0.5015,90,90,90 Frank-Kasper phase - 19.83 X 1831
Re-W W0.75 Re0.25 W,cI2,229 Im-3m 0.317,0.317,0.317,90,90,90 b.c.c. family - 19.23 X 24686
Re-W W3Re Cr3Si,cP8,223 Pm-3n 0.50182,0.50182,0.50182,90,90,90 Frank-Kasper phase - 19.39 X 2752
Re-Y YRe2 MgZn2,hP12,194 P63 /mmc 0.5396,0.5396,0.8819,90,90,120 Friauf-Laves phase - 13.78 X 1059
Re-Yb YbRe2 MgZn2,hP12,194 P63 /mmc 0.534,0.534,0.8685,90,90,120 Friauf-Laves phase - 16.89 A 2437
Re-Zr ZrRe2 MgZn2,hP12,194 P63 /mmc 0.526,0.526,0.8621,90,90,120 Friauf-Laves phase - 14.91 A 11853
Re-Zr Zr0.01 Re0.99 Mg,hP2,194 P63 /mmc 0.27557,0.27557,0.44446,90,90,120 close-packed structure - 21.05 X 4835
Re-Zr Zr21Re25 Zr21Re25,hR276,167 R-3c 2.5847,2.5847,0.8771,90,90,120 - - 12.90 X 18808
Re-Zr Zr5Re24 Ti5Re24,cI58,217 I-43m 0.9645,0.9645,0.9645,90,90,90 - - 18.23 A 1145
Rh-Ru Ru0.4 Rh0.6 Cu,cF4,225 Fm-3m 0.3806,0.3806,0.3806,90,90,90 close-packed structure - 12.31 X 17139
Rh-Ru Ru0.5 Rh0.5 Mg,hP2,194 P63 /mmc 0.2712,0.2712,0.4312,90,90,120 close-packed structure - 12.33 X 17139
Rh-S RhS2 FeS2,cP12,205 Pa-3 0.5574,0.5574,0.5574,90,90,90 pyrite-marcasite family - 6.41 A 26
Rh-S Rh17S15 Pd17Se15,cP64,221 Pm-3m 0.9911,0.9911,0.9911,90,90,90 miassite - 7.61 X 1577
Rh-S Rh2S3 Rh2S3,oP20,60 Pbcn 0.8462,0.5985,0.6138,90,90,90 - - 6.45 X 3389
Rh-S Rh3S4 Rh3S4,mS42,12 C12/m1 1.029,1.067,0.6212,90,107.7,90 kingstonite gray silver 6.70 X 38242
Rh-Sb RhSb FeAs,oP8,62 Pnma 0.59718,0.38621,0.63242,90,90,90 AlB2 family - 10.23 X 10325
Rh-Sb RhSb2 rt CoSb2,mP12,14 P121/c1 0.66156,0.65596,0.66858,90,116.821,90 pyrite-marcasite family - 8.89 X 5748
Rh-Sb RhSb3 CoAs3,cI32,204 Im-3 0.92322,0.92322,0.92322,90,90,90 - - 7.90 X 7891
Rh-Sb Rh0.93 Sb0.07 Cu,cF4,225 Fm-3m 0.3852,0.3852,0.3852,90,90,90 close-packed structure - 12.11 X 2028
Rh-Sb Rh2Sb Co2Si-b,oP12,62 Pnma 0.5721,0.4171,0.7928,90,90,90 - - 11.50 X 24329
Rh-Sc ScRh3 Cu3Au,cP4,221 Pm-3m 0.3904,0.3904,0.3904,90,90,90 close-packed structure gray silver 9.87 X 43525
Rh-Sc Sc1.03 Rh0.97 CsCl,cP2,221 Pm-3m 0.32,0.32,0.32,90,90,90 b.c.c. family - 7.41 X 30304
Rh-Sc Sc57Rh13 Sc57Rh13,cP140,200 Pm-3 1.44051,1.44051,1.44051,90,90,90 - - 4.33 X 17804
Rh-Se RhSe ht NiAs,hP4,194 P63 /mmc 0.3642,0.3642,0.5486,90,90,120 AlB2 family - 9.58 X 1128
Rh-Se RhSe1.95 rt IrSe2,oP24,62 Pnma 2.091,0.3709,0.5951,90,90,90 pyrite-marcasite family - 7.39 A 3504
Rh-Se Rh0.74 Se rt *,hP32,* - 0.7296,0.7296,1.0986,90,90,120 - - - N 3504
Rh-Se Rh0.78 Se ht *,hP32,* - 0.73,0.73,1.106,90,90,120 - - - N 3504
Rh-Se Rh0.98 Se2 ht FeS2,cP12,205 Pa-3 0.60153,0.60153,0.60153,90,90,90 pyrite-marcasite family - 7.90 X 12053
Rh-Se Rh2Se3 ht *,o*60,* - 0.6346,1.0992,1.6512,90,90,90 - - - N 3504
Rh-Se Rh2Se3 rt Rh2S3,oP20,60 Pbcn 0.8888,0.6294,0.6423,90,90,90 - - 8.18 A 3389
Rh-Se Rh3Se8 Rh3Se8,hR33,148 R-3 0.84900,0.84900,1.01881,90,90,120 - - 7.37 X 12053
Rh-Si RhSi cub CsCl,cP2,221 Pm-3m 0.2963,0.2963,0.2963,90,90,90 b.c.c. family - 8.36 X 1045
Rh-Si RhSi ht FeSi,cP8,198 P213 0.4674,0.4674,0.4674,90,90,90 - - 8.52 X 2512
Rh-Si RhSi m RhSi,mP8,14 P121/c1 0.45892,0.45728,0.55241,90,116.214,90 - - 8.37 X 30182
Rh-Si RhSi rt FeAs,oP8,62 Pnma 0.5531,0.3063,0.6362,90,90,90 AlB2 family - 8.07 X 13283
Rh-Si Rh0.977 Si0.023 Cu,cF4,225 Fm-3m 0.3797,0.3797,0.3797,90,90,90 close-packed structure - 12.28 X 18089
Rh-Si Rh2Si Co2Si-b,oP12,62 Pnma 0.5408,0.393,0.7383,90,90,90 - - 9.90 X 1848
Rh-Si Rh20Si13 ht Rh20Si13,hP34,176 P63 /m 1.1851,1.1851,0.3623,90,90,120 - - 9.13 X 2516
Rh-Si Rh3Si2 rt Ni2Al3,hP5,164 P-3m1 0.3965,0.3965,0.5051,90,90,120 - - 8.81 X 18089
Rh-Si Rh3Si4 rt Rh3Si4,oP28,62 Pnma 1.8810,0.3614,0.5813,90,90,90 - - 7.08 X 3876
Rh-Si Rh4Si5 rt Rh4Si5,mP18,11 P121/m1 0.5924,0.3508,1.2335,90,100.181,90 - - 7.27 X 3877
Rh-Si Rh5Si3 Rh5Ge3,oP16,55 Pbam 0.5317,1.0131,0.3895,90,90,90 - - 9.48 X 1848
Rh-Sm SmRh CsCl,cP2,221 Pm-3m 0.3466,0.3466,0.3466,90,90,90 b.c.c. family - 10.10 X 7828
Rh-Sm SmRh2 MgCu2,cF24,227 Fd-3m 0.7522,0.7522,0.7522,90,90,90 Friauf-Laves phase - 11.12 X 31717
Rh-Sm SmRh3 rt CeNi3,hP24,194 P63 /mmc 0.5255,0.5255,1.746,90,90,120 Laves-CaCu5 - 10.96 A 7828
Rh-Sm Sm3Rh2 Er3Ni2,hR45,148 R-3 0.8701,0.8701,1.6526,90,90,120 - - 9.06 X 10402
Rh-Sm Sm3.2 Rh0.8 Fe3C-b,oP16,62 Pnma 0.7245,0.9675,0.6368,90,90,90 - - 8.39 A 7828
Rh-Sm Sm5Rh4 Sm5Ge4,oP36,62 Pnma 0.7335,1.467,0.7557,90,90,90 - - 9.51 A 9915
Rh-Sm Sm7Rh3 Th7Fe3,hP20,186 P63 mc 0.9893,0.9893,0.6245,90,90,120 - - 8.54 A 7500
Rh-Sn RhSn FeSi,cP8,198 P213 0.5122,0.5122,0.5122,90,90,90 - - 10.95 X 279
Rh-Sn RhSn2 ht CuAl2,tI12,140 I4/mcm 0.641,0.641,0.5656,90,90,90 - - 9.73 X 6743
Rh-Sn RhSn2 rt RhSn2,tI26,139 I4/mmm 0.4487,0.4487,1.7717,90,90,90 - - 9.51 X 827
Handbook of Inorganic Substances – Edition 2015 : Data 159

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Rh-Sn RhSn3 CoSn3,tI64,142 I41/acd 0.6324,0.6324,3.412,90,90,90 - - 8.94 X 31877


Rh-Sn RhSn4 IrGe 4,hP15,152 P3121 0.6774,0.6774,0.8614,90,90,120 - - 8.41 X 31877
Rh-Sn Rh0.91 Sn0.09 Cu,cF4,225 Fm-3m 0.38447,0.38447,0.38447,90,90,90 close-packed structure - 12.19 X 33133
Rh-Sn Rh1.5 Sn Co1.75 Ge,hP6,194 P63/mmc 0.4331,0.4331,0.5542,90,90,120 AlB2 family - 10.07 X 258
Rh-Sn Rh2Sn Co2Si-b,oP12,62 Pnma 0.552,0.4221,0.8209,90,90,90 - - 11.27 X 1167
Rh-Sr SrRh2 MgCu2,cF24,227 Fd-3m 0.7706,0.7706,0.7706,90,90,90 Friauf-Laves phase - 8.52 X 938
Rh-Ta TaRh2 Co2Si-b,oP12,62 Pnma 0.5454,0.4027,0.8179,90,90,90 - - 14.30 A 2099
Rh-Ta TaRh3 Cu3Au,cP4,221 Pm-3m 0.386,0.386,0.386,90,90,90 close-packed structure - 14.14 X 22377
Rh-Ta Ta0.08 Rh0.92 Cu,cF4,225 Fm-3m 0.382,0.382,0.382,90,90,90 close-packed structure - 13.01 X 22377
Rh-Ta Ta0.7 Rh0.3 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9904,0.9904,0.516,90,90,90 Frank-Kasper phase - 15.51 A 2382
Rh-Ta Ta0.8 Rh1.2 TaIr,oP12,51 Pmma 1.3551,0.2822,0.4742,90,90,90 close-packed structure - 14.74 X 2382
Rh-Tb TbRh CsCl,cP2,221 Pm-3m 0.3417,0.3417,0.3417,90,90,90 b.c.c. family - 10.90 X 2469
Rh-Tb TbRh2 MgCu2,cF24,227 Fd-3m 0.7492,0.7492,0.7492,90,90,90 Friauf-Laves phase - 11.52 X 7828
Rh-Tb TbRh5 ht CaCu5,hP6,191 P6/mmm 0.5134,0.5134,0.429,90,90,120 - - 11.42 X 7828
Rh-Tb Tb3Rh Fe3C-b,oP16,62 Pnma 0.7156,0.9505,0.6308,90,90,90 - - 8.97 A 7828
Rh-Tb Tb3Rh2 Y3Rh2,tI140,140 I4/mcm 1.125,1.125,2.52,90,90,90 - - 9.95 A 9564
Rh-Tb Tb5Rh3 ht Mn5 Si3,hP16,193 P63/mcm 0.8176,0.8176,0.6385,90,90,120 - - 9.91 A 7828
Rh-Tb Tb7Rh3 Th7Fe3,hP20,186 P63mc 0.9789,0.9789,0.6158,90,90,120 - - 9.24 A 7500
Rh-Tc Tc0.045 Rh0.955 Cu,cF4,225 Fm-3m 0.3806,0.3806,0.3806,90,90,90 close-packed structure - 12.37 X 1861
Rh-Tc Tc0.5 Rh0.5 Mg,hP2,194 P63/mmc 0.2727,0.2727,0.4328,90,90,120 close-packed structure - 11.97 X 9260
Rh-Te RhTe rt NiAs,hP4,194 P63/mmc 0.399,0.399,0.566,90,90,120 AlB2 family - 9.81 X 685
Rh-Te RhTe 2 ht CdI2 ,hP3,164 P-3m1 0.392,0.392,0.541,90,90,120 CdI2-PbI2 polytype - 8.26 X 685
Rh-Te Rh0.82 Te2 rt FeS2 ,cP12,205 Pa-3 0.64234,0.64234,0.64234,90,90,90 pyrite-marcasite family white 8.51 X 11161
Rh-Te Rh0.99 Te0.01 Cu,cF4,225 Fm-3m 0.3805,0.3805,0.3805,90,90,90 close-packed structure - 12.44 X 23681
Rh-Te Rh2.30 Te4 rt Cr3S4,mS14,12 C12/m1 1.28297,0.39337,0.6808,90,122.009,90 - - 8.52 X 34482
Rh-Te Rh3Te 2 rt Rh3Te2,oS20,63 Cmcm 0.3697,1.2446,0.7694,90,90,90 - - 10.58 X 2896
Rh-Te Rh3Te 8 Rh3Se8,hR33,148 R-3 0.91443,0.91443,1.09878,90,90,120 - - 8.32 X 11161
Rh-Th ThRh TlI,oS8,63 Cmcm 0.3866,1.124,0.422,90,90,90 CrB(TlI)-FeB - 12.13 X 1583
Rh-Th ThRh2 ht Co1.75Ge,hP6,194 P63/mmc 0.4629,0.4629,0.5849,90,90,120 AlB2 family - 13.40 X 1921
Rh-Th ThRh3 rt Cu3Au,cP4,221 Pm-3m 0.4148,0.4148,0.4148,90,90,90 close-packed structure - 12.58 X 1921
Rh-Th Th3Rh5 *,t**,* - 0.482,0.482,1.46,90,90,90 - - - N 10786
Rh-Th Th7Rh3 Th7Fe3,hP20,186 P63mc 1.0028,1.0028,0.6293,90,90,120 - - 11.71 X 1353
Rh-Ti TiRh ht1 CuTi,tP2,123 P4/mmm 0.2988,0.2988,0.335,90,90,90 b.c.c. family - 8.37 X 21358
Rh-Ti TiRh ht2 CsCl,cP2,221 Pm-3m 0.3126,0.3126,0.3126,90,90,90 b.c.c. family - 8.20 X 21358
Rh-Ti TiRh rt *,mP4,10 P12/m1 0.4178,0.3371,0.4185,90,90.89,90 - - - N 21358
Rh-Ti TiRh3 rt Cu3Au,cP4,221 Pm-3m 0.382,0.382,0.382,90,90,90 close-packed structure - 10.62 X 3295
Rh-Ti Ti0.1 Rh0.9 Cu,cF4,225 Fm-3m 0.3812,0.3812,0.3812,90,90,90 close-packed structure - 11.68 X 3295
Rh-Ti Ti0.75 Rh0.25 ht W,cI2,229 Im-3m 0.3156,0.3156,0.3156,90,90,90 b.c.c. family - 6.51 X 3295
Rh-Ti Ti0.9 Rh1.1 rt *,o**,* - 0.3399,0.4111,0.4154,90,90,90 - - - N 2320
Rh-Ti Ti2Rh rt CuZr2,tI6,139 I4/mmm 0.3078,0.3078,0.9882,90,90,90 close-packed structure - 7.05 A 3251
Rh-Ti Ti3Rh5 Rh5Ge3,oP16,55 Pbam 0.536,1.042,0.408,90,90,90 - - 9.59 X 4872
Rh-Tm TmRh CsCl,cP2,221 Pm-3m 0.3358,0.3358,0.3358,90,90,90 b.c.c. family - 11.92 X 2469
Rh-Tm TmRh2 MgCu2,cF24,227 Fd-3m 0.7416,0.7416,0.7416,90,90,90 Friauf-Laves phase - 12.21 X 3261
Rh-Tm Tm5 Rh3 Mn5 Si3,hP16,193 P63/mcm 0.8058,0.8058,0.6252,90,90,120 - - 10.90 A 15271
Rh-U URh3 Cu3Au,cP4,221 Pm-3m 0.3988,0.3988,0.3988,90,90,90 close-packed structure - 14.31 X 13909
Rh-U U2Rh rt *,mP12,* - 0.518,0.344,1.319,90,96.1,90 - - - N 26464
Rh-V VRh rt VIr,oS8,65 Cmmm 0.578,0.665,0.278,90,90,90 b.c.c. family - 9.56 A 10740
Rh-V VRh3 Cu3Au,cP4,221 Pm-3m 0.3784,0.3784,0.3784,90,90,90 close-packed structure - 11.02 X 10879
Rh-V V0.18 Rh0.82 Cu,cF4,225 Fm-3m 0.3789,0.3789,0.3789,90,90,90 close-packed structure - 11.42 X 10740
Rh-V V0.85 Rh0.15 W,cI2,229 Im-3m 0.3009,0.3009,0.3009,90,90,90 b.c.c. family - 7.16 X 10740
Rh-V V0.96 Rh1.04 CuAu,tP2,123 P4/mmm 0.2749,0.2749,0.3593,90,90,90 close-packed structure - 9.54 X 10879
Rh-V V1.5 Rh2.5 V(V0.5 Rh0.5)Rh2,oS16,63 Cmcm 0.542,0.9276,0.432,90,90,90 - - 10.20 X 7481
Rh-V V3Rh Cr3Si,cP8,223 Pm-3n 0.47852,0.47852,0.47852,90,90,90 Frank-Kasper phase - 7.75 X 3823
Rh-W WRh3 rt Mg3 Cd,hP8,194 P63/mmc 0.5453,0.5453,0.435,90,90,120 close-packed structure - 14.60 A 2443
Rh-W W0.19 Rh0.81 Mg,hP2,194 P63/mmc 0.2708,0.2708,0.4328,90,90,120 close-packed structure - 14.29 X 807
Rh-Y YRh CsCl,cP2,221 Pm-3m 0.3406,0.3406,0.3406,90,90,90 b.c.c. family - 8.06 X 29415
Rh-Y YRh2 MgCu2,cF24,227 Fd-3m 0.7492,0.7492,0.7492,90,90,90 Friauf-Laves phase - 9.31 X 16222
Rh-Y YRh3 rt CeNi3,hP24,194 P63/mmc 0.523,0.523,1.738,90,90,120 Laves-CaCu5 - 9.62 A 7828
Rh-Y YRh5 ht CaCu5,hP6,191 P6/mmm 0.5141,0.5141,0.4294,90,90,120 - - 10.20 X 7828
Rh-Y Y3Rh Fe3C-b,oP16,62 Pnma 0.7138,0.9438,0.6319,90,90,90 - - 5.77 A 6734
Rh-Y Y3Rh2 Y3Rh2,tI140,140 I4/mcm 1.1232,1.1232,2.516,90,90,90 - - 6.92 X 9564
Rh-Y Y7Rh3 Th7Fe3,hP20,186 P63mc 0.9775,0.9775,0.619,90,90,120 - - 6.04 A 6734
Rh-Yb YbRh CsCl,cP2,221 Pm-3m 0.3347,0.3347,0.3347,90,90,90 b.c.c. family - 12.22 X 10149
Rh-Yb YbRh2 MgCu2,cF24,227 Fd-3m 0.7432,0.7432,0.7432,90,90,90 Friauf-Laves phase - 12.26 X 10149
Rh-Zn ZnRh CsCl,cP2,221 Pm-3m 0.29997,0.29997,0.29997,90,90,90 b.c.c. family - 10.35 X 39456
Rh-Zn Zn11 Rh2 Cu5Zn8,cI52,217 I-43m 0.90879,0.90879,0.90879,90,90,90 γ-brass - 8.19 X 39456
Rh-Zn Zn13 Rh Zn13 Co,mS28,12 C12/m1 1.0908,0.7537,0.5127,90,101.02,90 - - 7.65 X 39456
Rh-Zr ZrRh ht1 CsCl,cP2,221 Pm-3m 0.3305,0.3305,0.3305,90,90,90 b.c.c. family - 8.93 X 21296
Rh-Zr ZrRh rt mon ZrIr,oS16,63 Cmcm 0.33394,1.959,0.4394,90,90,90 - - 8.97 X 52482
Rh-Zr ZrRh3 Cu3Au,cP4,221 Pm-3m 0.3905,0.3905,0.3905,90,90,90 close-packed structure - 11.15 X 21581
Rh-Zr Zr0.05 Rh0.95 Cu,cF4,225 Fm-3m 0.383,0.383,0.383,90,90,90 close-packed structure - 12.10 X 13215
Rh-Zr Zr0.5 Rh0.5 ht2 W,cI2,229 Im-3m 0.325,0.325,0.325,90,90,90 b.c.c. family - 9.39 X 13215
Rh-Zr Zr0.915 Rh0.085 ht W,cI2,229 Im-3m 0.354,0.354,0.354,90,90,90 b.c.c. family - 6.90 X 2710
Rh-Zr Zr0.97 Rh0.03 m Ti,hP3,191 P6/mmm 0.5055,0.5055,0.3103,90,90,120 - - 6.64 X 2710
Rh-Zr Zr2Rh stab Ti2Ni,cF96,227 Fd-3m 1.2536,1.2536,1.2536,90,90,90 - - 7.70 A 18013
Rh-Zr Zr2Rh CuAl2,tI12,140 I4/mcm 0.6496,0.6496,0.5605,90,90,90 - - 8.01 X 6743
Rh-Zr Zr3Rh m Ni3P,tI32,82 I-4 1.0802,1.0802,0.5629,90,90,90 - - 7.62 A 18013
Rh-Zr Zr3Rh4 rt Pu3Pd4,hR42,148 R-3 1.25,1.25,0.55,90,90,120 b.c.c. family - 9.17 A 33150
160 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Rh-Zr Zr3Rh5 Pu3Pd5,oS32,63 Cmcm 0.86634,0.6986,0.86218,90,90,90 - - 10.03 X 20956


Ru-S RuS2 FeS2,cP12,205 Pa-3 0.56106,0.56106,0.56106,90,90,90 laurite - 6.21 X 23165
Ru-Sb RuSb FeAs,oP8,62 Pnma 0.59608,0.37023,0.65797,90,90,90 AlB2 family - 10.19 X 10325
Ru-Sb RuSb2 FeAs2,oP6,58 Pnnm 0.59524,0.66737,0.31803,90,90,90 pyrite-marcasite family - 9.06 X 3878
Ru-Sb Ru4Sb12.6 m LaFe4P 12,cI34,204 Im-3 0.9325,0.9325,0.9325,90,90,90 - - 7.94 X 42963
Ru-Sc ScRu CsCl,cP2,221 Pm-3m 0.32,0.32,0.32,90,90,90 b.c.c. family - 7.40 X 30158
Ru-Sc ScRu2 MgZn2,hP12,194 P63 /mmc 0.5119,0.5119,0.8542,90,90,120 Friauf-Laves phase - 8.47 X 1059
Ru-Sc Sc11Ru4 Sc11Ir4,cF120,225 Fm-3m 1.342,1.342,1.342,90,90,90 - - 4.94 A 30158
Ru-Sc Sc2Ru Ti2Ni,cF96,227 Fd-3m 1.23,1.23,1.23,90,90,90 - - 5.45 A 30158
Ru-Sc Sc44Ru7 rt Mg44Rh7,cF408,216 F-43m 2.075,2.075,2.075,90,90,90 - - 3.99 A 30158
Ru-Sc Sc5Ru3 Mn5Si3,hP16,193 P63 /mcm 0.803,0.803,0.548,90,90,120 - - 5.73 A 30158
Ru-Sc Sc57Ru13 Sc57Rh13,cP140,200 Pm-3 1.438,1.438,1.438,90,90,90 - - 4.33 A 30158
Ru-Se RuSe2 FeS2,cP12,205 Pa-3 0.59336,0.59336,0.59336,90,90,90 pyrite-marcasite family - 8.23 X 23165
Ru-Si RuSi Ru+ CsCl,cP2,221 Pm-3m 0.29072,0.29072,0.29072,90,90,90 b.c.c. family - 8.73 X 33624
Ru-Si RuSi Ru- FeSi,cP8,198 P213 0.47059,0.47059,0.47059,90,90,90 - - 8.23 X 33624
Ru-Si Ru2Si ht Co2Si-b,oP12,62 Pnma 0.5279,0.4005,0.7418,90,90,90 - - 9.75 X 1403
Ru-Si Ru2Si3 ht *,t**,* - 0.552,0.552,0.446,90,90,90 chimney-ladder structure - - N 395
Ru-Si Ru2Si3 rt Ru2Ge3,oP40,60 Pbcn 1.10613,0.89518,0.53548,90,90,90 chimney-ladder structure - 7.18 X 33624
Ru-Si Ru4Si3 Ru4Si3,oP28,62 Pnma 0.51875,0.40194,1.7138,90,90,90 - - 9.08 X 33624
Ru-Si Ru5Si3 ht Rh5Ge3,oP16,55 Pbam 0.52457,0.9819,0.40236,90,90,90 - - 9.45 A 22008
Ru-Sm SmRu2 cub MgCu2,cF24,227 Fd-3m 0.7577,0.7577,0.7577,90,90,90 Friauf-Laves phase - 10.77 X 25319
Ru-Sm SmRu2 hex MgZn2,hP12,194 P63 /mmc 0.5287,0.5287,0.894,90,90,120 Friauf-Laves phase - 10.82 A 43086
Ru-Sm Sm0.05 Ru0.95 Mg,hP2,194 P63 /mmc 0.2719,0.2719,0.4297,90,90,120 close-packed structure - 12.50 X 17698
Ru-Sm Sm3Ru Fe3C-b,oP16,62 Pnma 0.7329,0.9477,0.6355,90,90,90 - - 8.31 A 22435
Ru-Sm Sm44Ru25 Y44Ru25,oP276,52 Pnna 2.276,1.509,1.5033,90,90,90 - - 11.76 A 43086
Ru-Sm Sm5Ru2 Mn5C2,mS28,15 C12/c1 1.6045,0.6435,0.7298,90,96.84,90 - - 8.47 A 22435
Ru-Sn RuSn2 ht CuAl2,tI12,140 I4/mcm 0.6389,0.6389,0.5693,90,90,90 - - 9.67 X 31808
Ru-Sn Ru0.98 Sn0.02 Mg,hP2,194 P63 /mmc 0.2712,0.2712,0.4284,90,90,120 close-packed structure - 12.34 X 31808
Ru-Sn Ru2Sn3 rt Ru2Sn3,tP20,116 P-4c2 0.61749,0.61749,0.99159,90,90,90 chimney-ladder structure - 9.81 X 33624
Ru-Sn Ru3Sn7 Ru3Sn7,cI40,229 Im-3m 0.93532,0.93532,0.93532,90,90,90 - gray dark 9.21 X 38452
Ru-Ta TaRu ht1 CuTi,tP2,123 P4/mmm 0.31,0.31,0.334,90,90,90 b.c.c. family - 14.59 X 23496
Ru-Ta TaRu rt *,oS4,65 Cmmm 0.4295,0.4386,0.3394,90,90,90 - - - N 23496
Ru-Ta Ta0.2 Ru0.8 lt Mg,hP2,194 P63 /mmc 0.2737,0.2737,0.4379,90,90,120 close-packed structure - 13.68 X 2042
Ru-Ta Ta0.21 Ru0.79 ht *,h**,* - 0.8766,0.8766,1.349,90,90,120 - - - N 2824
Ru-Ta Ta0.75 Ru0.25 W,cI2,229 Im-3m 0.3215,0.3215,0.3215,90,90,90 b.c.c. family - 16.09 X 2042
Ru-Ta Ta1.24 Ru0.76 ht2 CsCl,cP2,221 Pm-3m 0.3195,0.3195,0.3195,90,90,90 b.c.c. family - 15.34 X 21109
Ru-Tb TbRu2 MgZn2,hP12,194 P63 /mmc 0.5265,0.5265,0.8853,90,90,120 Friauf-Laves phase - 11.28 A 6751
Ru-Tb Tb3Ru Fe3C-b,oP16,62 Pnma 0.7255,0.9222,0.6271,90,90,90 - - 9.15 A 13334
Ru-Tb Tb44Ru25 Y44Ru25,oP276,52 Pnna 2.8023,1.52,1.52,90,90,90 - - 9.77 A 23566
Ru-Tb Tb5Ru2 Mn5C2,mS28,15 C12/c1 1.5745,0.6318,0.7279,90,97.21,90 - - 9.22 A 12457
Ru-Tc Tc0.5 Ru0.5 Mg,hP2,194 P63 /mmc 0.2733,0.2733,0.434,90,90,120 close-packed structure - 11.78 X 9260
Ru-Te RuTe2 ht FeS2,cP12,205 Pa-3 0.6391,0.6391,0.6391,90,90,90 pyrite-marcasite family white 9.07 X 20857
Ru-Te RuTe2 rt FeS2,oP6,58 Pnnm 0.52812,0.63943,0.40085,90,90,90 pyrite-marcasite family black 8.74 X 33768
Ru-Te Ru0.999 Te0.001 Mg,hP2,194 P63 /mmc 0.2705,0.2705,0.4282,90,90,120 close-packed structure - 12.37 X 28998
Ru-Th ThRu TlI,oS8,63 Cmcm 0.3879,1.126,0.4069,90,90,90 CrB(TlI)-FeB - 12.45 A 8284
Ru-Th ThRu2 MgCu2,cF24,227 Fd-3m 0.7652,0.7652,0.7652,90,90,90 Friauf-Laves phase - 12.87 X 15274
Ru-Th Th0.99 Ru0.01 rt Cu,cF4,225 Fm-3m 0.50869,0.50869,0.50869,90,90,90 close-packed structure - 11.64 X 1921
Ru-Th Th7Ru3 Th7Fe3,hP20,186 P63 mc 0.9971,0.9971,0.6288,90,90,120 - golden 11.82 A 8284
Ru-Ti TiRu CsCl,cP2,221 Pm-3m 0.3067,0.3067,0.3067,90,90,90 b.c.c. family - 8.57 X 2043
Ru-Ti Ti0.1 Ru0.9 Mg,hP2,194 P63 /mmc 0.2714,0.2714,0.4316,90,90,120 close-packed structure - 11.55 X 2043
Ru-Ti Ti0.8 Ru0.2 ht W,cI2,229 Im-3m 0.3161,0.3161,0.3161,90,90,90 b.c.c. family - 6.16 X 2043
Ru-Ti Ti0.99 Ru0.01 rt Mg,hP2,194 P63 /mmc 0.2951,0.2951,0.4685,90,90,120 close-packed structure - 4.55 X 2043
Ru-Tm TmRu2 MgZn2,hP12,194 P63 /mmc 0.523,0.523,0.874,90,90,120 Friauf-Laves phase - 11.91 A 3261
Ru-Tm Tm3Ru Fe3C-b,oP16,62 Pnma 0.726,0.8986,0.6173,90,90,90 - - 10.03 A 12457
Ru-Tm Tm3Ru2 Er3Ru2,hP10,176 P63 /m 0.7844,0.7844,0.3919,90,90,120 - - 11.28 A 23566
Ru-Tm Tm5Ru2 Mn5C2,mS28,15 C12/c1 1.5362,0.6152,0.7229,90,97.44,90 - - 10.26 A 12457
Ru-U URu3 Cu3Au,cP4,221 Pm-3m 0.398,0.398,0.398,90,90,90 close-packed structure - 14.26 X 13909
Ru-U U2Ru U2Ru,mS12,12 C12/m1 1.3106,0.3343,0.5202,90,96.16,90 - - 16.92 X 1365
Ru-U U3Ru2 *,cF120,227 Fd-3m 1.2895,1.2895,1.2895,90,90,90 - - - N 4279
Ru-V V0.3 Ru0.7 Mg,hP2,194 P63 /mmc 0.2701,0.2701,0.4313,90,90,120 close-packed structure - 10.49 X 9916
Ru-V V0.8 Ru0.2 W,cI2,229 Im-3m 0.2998,0.2998,0.2998,90,90,90 b.c.c. family - 7.51 X 9916
Ru-V V1.02 Ru0.98 ht CsCl,cP2,221 Pm-3m 0.299,0.299,0.299,90,90,90 b.c.c. family - 9.38 X 6208
Ru-V V1.02 Ru0.98 rt CuTi,tP2,123 P4/mmm 0.2928,0.2928,0.3118,90,90,90 b.c.c. family - 9.38 X 6208
Ru-W W0.4 Ru0.6 Mg,hP2,194 P63 /mmc 0.2751,0.2751,0.441,90,90,120 close-packed structure - 15.42 X 2389
Ru-W W0.6 Ru0.4 ht (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9554,0.9554,0.4972,90,90,90 Frank-Kasper phase - 16.55 A 2389
Ru-W W0.85 Ru0.15 W,cI2,229 Im-3m 0.3157,0.3157,0.3157,90,90,90 b.c.c. family - 18.10 X 2389
Ru-Y YRu2 MgZn2,hP12,194 P63 /mmc 0.5256,0.5256,0.8792,90,90,120 Friauf-Laves phase - 9.19 X 1059
Ru-Y Y0.05 Ru0.95 Mg,hP2,194 P63 /mmc 0.2726,0.2726,0.4308,90,90,120 close-packed structure - 12.03 X 17698
Ru-Y Y3Ru Fe3C-b,oP16,62 Pnma 0.7342,0.9214,0.6333,90,90,90 - - 5.70 A 17698
Ru-Y Y3Ru2 cub *,cI40,* - 0.9854,0.9854,0.9854,90,90,90 - - - N 17698
Ru-Y Y3Ru2 hex Er3Ru2,hP10,176 P63 /m 0.8004,0.8004,0.3998,90,90,120 - - 7.02 A 23566
Ru-Y Y44Ru25 Y44Ru25,oP276,52 Pnna 2.808,1.5195,1.5195,90,90,90 - - 6.60 X 22405
Ru-Y Y5Ru2 Mn5C2,mS28,15 C12/c1 1.577,0.634,0.732,90,97.18,90 - - 5.92 A 17698
Ru-Yb YbRu CsCl,cP2,221 Pm-3m 0.336,0.336,0.336,90,90,90 b.c.c. family - 12.00 X 10149
Ru-Yb YbRu2 MgZn2,hP12,194 P63 /mmc 0.5221,0.5221,0.8746,90,90,120 Friauf-Laves phase - 12.07 A 10149
Ru-Zn Zn0.740 Ru0.260 Mg,hP2,194 P63 /mmc 0.27052,0.27052,0.4286,90,90,120 close-packed structure - 9.13 X 46314
Ru-Zn Zn127.05Ru12.75 *,hP564,194 P63 /mmc 1.2943,1.2943,5.7552,90,90,120 - - - N 47623
Ru-Zn Zn3Ru ZrAl3,tI16,139 I4/mmm 0.37682,0.37682,1.55478,90,90,90 close-packed structure gray 8.94 X 46314
Handbook of Inorganic Substances – Edition 2015 : Data 161

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ru-Zn Zn6Ru Zn6Ru,cP252,213 P4132 1.55575,1.55575,1.55575,90,90,90 - - 7.83 X 5899


Ru-Zr ZrRu CsCl,cP2,221 Pm-3m 0.325,0.325,0.325,90,90,90 b.c.c. family - 9.30 X 2043
Ru-Zr ZrRu2 ht MgZn2,hP12,194 P63/mmc 0.511,0.511,0.844,90,90,120 Friauf-Laves phase - 10.21 A 2043
Ru-Zr Zr0.005 Ru0.995 Mg,hP2,194 P63/mmc 0.27049,0.27049,0.42831,90,90,120 close-packed structure - 12.36 X 635
Ru-Zr Zr0.95 Ru0.05 ht W,cI2,229 Im-3m 0.3557,0.3557,0.3557,90,90,90 b.c.c. family - 6.77 X 35795
Ru-Zr Zr0.99 Ru0.01 rt Mg,hP2,194 P63/mmc 0.3231,0.3231,0.5149,90,90,120 close-packed structure - 6.52 X 35795
S-Sb Sb10 S15 m Sb10 S15,mS104,15 C12/c1 1.3393,1.17170,1.6737,90,93.763,90 - bronze 4.30 X 17835
S-Sb Sb2S3 Sb2S3,oP20,62 Pnma 1.13197,0.38332,1.1233,90,90,90 stibnite - 4.63 X 42697
S-Sc ScS NaCl,cF8,225 Fm-3m 0.5191,0.5191,0.5191,90,90,90 rocksalt family - 3.66 X 8066
S-Sc Sc0.68 S ht1 Sc0.685 S,hR12,166 R-3m 0.3656,0.3656,1.791,90,90,120 - black 3.01 X 2186
S-Sc Sc2S3 rt Sc2S3,oF80,70 Fddd 0.739,1.041,2.205,90,90,90 - yellow 2.91 X 1841
S-Sc Sc2S3 tet *,tI160,* - 0.7348,0.7348,3.117,90,90,90 - - - N 1432
S-Se SeS *,oP64,* - 0.96,1.352,1.453,90,90,90 - red brick - N 11492
S-Se Se0.25 S0.75 8 γ S,mP32,13 P12/c1 0.84354,1.3374,0.9392,90,122.646,90 - orange 2.61 X 12055
S-Se Se0.25 S1.75 Se0.25 S1.75 ,oP24,58 Pnnm 0.4774,0.9193,1.468,90,90,90 - - 2.35 X 7858
S-Se Se0.375 S0.625 Se0.38 S0.62 ,mP64,13 P12/c1 0.83955,1.332,0.928,90,122.403,90 - red bright 3.01 A 6369
S-Se Se0.44 S0.56 hp (Se0.44 S0.56),hP18,144 P31 0.785,0.785,0.462,90,90,120 - - 3.19 X 5337
S-Se Se0.625 S0.375 8 α Se-b,mP32,14 P121/c1 0.8867,0.9113,1.43934,90,127.264,90 - red 3.52 X 12055
S-Se Se0.71 S0.29 Se,hP3,152 P3121 0.437,0.437,0.4954,90,90,120 - - 3.97 A 26301
S-Se Se0.83 S0.17 6 S,hR18,148 R-3 1.1243,1.1243,0.4374,90,90,120 - red dark 4.43 A 18879
S-Se Se5S2 rt Se2(Se 0.62 S0.38)5,oP28,19 P212121 0.4352,1.2924,1.3574,90,90,90 - red dark 3.99 X 18879
S-Si SiS2 hp ZnCl2,tI12,122 I-42d 0.542,0.542,0.8718,90,90,90 - colorless 2.39 X 2784
S-Si SiS2 SiS2 ,oI12,72 Ibam 0.5564,0.9545,0.5552,90,90,90 - colorless 2.08 X 14855
S-Sm SmS hp NaCl,cF8,225 Fm-3m 0.5972,0.5972,0.5972,90,90,90 rocksalt family black 5.69 X 11803
S-Sm SmS1.94 *,c*24,* - 0.796,0.796,0.796,90,90,90 - black - N 1095
S-Sm Sm10 S19 Ce10 Se19,tP58,86 P42/n 0.8818,0.8818,1.5928,90,90,90 - red dark 5.67 X 38270
S-Sm Sm2 S3 rt Cr3C2-b,oP20,62 Pnma 0.73764,0.39744,1.53626,90,90,90 - black red 5.85 X 26957
S-Sm Sm2.667 S4 ht Th3P 4,cI28,220 I-43d 0.84471,0.84471,0.84471,90,90,90 - yellow 5.83 X 26957
S-Sm Sm3 S4 ht Th3P 4,cI28,220 I-43d 0.8523,0.8523,0.8523,90,90,90 - black 6.22 X 11218
S-Sm Sm5 S7 *,tI192,142 I41/acd 1.488,1.488,1.976,90,90,90 - - - N 3985
S-Sn SnS ht1 NaCl,cF8,225 Fm-3m 0.6,0.6,0.6,90,90,90 rocksalt family - 4.64 X 50775
S-Sn SnS ht2 TlI,oS8,63 Cmcm 0.4136,1.1488,0.4172,90,90,90 CrB(TlI)-FeB - 5.05 X 19228
S-Sn SnS rt GeS,oP8,62 Pnma 1.1143,0.3971,0.4336,90,90,90 herzenbergite black 5.22 X 19228
S-Sn SnS tf ZnS,cF8,216 F-43m 0.5783,0.5783,0.5783,90,90,90 adamantane structure - 5.18 X 50775
S-Sn SnS2 10H *,hP15,* - 0.366,0.366,2.9925,90,90,120 - - - N 3120
S-Sn SnS2 18R CdI2 ,hR27,166 R-3m 0.364,0.364,5.3,90,90,120 CdI2-PbI2 polytype - 4.49 A 13524
S-Sn SnS2 2H CdI2 ,hP3,164 P-3m1 0.3616,0.3616,0.568,90,90,120 CdI2-PbI2 polytype yellow 4.72 X 11362
S-Sn SnS2 6H Sb2Te,hP9,164 P-3m1 0.3643,0.3643,1.7683,90,90,120 - - 4.48 A 12486
S-Sn Sn0.93 S1.83 4H Sn0.9 S1.8 ,hP6,156 P3m1 0.36470,0.36470,1.1811,90,90,120 - yellow 4.13 X 23256
S-Sn Sn2S3 rt Sn2S3,oP20,62 Pnma 0.8878,0.3751,1.4020,90,90,90 ottemannite black 4.75 X 14905
S-Sn Sn3S4 *,tP*,* - 0.7488,0.7488,3.3131,90,90,90 - - - N 3120
S-Sr SrS hp CsCl,cP2,221 Pm-3m 0.3372,0.3372,0.3372,90,90,90 b.c.c. family - 5.18 X 18435
S-Sr SrS NaCl,cF8,225 Fm-3m 0.6019,0.6019,0.6019,90,90,90 rocksalt family white 3.65 X 46184
S-Sr SrS2 SrS2 ,tI12,140 I4/mcm 0.6095,0.6095,0.7616,90,90,90 - yellow 3.56 X 9636
S-Sr SrS3 hp BaS3 ,tP8,113 P-421m 0.6708,0.6708,0.3942,90,90,90 - yellow 3.44 A 43002
S-Sr SrS3 SrS3 ,oS16,41 Aea2 0.6982,0.8032,0.7088,90,90,90 - - 3.07 X 8477
S-Ta TaS WC,hP2,187 P-6m2 0.327,0.327,0.3125,90,90,120 AlB2 family - 12.22 X 17411
S-Ta TaS2 3R MoS2,hR9,160 R3m 0.332,0.332,1.79,90,90,120 - - 7.15 X 1683
S-Ta TaS2 lt hex2 TaSe 2,hP12,194 P63/mmc 0.3332,0.3332,2.362,90,90,120 - - 7.17 A 7538
S-Ta TaS2 lt rhom *,hR36,* - 0.3335,0.3335,7.124,90,90,120 - - - N 9383
S-Ta TaS2 lt trig1 CdI2 ,hP3,164 P-3m1 0.335,0.335,0.586,90,90,120 CdI2-PbI2 polytype yellow 7.15 X 605
S-Ta TaS2 rt 6R TaS2 ,hR18,160 R3m 0.3335,0.3335,3.585,90,90,120 - - 7.07 X 1683
S-Ta TaS2 rt NbS2,hP6,194 P63/mmc 0.3314,0.3314,1.2097,90,90,120 - gray 7.07 X 23149
S-Ta TaS3 lt mon NbSe3,mP24,11 P121/m1 0.9515,0.33412,1.46933,90,107.495,90 - black 6.20 X 14363
S-Ta TaS3 lt orth *,oS96,20 C222 1 1.5173,3.6804,0.334,90,90,90 - - - N 2400
S-Ta Ta1.01 S2 Nb1.35 S2,hP8,194 P63/mmc 0.3295,0.3295,1.245,90,90,120 AlB2 family - 7.00 A 1683
S-Ta Ta2S Ta2S,oP36,57 Pbcm 0.7379,0.5574,1.519,90,90,90 - - 12.57 X 4385
S-Ta Ta2.4 S4 Ta2.4 S4,hR21,166 R-3m 0.3315,0.3315,3.62,90,90,120 - - 8.13 X 1683
S-Ta Ta3S2 Ta3S2,oS40,39 Aem2 0.74783,1.7222,0.56051,90,90,90 - black 11.17 X 24635
S-Ta Ta6S ht Ta6S,mS56,15 C12/c1 1.41576,0.52835,1.47885,90,118.010,90 - - 15.20 X 4974
S-Ta Ta6S rt Ta6S,aP14,2 P-1 0.5252,0.7516,0.7536,113.76,98.46,109.15 - - 15.25 X 21321
S-Tb TbS rt NaCl,cF8,225 Fm-3m 0.5518,0.5518,0.5518,90,90,90 rocksalt family - 7.55 X 20081
S-Tb TbS tf NiO,hR6,166 R-3m 0.38856,0.38856,0.96084,90,90,120 - - 7.57 X 12039
S-Tb TbS2 hp1-ht *,c**,* - 0.7815,0.7815,0.7815,90,90,90 - black gray - N 5227
S-Tb TbS2 hp2-ht NdS2,tP24,117 P-4b2 0.7751,0.7751,0.7861,90,90,90 - black gray 6.27 A 5227
S-Tb TbS2 TbS2 ,mP6,11 P121/m1 0.38723,0.38599,0.78872,90,90.10,90 - - 6.28 X 16506
S-Tb Tb10 S19 Ce10 Se19,tP58,86 P42/n 0.86538,0.86538,1.57653,90,90,90 - - 6.18 A 59478
S-Tb Tb2S3 rt orth1 Cr3C2-b,oP20,62 Pnma 0.7319,0.3898,1.5224,90,90,90 - - 6.33 A 20081
S-Tb Tb2S3 rt orth2 Th2S3,oP20,62 Pnma 1.06787,0.38806,1.04907,90,90,90 - - 6.33 X 26972
S-Tb Tb2.67 S4 ht Th3P 4,cI28,220 I-43d 0.83523,0.83523,0.83523,90,90,90 - yellow 6.30 X 35207
S-Tb Tb5S7 Y5S7 ,mS24,12 C12/m1 1.2811,0.3835,1.1638,90,104.21,90 - - 6.11 A 4496
S-Tb Tb8S14.8 Y8S14.8 ,mS174,5 C121 1.5468,1.5844,1.166,90,90.19,90 - red 6.09 X 58282
S-Tc TcS2 TcS2 ,aP12,2 P-1 0.6371,0.6464,0.6654,62.94,76.39,61. - - 5.05 X 31780
S-Te Te0.125 S0.875 8 β lt1 S,mP64,14 P121/c1 1.1131,1.1106,1.0847,90,94.,90 - red 2.62 X 11948
S-Te Te0.5 S3.5 8 γ (Te0.18S0.82 )3S,mP32,13 P12/c1 0.8358,1.3386,0.9368,90,122.45,90 - red dark 2.64 X 11948
S-Te Te7S10 hp *,aP408,1 P1 0.925,3.164,4.149,90.,90.,90. - - - N 4247
S-Th ThS rt NaCl,cF8,225 Fm-3m 0.56851,0.56851,0.56851,90,90,90 rocksalt family gray 9.55 X 19435
S-Th ThS2 PbCl2,oP12,62 Pnma 0.7267,0.4273,0.8615,90,90,90 - brown 7.35 X 17733
162 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

S-Th Th2S3 Th2S3,oP20,62 Pnma 1.08519,0.3958,1.09922,90,90,90 - - 7.88 X 307


S-Th Th2S5 Th2S5,oP28,60 Pbcn 0.7623,1.0141,0.7677,90,90,90 - red brick 6.99 X 14935
S-Th Th7S12 Th7S12,hP20,176 P63 /m 1.1063,1.1063,0.3991,90,90,120 - - 7.89 X 306
S-Ti TiS ht 2H NiAs,hP4,194 P63 /mmc 0.3296,0.3296,0.6398,90,90,120 AlB2 family - 4.41 X 19538
S-Ti TiS0.2 rt Mg,hP2,194 P63 /mmc 0.2971,0.2971,0.48,90,90,120 close-packed structure - 4.92 F 1158
S-Ti TiS2 m Ti2C,cF48,227 Fd-3m 0.97389,0.97389,0.97389,90,90,90 - - 3.22 X 26234
S-Ti TiS2 rt CdI2,hP3,164 P-3m1 0.34097,0.34097,0.57052,90,90,120 CdI2 -PbI2 polytype golden 3.24 X 38959
S-Ti TiS3 TiS3,mP8,11 P121/m1 0.4958,0.34006,0.8778,90,97.32,90 - black 3.26 X 8707
S-Ti Ti0.502 S 2H NiAs,hP4,194 P63 /mmc 0.3407,0.3407,0.5695,90,90,120 AlB2 family - 3.25 X 20329
S-Ti Ti0.508 S Ti+ Cr0.88 S,hP4,164 P-3m1 0.34097,0.34097,0.57052,90,90,120 - - 3.26 X 38959
S-Ti Ti0.56 S Ti0.56 S,hR48,160 R3m 0.341,0.341,6.84,90,90,120 - - 3.41 X 9529
S-Ti Ti0.58 S 48R Ti0.58 S,hR96,160 R3m 0.343,0.343,13.77,90,90,120 - - 3.40 X 7540
S-Ti Ti0.58 S 8H Ti0.58 S,hP16,164 P-3m1 0.342,0.342,2.288,90,90,120 - - 3.43 X 7540
S-Ti Ti0.59 S 12R Sc0.67 Te,hR24,166 R-3m 0.342,0.342,3.432,90,90,120 - - 3.46 X 8826
S-Ti Ti0.59 S 16H Ti0.59 S,hP32,156 P3m1 0.342,0.342,4.592,90,90,120 - - 3.45 X 11140
S-Ti Ti0.59 S 18H Ti0.59 S,hP36,164 P-3m1 0.342,0.342,5.166,90,90,120 - - 3.45 X 11140
S-Ti Ti0.6 S 10H Ti0.60 S,hP20,164 P-3m1 0.342,0.342,2.87,90,90,120 - - 3.47 X 7540
S-Ti Ti0.615 S 4H1 Ti0.62 S,hP8,186 P63 mc 0.34198,0.34198,1.1444,90,90,120 - brass 3.53 X 5435
S-Ti Ti0.625 S 12H Ti0.60 S,hP24,186 P63 mc 0.342,0.342,3.438,90,90,120 - - 3.55 X 5826
S-Ti Ti0.67 S 6R Sc0.685 S,hR12,166 R-3m 0.344,0.344,1.71,90,90,120 - - 3.65 X 13151
S-Ti Ti0.685 S 4H2 Ti0.68 S,mS96,9 C1c1 0.59439,1.0295,2.2858,90,90,90 - - 3.70 X 12826
S-Ti Ti0.744 S 33R Ti0.74 S,hR66,166 R-3m 0.34342,0.34342,9.461,90,90,120 - - 3.84 X 20201
S-Ti Ti0.75 S ht 4H TiP,hP8,194 P63 /mmc 0.3431,0.3431,1.144,90,90,120 - black blue 3.87 X 823
S-Ti Ti0.764 S 18H Ti0.77 S,hP36,194 P63 /mmc 0.34365,0.34365,5.165,90,90,120 - - 3.88 X 20201
S-Ti Ti0.785 S 21R Ti0.79 S,hR42,166 R-3m 0.34354,0.34354,6.0431,90,90,120 - - 3.93 X 20201
S-Ti Ti0.81 S 10H Ti0.81 S,hP20,194 P63 /mmc 0.3439,0.3439,2.893,90,90,120 - - 3.97 X 5471
S-Ti Ti0.93 S ht 9R TiS,hR18,166 R-3m 0.3425,0.3425,2.6493,90,90,120 - gray 4.25 X 973
S-Ti Ti1.25 S0.63 ht WC,hP2,187 P-6m2 0.3273,0.3273,0.3214,90,90,120 AlB2 family - 4.46 X 1158
S-Ti Ti2S Ta2P,oP36,58 Pnnm 1.135,1.406,0.332,90,90,90 - - 4.81 X 3387
S-Ti Ti2S3 4H3 Ti2S3,mS40,9 C1c1 1.0286,0.59383,1.19345,90,106.696,90 - - 3.65 X 12826
S-Ti Ti2S3 mon Ti2S3,mS44,15 C12/c1 0.5951,1.0313,1.156,90,90.,90 - - 3.59 X 15946
S-Ti Ti3S4 2H *,m*14,* - 0.598,0.344,1.014,90,95.67,90 - - - N 1873
S-Ti Ti5S8 V5S8,mS26,12 C12/m1 1.15,0.685,0.82744,90,134.02,90 - - 3.51 A 13486
S-Ti Ti8S3 Ti8S3,mS88,12 C12/m1 2.513,0.3327,1.936,90,123.1,90 - - 4.70 X 7996
S-Tl TlS hp1 Sc0.685 S,hR12,166 R-3m 0.3945,0.3945,2.1788,90,90,120 - - 8.02 A 21720
S-Tl TlS hp3 CsCl,cP2,221 Pm-3m 0.3202,0.3202,0.3202,90,90,90 b.c.c. family - 11.96 X 21720
S-Tl TlS ht TlS,mS256,5 C121 1.1018,1.1039,5.912,90,90.14,90 - - 6.99 X 27812
S-Tl TlS lt TlSe,tI16,140 I4/mcm 0.7785,0.7785,0.6802,90,90,90 - - 7.62 X 29085
S-Tl TlS tet2 TlS,tP64,92 P41212 0.7803,0.7803,2.955,90,90,90 - - 6.98 X 29085
S-Tl TlS tf *,t*176,* - 1.724,1.724,1.525,90,90,90 - - - N 18537
S-Tl TlS2 *,tP1152,137 P42 /nmc 2.317,2.317,5.476,90,90,90 - - - N 5810
S-Tl Tl2S ht *,hP9,* - 0.6142,0.6142,0.821,90,90,120 - - - N 12679
S-Tl Tl2S rt Tl2S,hR81,146 R3 1.215,1.215,1.819,90,90,120 carlinite black 8.50 X 40566
S-Tl Tl2S tet *,t*36,* - 0.7735,0.7735,1.947,90,90,90 - - 7.54 N 18583
S-Tl Tl2S5 orth1 Tl2S5,oP28,19 P212121 0.6538,0.6660,1.670,90,90,90 - pink 5.20 X 8750
S-Tl Tl2S5 orth2 *,oP84,60 Pbcn 2.345,0.8877,1.057,90,90,90 - black - N 672
S-Tl Tl4S3 Tl4S3,mP28,14 P121/c1 0.7757,1.303,0.7972,90,103.99,90 - black 7.76 X 7154
S-Tm TmS NaCl,cF8,225 Fm-3m 0.5417,0.5417,0.5417,90,90,90 rocksalt family golden 8.40 X 12398
S-Tm TmS2 hp1-ht NdS2,tP24,117 P-4b2 0.763,0.763,0.785,90,90,90 - black gray 6.77 A 11830
S-Tm TmS2 hp2-ht *,c**,* - 0.7745,0.7745,0.7745,90,90,90 - black gray - N 5227
S-Tm TmS2 CeSe2,mP12,14 P121/c1 0.77771,0.38456,0.77588,90,90.067,90 - - 6.67 A 57465
S-Tm Tm10S19 Ce10Se19,tP58,86 P42 /n 0.8531,0.8531,1.5563,90,90,90 - - 6.74 X 59478
S-Tm Tm15S22 Tm15S22,mS74,12 C12/m1 3.8395,0.38421,1.1141,90,91.02,90 - black 6.55 X 24834
S-Tm Tm2S3 cub (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.2475,1.2475,1.2475,90,90,90 - - 5.94 X 24027
S-Tm Tm2S3 hp Tm2S3,mP20,11 P121/m1 1.0897,0.39024,1.1162,90,108.87,90 - green 6.42 X 26173
S-Tm Tm2S3 hp1-ht Th2S3,oP20,62 Pnma 1.0479,0.38031,1.036,90,90,90 - brown red 6.98 X 33847
S-Tm Tm2S3 rhom Al2O3,hR30,167 R-3c 0.6768,0.6768,1.8236,90,90,120 - white 5.98 X 23200
S-Tm Tm2S3 rt Ho2S3,mP30,11 P121/m1 1.00626,0.39675,1.7396,90,98.655,90 - gray silver 6.30 X 50110
S-Tm Tm2.67 S4 hp2-ht Th3P 4,cI28,220 I-43d 0.8223,0.8223,0.8223,90,90,90 - amber 6.92 X 23515
S-Tm Tm5S7 Yb5Se7,mS26,12 C12/m1 1.2455,0.37398,1.1268,90,105.45,90 - - 7.02 X 28318
S-Tm Tm8S11 Tm8S11,oS76,63 Cmcm 0.37486,1.26160,3.4932,90,90,90 - black 6.85 X 23589
S-U US lt NiO,hR6,166 R-3m 0.38632,0.38632,0.95595,90,90,120 rocksalt family - 10.89 X 46621
S-U US rt NaCl,cF8,225 Fm-3m 0.5488,0.5488,0.5488,90,90,90 rocksalt family golden 10.85 X 19441
S-U US2 m Fe2P,hP9,189 P-62m 0.7236,0.7236,0.4062,90,90,120 Fe2P family black 8.17 X 32169
S-U US2 PbCl2,oP12,62 Pnma 0.71183,0.41233,0.84869,90,90,90 - black 8.06 X 53018
S-U US3 ZrSe3,mP8,11 P121/m1 0.53738,0.39598,0.9032,90,97.258,90 - black 5.82 X 46039
S-U U2S3 Th2S3,oP20,62 Pnma 1.065,0.389,1.041,90,90,90 - gray 8.81 X 307
S-U U2S5 Th2S5,oP28,60 Pbcn 0.749,0.9931,0.749,90,90,90 - - 7.59 A 13374
S-U U2.75 S5 ht U2.75 S5,tP32,130 P4/ncc 1.0293,1.0293,0.6374,90,90,90 - black gray 8.02 X 17217
S-U U3S5 Yb5Sb3,oP32,62 Pnma 1.174,0.811,0.742,90,90,90 - black 8.22 X 6614
S-U U4S3 U4S3,cP7,221 Pm-3m 0.5494,0.5494,0.5494,90,90,90 - - 10.50 X 187
S-V VS rt FeAs,oP8,62 Pnma 0.5854,0.331,0.5825,90,90,90 AlB2 family - 4.88 X 4841
S-V VS2 stab CdI2,hP3,164 P-3m1 0.322,0.322,0.575,90,90,120 CdI2 -PbI2 polytype - 3.70 A 16440
S-V VS4 VS4,mS40,15 C12/c1 1.272,1.042,0.6780,90,110.8,90 patronite - 2.83 X 2319
S-V V0.59 S ht NiAs,hP4,194 P63 /mmc 0.329,0.329,0.569,90,90,120 AlB2 family - 3.87 X 18272
S-V V0.87 S rt Cr0.88 S,hP4,164 P-3m1 0.3352,0.3352,0.5797,90,90,120 - - 4.50 X 8541
S-V V0.91 S ht NiAs,hP4,194 P63 /mmc 0.334,0.334,0.58,90,90,120 AlB2 family - 4.65 X 32152
S-V V2S3 *,hP*,* - 0.6634,0.6634,2.249,90,90,120 - - - N 17331
Handbook of Inorganic Substances – Edition 2015 : Data 163

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

S-V V3S ht V3S,tI32,121 I-42m 0.9470,0.9470,0.4589,90,90,90 - - 5.97 X 1039


S-V V3S rt V3S,tP32,133 P42/nbc 0.9381,0.9381,0.4663,90,90,90 - - 5.99 X 1039
S-V V3S4 hex Nb3Te4,hP14,176 P63/m 0.9118,0.9118,0.33035,90,90,120 - black 3.92 X 26994
S-V V3S4 rt Cr3S4,mS14,12 C12/m1 1.2638,0.3294,0.5878,90,115.68,90 - gray 4.23 X 30263
S-V V5S4 rt Ti5 Te4,tI18,87 I4/m 0.8981,0.8981,0.3223,90,90,90 Chevrel phase - 4.89 X 8541
S-V V5S8 rt V5S8 ,mS26,12 C12/m1 1.1293,0.6645,0.792,90,134.01,90 - - 3.97 X 9181
S-V V7S8 rt Fe7Se8,hP45,152 P3121 0.6706,0.6706,1.7412,90,90,120 - - 4.50 X 4841
S-W WS2 2H MoS2,hP6,194 P63/mmc 0.31532,0.31532,1.2323,90,90,120 tungstenite 2H black 7.76 X 20408
S-W WS2 3R MoS2,hR9,160 R3m 0.3158,0.3158,1.849,90,90,120 tungstenite 3R - 7.74 X 20408
S-W WS2 m *,o**,* - 0.6465,1.1538,1.232,90,90,90 - - - N 17478
S-W W14 S5 *,o**,* - 0.337,1.848,1.98,90,90,90 - - - N 20370
S-W W21 S8 Nb21 S8,tI58,87 I4/m 1.677,1.677,0.335,90,90,90 - - 14.51 A 20370
S-Y YS NaCl,cF8,225 Fm-3m 0.5466,0.5466,0.5466,90,90,90 rocksalt family red 4.92 X 18903
S-Y YS1.75 hp tet NdS2,tP24,117 P-4b2 0.773,0.773,0.79,90,90,90 - black gray 4.08 A 2197
S-Y YS2 hp cub *,c**,* - 0.7797,0.7797,0.7797,90,90,90 - black gray - N 5227
S-Y Y2S3 hp1-ht Th2S3,oP20,62 Pnma 1.0602,0.3858,1.0436,90,90,90 - - 4.26 A 9490
S-Y Y2S3 Ho2S3,mP30,11 P121/m1 1.01736,0.40107,1.75234,90,98.601,90 - colorless 3.86 X 25911
S-Y Y2.67 S4 hp2-ht Th3P 4,cI28,220 I-43d 0.834,0.834,0.834,90,90,90 - - 4.19 A 26062
S-Y Y5S7 Y5S7 ,mS24,12 C12/m1 1.2768,0.3803,1.1545,90,104.82,90 - - 4.10 X 2532
S-Y Y8S14.8 Y8S14.8 ,mS174,5 C121 1.5386,1.5727,1.1505,90,90.21,90 - red 4.24 X 58282
S-Yb YbS rt NaCl,cF8,225 Fm-3m 0.5687,0.5687,0.5687,90,90,90 rocksalt family - 7.41 X 17457
S-Yb YbS1.7 hp tet1 UAs2,tP6,129 P4/nmm 0.3842,0.3842,0.7747,90,90,90 - - 6.61 X 10118
S-Yb YbS1.7 hp tet2 NdS2,tP24,117 P-4b2 0.7573,0.7573,0.7764,90,90,90 - black gray 6.79 X 10118
S-Yb YbS2 hp cub *,c**,* - 0.7722,0.7722,0.7722,90,90,90 - black gray - N 5227
S-Yb YbS2 BaS2 ,mS12,15 C12/c1 0.9326,0.4754,0.9025,90,118.39,90 - - 4.48 X 8667
S-Yb Yb0.92 S rt Yb0.91 Se,cF64,225 Fm-3m 1.1281,1.1281,1.1281,90,90,90 rocksalt family - 7.08 X 28529
S-Yb Yb2S3 cub (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.24683,1.24683,1.24683,90,90,90 - orange 6.06 X 26173
S-Yb Yb2S3 hp1-ht Th2S3,oP20,62 Pnma 1.0435,0.3786,1.033,90,90,90 - - 7.20 A 9490
S-Yb Yb2S3 mon Ho2S3,mP30,11 P121/m1 1.037,0.406,1.815,90,100.,90 - red 5.86 X 10117
S-Yb Yb2S3 orth *,o**,* - 0.3617,0.6788,0.9981,90,90,90 - - - N 5980
S-Yb Yb2S3 rhom Al2O3,hR30,167 R-3c 0.67405,0.67405,1.8148,90,90,120 - yellow 6.17 X 28417
S-Yb Yb2.67 S4 hp2-ht Th3P 4,cI28,220 I-43d 0.8358,0.8358,0.8358,90,90,90 - - 6.72 A 26062
S-Yb Yb2.9 S4 Yb2.9 S4,oP28,62 Pnma 1.271,0.38,1.288,90,90,90 - - 6.73 X 3473
S-Zn ZnS 102R ZnS,hR204,160 R3m 0.382,0.382,31.926,90,90,120 adamantane structure - 4.09 X 6419
S-Zn ZnS 108R1 ZnS-a,hR216,160 R3m 0.382,0.382,33.804,90,90,120 adamantane structure - 4.09 X 9935
S-Zn ZnS 108R2 ZnS-c,hR216,160 R3m 0.382,0.382,33.804,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 108R3 ZnS-b,hR216,160 R3m 0.382,0.382,33.804,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 10H SiC,hP20,156 P3m1 0.382,0.382,3.113,90,90,120 adamantane structure - 4.11 X 4970
S-Zn ZnS 10H ZnS,hP20,186 P63mc 0.3824,0.3824,3.120,90,90,120 wurtzite 10H brown 4.10 X 1087
S-Zn ZnS 10H2 ZnS,hP20,156 P3m1 0.382,0.382,3.13,90,90,120 adamantane structure - 4.09 X 3325
S-Zn ZnS 114R1 ZnS-a,hR228,160 R3m 0.382,0.382,35.682,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 114R2 ZnS-d,hR228,160 R3m 0.382,0.382,35.682,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 114R3 ZnS-c,hR228,160 R3m 0.382,0.382,35.682,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 114R4 ZnS-b,hR228,160 R3m 0.382,0.382,35.682,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 120R1 ZnS-a,hR240,160 R3m 0.382,0.382,37.56,90,90,120 adamantane structure - 4.09 X 6419
S-Zn ZnS 120R2 ZnS-b,hR240,160 R3m 0.382,0.382,37.56,90,90,120 adamantane structure - 4.09 X 6419
S-Zn ZnS 120R3 ZnS-c,hR240,160 R3m 0.382,0.382,37.56,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 12H ZnS,hP24,186 P63mc 0.382,0.382,3.756,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 12H2 ZnS-b,hP24,156 P3m1 0.382,0.382,3.756,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 12H3 ZnS-c,hP24,156 P3m1 0.382,0.382,3.756,90,90,120 adamantane structure - 4.09 X 4970
S-Zn ZnS 12R ZnS,hR24,160 R3m 0.382,0.382,3.744,90,90,120 adamantane structure brown 4.10 X 1863
S-Zn ZnS 14H ZnS,hP28,186 P63mc 0.382,0.382,4.382,90,90,120 adamantane structure - 4.09 X 3345
S-Zn ZnS 14H1 ZnS-a,hP28,156 P3m1 0.382,0.382,4.382,90,90,120 adamantane structure - 4.09 X 3325
S-Zn ZnS 14H3 ZnS-c,hP28,156 P3m1 0.382,0.382,4.382,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 14H4 ZnS-d,hP28,156 P3m1 0.382,0.382,4.382,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 14H5 ZnS-e,hP28,156 P3m1 0.382,0.382,4.382,90,90,120 adamantane structure - 4.09 X 6861
S-Zn ZnS 14H6 ZnS-f,hP28,156 P3m1 0.382,0.382,4.382,90,90,120 adamantane structure - 4.09 X 6366
S-Zn ZnS 14H7 ZnS-g,hP28,156 P3m1 0.382,0.382,4.382,90,90,120 adamantane structure - 4.09 X 6366
S-Zn ZnS 14H8 ZnS-h,hP28,156 P3m1 0.382,0.382,4.382,90,90,120 adamantane structure - 4.09 X 6366
S-Zn ZnS 15R SiC,hR30,160 R3m 0.3822,0.3822,4.679,90,90,120 wurtzite 15R brown 4.10 X 299
S-Zn ZnS 162R ZnS,hR324,160 R3m 0.382,0.382,50.706,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 16H ZnS,hP32,186 P63mc 0.382,0.382,5.008,90,90,120 adamantane structure - 4.09 X 3346
S-Zn ZnS 16H1 ZnS-a,hP32,156 P3m1 0.382,0.382,5.008,90,90,120 adamantane structure - 4.09 X 3372
S-Zn ZnS 16H2 ZnS-b,hP32,156 P3m1 0.382,0.382,5.008,90,90,120 adamantane structure - 4.09 X 3372
S-Zn ZnS 16H3 ZnS-c,hP32,156 P3m1 0.382,0.382,5.008,90,90,120 adamantane structure - 4.09 X 3372
S-Zn ZnS 18H1 ZnS-a,hP36,156 P3m1 0.382,0.382,5.634,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 18H2 ZnS-b,hP36,156 P3m1 0.382,0.382,5.634,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 18H3 ZnS-c,hP36,156 P3m1 0.382,0.382,5.634,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 18H4 ZnS-d,hP36,156 P3m1 0.382,0.382,5.634,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 18H5 ZnS-e,hP36,156 P3m1 0.382,0.382,5.634,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 18H6 ZnS-f,hP36,156 P3m1 0.382,0.382,5.634,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 18H7 ZnS-g,hP36,156 P3m1 0.382,0.382,5.634,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 18H8 ZnS-h,hP36,156 P3m1 0.382,0.382,5.634,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 18R ZnS,hR36,160 R3m 0.382,0.382,5.634,90,90,120 adamantane structure - 4.09 X 3345
S-Zn ZnS 20H ZnS,hP40,186 P63mc 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 20H1 ZnS-a,hP40,156 P3m1 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 3346
S-Zn ZnS 20H10 ZnS-j,hP40,156 P3m1 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 20H2 ZnS-b,hP40,156 P3m1 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 3346
164 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

S-Zn ZnS 20H3 ZnS-c,hP40,156 P3m1 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 20H4 ZnS-d,hP40,156 P3m1 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 20H5 ZnS-e,hP40,156 P3m1 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 20H7 ZnS-h,hP40,156 P3m1 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 20H8 ZnS-g,hP40,156 P3m1 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 20H9 ZnS-i,hP40,156 P3m1 0.382,0.382,6.26,90,90,120 adamantane structure - 4.09 X 17052
S-Zn ZnS 21R ZnS,hR42,160 R3m 0.382,0.382,6.552,90,90,120 adamantane structure brown 4.10 X 1863
S-Zn ZnS 22H1 ZnS-a,hP44,156 P3m1 0.382,0.382,6.886,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 22H2 ZnS-b,hP44,156 P3m1 0.382,0.382,6.886,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 22H3 ZnS-c,hP44,156 P3m1 0.382,0.382,6.886,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 24H10 ZnS-j,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 24H11 ZnS-k,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 24H12 ZnS-l,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 24H13 ZnS-m,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 24H14 ZnS-n,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 24H3 ZnS-c,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 3829
S-Zn ZnS 24H4 ZnS-d,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 3829
S-Zn ZnS 24H5 ZnS-e,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 3829
S-Zn ZnS 24H6 ZnS-f,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 3829
S-Zn ZnS 24H7 ZnS-g,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 3829
S-Zn ZnS 24H8 ZnS-h,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 3829
S-Zn ZnS 24H9 ZnS-i,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 24R1 ZnS-a,hR48,160 R3m 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 5194
S-Zn ZnS 24R2 ZnS-b,hR48,160 R3m 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 9935
S-Zn ZnS 24R3 SiC,hR48,160 R3m 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 3325
S-Zn ZnS 24T1 ZnS-a,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 3345
S-Zn ZnS 24T2 ZnS-b,hP48,156 P3m1 0.382,0.382,7.512,90,90,120 adamantane structure - 4.09 X 3829
S-Zn ZnS 26H1 ZnS-a,hP52,156 P3m1 0.382,0.382,8.138,90,90,120 adamantane structure - 4.09 X 3325
S-Zn ZnS 26H2 ZnS-b,hP52,156 P3m1 0.382,0.382,8.138,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 26H3 ZnS-c,hP52,156 P3m1 0.382,0.382,8.138,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 26H4 ZnS-d,hP52,156 P3m1 0.382,0.382,8.138,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 26H5 ZnS-e,hP52,156 P3m1 0.382,0.382,8.138,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 28H1 ZnS-a,hP56,156 P3m1 0.382,0.382,8.764,90,90,120 adamantane structure - 4.09 X 3325
S-Zn ZnS 28H2 ZnS-b,hP56,156 P3m1 0.382,0.382,8.764,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 28H3 ZnS-c,hP56,156 P3m1 0.382,0.382,8.764,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 28H4 ZnS-d,hP56,156 P3m1 0.382,0.382,8.764,90,90,120 adamantane structure - 4.09 X 6708
S-Zn ZnS 28H5 ZnS-e,hP56,156 P3m1 0.382,0.382,8.764,90,90,120 adamantane structure - 4.09 X 6708
S-Zn ZnS 28H6 ZnS-f,hP56,156 P3m1 0.382,0.382,8.764,90,90,120 adamantane structure - 4.09 X 6708
S-Zn ZnS 28H7 ZnS-g,hP56,156 P3m1 0.382,0.382,8.764,90,90,120 adamantane structure - 4.09 X 6708
S-Zn ZnS 30R1 ZnS-a,hR60,160 R3m 0.382,0.382,9.39,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 30R2 ZnS-b,hR60,160 R3m 0.382,0.382,9.39,90,90,120 adamantane structure - 4.09 X 4970
S-Zn ZnS 30R3 ZnS-c,hR60,160 R3m 0.382,0.382,9.39,90,90,120 adamantane structure - 4.09 X 4970
S-Zn ZnS 32H1 ZnS-a,hP64,156 P3m1 0.382,0.382,10.016,90,90,120 adamantane structure - 4.09 X 9935
S-Zn ZnS 32H2 ZnS-b,hP64,156 P3m1 0.382,0.382,10.016,90,90,120 adamantane structure - 4.09 X 9935
S-Zn ZnS 34H ZnS,hP68,156 P3m1 0.382,0.382,10.642,90,90,120 adamantane structure - 4.09 X 6419
S-Zn ZnS 36H1 ZnS-a,hP72,156 P3m1 0.382,0.382,11.268,90,90,120 adamantane structure - 4.09 X 9935
S-Zn ZnS 36H2 ZnS-b,hP72,156 P3m1 0.382,0.382,11.268,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 36R1 ZnS-a,hR72,160 R3m 0.382,0.382,11.268,90,90,120 adamantane structure - 4.09 X 3345
S-Zn ZnS 36R2 ZnS-b,hR72,160 R3m 0.382,0.382,11.268,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 36R3 ZnS-c,hR72,160 R3m 0.382,0.382,11.268,90,90,120 adamantane structure - 4.09 X 4377
S-Zn ZnS 36R4 ZnS-d,hR72,160 R3m 0.382,0.382,11.268,90,90,120 adamantane structure - 4.09 X 4377
S-Zn ZnS 36R5 ZnS-e,hR72,160 R3m 0.382,0.382,11.268,90,90,120 adamantane structure - 4.09 X 4377
S-Zn ZnS 36R6 ZnS-f,hR72,160 R3m 0.382,0.382,11.268,90,90,120 adamantane structure - 4.09 X 4377
S-Zn ZnS 40H ZnS,hP80,156 P3m1 0.382,0.382,12.52,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 42R1 ZnS-a,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 42R2 ZnS-k,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 42R3 ZnS-c,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 6861
S-Zn ZnS 42R3 ZnS-i,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 42R4 ZnS-g,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 42R5 ZnS-e,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 6861
S-Zn ZnS 42R5 ZnS-j,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 42R6 ZnS-d,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 4970
S-Zn ZnS 42R6 ZnS-f,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 6366
S-Zn ZnS 42R7 ZnS-b,hR84,160 R3m 0.382,0.382,13.146,90,90,120 adamantane structure - 4.09 X 4970
S-Zn ZnS 44H1 ZnS-a,hP88,156 P3m1 0.382,0.382,13.772,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 44H2 ZnS-b,hP88,156 P3m1 0.382,0.382,13.772,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 48R1 ZnS-a,hR96,160 R3m 0.382,0.382,15.024,90,90,120 adamantane structure - 4.09 X 3346
S-Zn ZnS 48R2 ZnS-b,hR96,160 R3m 0.382,0.382,15.024,90,90,120 adamantane structure - 4.09 X 3346
S-Zn ZnS 48R3 ZnS-c,hR96,160 R3m 0.382,0.382,15.024,90,90,120 adamantane structure - 4.09 X 3346
S-Zn ZnS 48R4 ZnS-d,hR96,160 R3m 0.382,0.382,15.024,90,90,120 adamantane structure - 4.09 X 3346
S-Zn ZnS 48R5 ZnS-e,hR96,160 R3m 0.382,0.382,15.024,90,90,120 adamantane structure - 4.09 X 3372
S-Zn ZnS 48R6 ZnS-f,hR96,160 R3m 0.382,0.382,15.024,90,90,120 adamantane structure - 4.09 X 3372
S-Zn ZnS 48R7 ZnS-g,hR96,160 R3m 0.382,0.382,15.024,90,90,120 adamantane structure - 4.09 X 3372
S-Zn ZnS 48R8 ZnS-i,hR96,160 R3m 0.382,0.382,15.024,90,90,120 adamantane structure - 4.09 X 4970
S-Zn ZnS 48R9 ZnS-h,hR96,160 R3m 0.382,0.382,15.024,90,90,120 adamantane structure - 4.09 X 4970
S-Zn ZnS 4H SiC,hP8,186 P63 mc 0.3822,0.3822,1.2498,90,90,120 wurtzite 4H green pale 4.09 X 53949
S-Zn ZnS 54R1 ZnS-a,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 54R10 ZnS-k,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 15787
Handbook of Inorganic Substances – Edition 2015 : Data 165

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

S-Zn ZnS 54R11 ZnS-h,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 54R2 ZnS-b,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 54R3 ZnS-d,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 54R4 ZnS-c,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 4411
S-Zn ZnS 54R5 ZnS-e,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 54R6 ZnS-f,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 54R7 ZnS-i,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 54R8 ZnS-j,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 54R9 ZnS-g,hR108,160 R3m 0.382,0.382,16.902,90,90,120 adamantane structure - 4.09 X 15787
S-Zn ZnS 60R1 ZnS-a,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 3346
S-Zn ZnS 60R10 ZnS-j,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 60R11 ZnS-k,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 60R12 ZnS-l,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 60R13 ZnS-m,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 60R14 ZnS-n,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4377
S-Zn ZnS 60R15 ZnS-o,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4377
S-Zn ZnS 60R16 ZnS-p,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4970
S-Zn ZnS 60R17 ZnS-q,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4970
S-Zn ZnS 60R18 ZnS-r,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 17052
S-Zn ZnS 60R19 ZnS-s,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 17052
S-Zn ZnS 60R2 ZnS-b,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 3346
S-Zn ZnS 60R3 ZnS-c,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 3346
S-Zn ZnS 60R4 ZnS-d,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 60R5 ZnS-f,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 60R6 ZnS-e,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 60R7 ZnS-g,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 60R8 ZnS-h,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 60R9 ZnS-i,hR120,160 R3m 0.382,0.382,18.78,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 64H ZnS,hP128,156 P3m1 0.382,0.382,20.032,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 66R1 ZnS-a,hR132,160 R3m 0.3823,0.3823,20.648,90,90,120 adamantane structure - 4.09 X 3217
S-Zn ZnS 66R2 ZnS-b,hR132,160 R3m 0.382,0.382,20.658,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 66R3 ZnS-c,hR132,160 R3m 0.382,0.382,20.658,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 66R4 ZnS-d,hR132,160 R3m 0.382,0.382,20.658,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 66R5 ZnS-e,hR132,160 R3m 0.382,0.382,20.658,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 6H SiC,hP12,186 P63mc 0.3821,0.3821,1.873,90,90,120 wurtzite 6H brown 4.10 X 338
S-Zn ZnS 72R1 ZnS-a,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 3829
S-Zn ZnS 72R10 ZnS-j,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 72R11 ZnS-k,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 72R12 ZnS-l,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 72R13 ZnS-m,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 72R14 ZnS-n,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 72R15 ZnS-o,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 72R16 ZnS-p,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 72R17 ZnS-q,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 72R18 ZnS-r,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 72R19 ZnS-s,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 5698
S-Zn ZnS 72R2 ZnS-b,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 3829
S-Zn ZnS 72R20 ZnS-t,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 6365
S-Zn ZnS 72R3 ZnS-c,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 72R4 ZnS-d,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 72R5 ZnS-e,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 72R6 ZnS-f,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 72R7 ZnS-g,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 72R8 ZnS-h,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 72R9 ZnS-i,hR144,160 R3m 0.382,0.382,22.536,90,90,120 adamantane structure - 4.09 X 4412
S-Zn ZnS 78R1 ZnS-a,hR156,160 R3m 0.382,0.382,24.414,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 78R2 ZnS-b,hR156,160 R3m 0.382,0.382,24.414,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 78R3 ZnS-c,hR156,160 R3m 0.382,0.382,24.414,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 78R4 ZnS-d,hR156,160 R3m 0.382,0.382,24.414,90,90,120 adamantane structure - 4.09 X 4365
S-Zn ZnS 78R5 ZnS-f,hR156,160 R3m 0.382,0.382,24.414,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 78R6 ZnS-e,hR156,160 R3m 0.382,0.382,24.414,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 84R0 ZnS-a,hR168,160 R3m 0.382,0.382,26.292,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 84R1 ZnS-b,hR168,160 R3m 0.382,0.382,26.292,90,90,120 adamantane structure - 4.09 X 4376
S-Zn ZnS 84R2 ZnS-c,hR168,160 R3m 0.382,0.382,26.292,90,90,120 adamantane structure - 4.09 X 6762
S-Zn ZnS 84R3 ZnS-d,hR168,160 R3m 0.382,0.382,26.292,90,90,120 adamantane structure - 4.09 X 6708
S-Zn ZnS 84R4 ZnS-e,hR168,160 R3m 0.382,0.382,26.292,90,90,120 adamantane structure - 4.09 X 6708
S-Zn ZnS 8H SiC,hP16,186 P63mc 0.382,0.382,2.496,90,90,120 wurtzite 8H green pale 4.10 X 1087
S-Zn ZnS 8H1 ZnS-a,hP16,156 P3m1 0.382,0.382,2.504,90,90,120 adamantane structure - 4.09 X 9935
S-Zn ZnS 8H2 ZnS-b,hP16,156 P3m1 0.382,0.382,2.504,90,90,120 adamantane structure - 4.09 X 9935
S-Zn ZnS 90R1 ZnS-a,hR180,160 R3m 0.382,0.382,28.17,90,90,120 adamantane structure - 4.09 X 6419
S-Zn ZnS 90R2 ZnS-b,hR180,160 R3m 0.382,0.382,28.17,90,90,120 adamantane structure - 4.09 X 6419
S-Zn ZnS 90R3 ZnS-c,hR180,160 R3m 0.382,0.382,28.17,90,90,120 adamantane structure - 4.09 X 18820
S-Zn ZnS 96R1 ZnS-a,hR192,160 R3m 0.382,0.382,30.048,90,90,120 adamantane structure - 4.09 X 6419
S-Zn ZnS 96R2 ZnS-b,hR192,160 R3m 0.382,0.382,30.048,90,90,120 adamantane structure - 4.09 X 9935
S-Zn ZnS 9R ZnS,hR18,160 R3m 0.382,0.382,2.808,90,90,120 adamantane structure yellow 4.10 X 1863
S-Zn ZnS ht ZnO,hP4,186 P63mc 0.38227,0.38227,0.62607,90,90,120 wurtzite colorless 4.08 X 22085
S-Zn ZnS rt ZnS,cF8,216 F-43m 0.5417,0.5417,0.5417,90,90,90 sphalerite white 4.07 X 32947
S-Zn ZnS2 FeS2 ,cP12,205 Pa-3 0.59542,0.59542,0.59542,90,90,90 pyrite-marcasite family - 4.07 A 4031
166 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

S-Zr ZrS ht NaCl,cF8,225 Fm-3m 0.516,0.516,0.516,90,90,90 rocksalt family golden 5.96 X 4945
S-Zr ZrS rt ZrS,tP4,129 P4/nmm 0.355,0.355,0.631,90,90,90 b.c.c. family - 5.15 X 605
S-Zr ZrS0.67 hex WC,hP2,187 P-6m2 0.3446,0.3446,0.3445,90,90,120 AlB2 family - 5.28 X 19082
S-Zr ZrS1.992 CdI2,hP3,164 P-3m1 0.3661,0.3661,0.5827,90,90,120 CdI2 -PbI2 polytype red 3.81 X 8065
S-Zr ZrS3 ZrSe3,mP8,11 P121/m1 0.51243,0.36244,0.898,90,97.28,90 - orange red 3.76 X 8707
S-Zr Zr0.646 S cub Zr0.65 S,cF64,227 Fd-3m 1.025,1.025,1.025,90,90,90 rocksalt family purple red 4.49 X 5583
S-Zr Zr0.72 S Zr0.77 S,mS32,12 C12/m1 1.035,1.031,0.731,90,134.91,90 - - 4.70 X 4945
S-Zr Zr0.75 S Sc0.685 S,hR12,166 R-3m 0.36295,0.36295,1.7885,90,90,120 - - 4.91 X 20424
S-Zr Zr2S Ta2P,oP36,58 Pnnm 1.234,1.53328,0.352,90,90,90 - - 6.42 X 21355
S-Zr Zr21S8 Nb21S8,tI58,87 I4/m 1.688,1.688,0.342,90,90,90 - - 7.40 A 5911
S-Zr Zr9S2 Zr9S2,tI88,141 I41/amd 0.9752,0.9752,1.9216,90,90,90 - - 6.43 X 6388
Sb-Sc ScSb NaCl,cF8,225 Fm-3m 0.58517,0.58517,0.58517,90,90,90 rocksalt family gray 5.53 X 10332
Sb-Sc Sc2Sb Cu2Sb,tP6,129 P4/nmm 0.4211,0.4211,0.7814,90,90,90 - - 5.07 X 41026
Sb-Sc Sc5Sb3 Yb5Sb3,oP32,62 Pnma 1.10792,0.87126,0.76272,90,90,90 - - 5.32 A 10332
Sb-Se Sb2Se3 rt Sb2S3,oP20,62 Pnma 1.17938,0.39858,1.16478,90,90,90 antimonselite - 5.83 X 18669
Sb-Sm SmSb rt NaCl,cF8,225 Fm-3m 0.6268,0.6268,0.6268,90,90,90 rocksalt family black gray 7.34 X 26007
Sb-Sm SmSb2 SmSb2,oS24,64 Cmce 0.6171,0.6051,1.789,90,90,90 - - 7.83 X 3531
Sb-Sm Sm2Sb La2Sb,tI12,139 I4/mmm 0.44733,0.44733,1.7337,90,90,90 - - 8.09 X 57414
Sb-Sm Sm2Sb5 Dy2Sb5,mP28,11 P121/m1 1.3242,0.42037,1.4856,90,102.574,90 - - 7.49 A 39470
Sb-Sm Sm4Sb3 Th3P 4,cI28,220 I-43d 0.9298,0.9298,0.9298,90,90,90 - gray 7.99 A 40163
Sb-Sm Sm5Sb3 ht *,t**,* - 0.4541,0.4541,1.846,90,90,90 - - - N 26007
Sb-Sm Sm5Sb3 rt Mn5Si3,hP16,193 P63 /mcm 0.9113,0.9113,0.6381,90,90,120 - - 8.09 A 46240
Sb-Sn SnSb hp1 NaCl,cF8,225 Fm-3m 0.612,0.612,0.612,90,90,90 rocksalt family - 6.97 X 6292
Sb-Sn SnSb hp2 CsCl,cP2,221 Pm-3m 0.3502,0.3502,0.3502,90,90,90 b.c.c. family - 9.30 X 6292
Sb-Sn Sn0.121 Sb0.879 As,hR6,166 R-3m 0.42575,0.42575,1.1459,90,90,120 - - 6.72 A 40302
Sb-Sn Sn0.5 Sb0.5 (Sn0.5 Sb0.5),hR6,166 R-3m 0.43258,0.43258,0.53457,90,90,120 stistaite - 13.83 X 45557
Sb-Sn Sn0.8 Sb0.2 rt Sn,tI4,141 I41/amd 0.58646,0.58646,0.31798,90,90,90 - - 7.25 X 25221
Sb-Sr SrSb2 CaSb2,mP6,11 P121/m1 0.4887,0.428,0.94838,90,108.627,90 - gray 5.85 X 10290
Sb-Sr Sr11Sb10 Ho11Ge10,tI84,139 I4/mmm 1.2454,1.2454,1.8066,90,90,90 - - 5.17 X 28423
Sb-Sr Sr16Sb11 Ca16Sb11,tP56,113 P-42 1m 1.29341,1.29341,1.18027,90,90,90 - - 4.61 A 33066
Sb-Sr Sr2Sb La2Sb,tI12,139 I4/mmm 0.5002,0.5002,1.7405,90,90,90 - black 4.53 X 7123
Sb-Sr Sr2Sb3 Sr2Sb3,mP40,14 P121/c1 0.6670,1.2973,1.5208,90,90.09,90 - gray 5.46 X 12857
Sb-Sr Sr5Sb3 hex Mn5Si3,hP16,193 P63 /mcm 0.95037,0.95037,0.74095,90,90,120 - black 4.60 X 22195
Sb-Sr Sr5Sb3 orth Yb5Sb3,oP32,62 Pnma 1.3173,1.0101,0.8734,90,90,90 - gray 4.59 X 27007
Sb-Ta TaSb2 OsGe2,mS12,12 C12/m1 1.02218,0.36447,0.82915,90,120.39,90 - - 10.58 X 2525
Sb-Ta Ta3Sb Cr3Si,cP8,223 Pm-3n 0.5265,0.5265,0.5265,90,90,90 Frank-Kasper phase - 15.12 X 5616
Sb-Ta Ta5Sb4 Ti5 Te4,tI18,87 I4/m 1.02357,1.02357,0.35425,90,90,90 Chevrel phase gray 12.45 X 35480
Sb-Tb TbSb lt NiO,hR6,166 R-3m 0.43546,0.43546,1.06987,90,90,120 - - 7.96 X 12039
Sb-Tb TbSb rt NaCl,cF8,225 Fm-3m 0.6179,0.6179,0.6179,90,90,90 rocksalt family gray 7.90 X 56063
Sb-Tb TbSb2 hp HoSb2,oS6,21 C222 0.3282,0.5903,0.799,90,90,90 - - 8.63 A 4623
Sb-Tb TbSb2 hp-ht SmSb2,oS24,64 Cmce 0.6123,0.5969,1.772,90,90,90 - - 8.25 A 4623
Sb-Tb Tb2Sb5 Dy2Sb5,mP28,11 P121/m1 1.31108,0.41698,1.4649,90,102.344,90 - - 7.87 X 50359
Sb-Tb Tb4Sb3 rt Th3P 4,cI28,220 I-43d 0.91518,0.91518,0.91518,90,90,90 - - 8.67 X 50558
Sb-Tb Tb5Sb3 Mn5Si3,hP16,193 P63 /mcm 0.89324,0.89324,0.62887,90,90,120 - - 8.86 X 19619
Sb-Te SbTe BiSe,hP12,164 P-3m1 0.426,0.426,2.39,90,90,120 - - 6.61 X 3647
Sb-Te Sb0.4 Te0.6 hp3 Te,mS6,12 C12/m1 0.81899,0.46256,0.37174,90,91.14,90 - - 8.86 X 59181
Sb-Te Sb0.4 Te0.6 hp4 W,cI2,229 Im-3m 0.3406,0.3406,0.3406,90,90,90 b.c.c. family - 10.53 X 58643
Sb-Te Sb0.5 Te0.5 m As,hR6,166 R-3m 0.424,0.424,1.18,90,90,120 - - 6.76 A 17007
Sb-Te Sb0.87 Te0.13 (Sn0.5 Sb0.5),hR3,166 R-3m 0.43181,0.43181,0.57267,90,90,120 - - 6.60 X 57781
Sb-Te Sb10Te3 Sb10Te3,hR39,166 R-3m 0.4289,0.4289,7.551,90,90,120 - gray dark 6.63 X 54419
Sb-Te Sb16Te3 Sb16Te3,hR57,166 R-3m 0.42817,0.42817,10.87017,90,90,120 - - 6.73 X 44379
Sb-Te Sb2Te Sb2Te,hP9,164 P-3m1 0.4272,0.4272,1.7633,90,90,120 - - 6.63 X 24357
Sb-Te Sb2Te3 hp1 Bi2Te3,mS20,12 C12/m1 1.43717,0.40138,0.87763,90,91.931,90 - - 8.22 X 59181
Sb-Te Sb2Te3 hp2 Bi2Te3,mS20,15 C12/c1 0.9706,0.6704,0.74799,90,109.744,90 - - 9.08 X 58643
Sb-Te Sb2Te3 Bi2Te3,hR15,166 R-3m 0.4183,0.4183,2.946,90,90,120 tellurantimony yellow 6.99 X 58643
Sb-Te Sb4Te3 Sb4Te3,hR42,166 R-3m 0.42754,0.42754,8.3564,90,90,120 - - 6.55 X 44427
Sb-Te Sb5Te3 *,hR48,166 R-3m 0.426,0.426,9.481,90,90,120 - - - N 37917
Sb-Te Sb8Te3 Sb8Te3,hR33,166 R-3m 0.42712,0.42712,6.38957,90,90,120 - - 6.70 X 44379
Sb-Te Sb8Te9 Bi8Se9,hR51,166 R-3m 0.42738,0.42738,10.2689,90,90,120 - - 6.51 X 44427
Sb-Th ThSb hp CsCl,cP2,221 Pm-3m 0.3847,0.3847,0.3847,90,90,90 b.c.c. family - 10.32 X 21157
Sb-Th ThSb rt NaCl,cF8,225 Fm-3m 0.6318,0.6318,0.6318,90,90,90 rocksalt family - 9.32 X 21157
Sb-Th ThSb2 UAs2,tP6,129 P4/nmm 0.4353,0.4353,0.9172,90,90,90 - - 9.09 X 750
Sb-Th Th3Sb4 Th3P 4,cI28,220 I-43d 0.9372,0.9372,0.9372,90,90,90 - - 9.55 X 750
Sb-Ti TiSb NiAs,hP4,194 P63 /mmc 0.4123,0.4123,0.6265,90,90,120 AlB2 family gray 6.11 X 43115
Sb-Ti TiSb2 CuAl2,tI12,140 I4/mcm 0.666,0.666,0.5818,90,90,90 - - 7.50 X 48451
Sb-Ti Ti10.84 Sb7.73 Cr11Ge8,oP76,62 Pnma 1.46228,0.55972,1.7644,90,90,90 - gray 6.72 X 41388
Sb-Ti Ti2Sb Ti2Bi,tI12,139 I4/mmm 0.39568,0.39568,1.45669,90,90,90 - black 6.34 A 54550
Sb-Ti Ti3Sb cub Cr3Si,cP8,223 Pm-3n 0.5236,0.5236,0.5236,90,90,90 Frank-Kasper phase gray 6.14 X 54550
Sb-Ti Ti3Sb tet Ti3Sb,tI32,140 I4/mcm 1.0465,1.0465,0.52639,90,90,90 - - 6.12 X 1628
Sb-Ti Ti3.2 Sb0.8 Mg3Cd,hP8,194 P63 /mmc 0.5958,0.5958,0.4808,90,90,120 close-packed structure - 5.63 X 393
Sb-Ti Ti4.80 Sb3.29 Ti5Ga4,hP18,193 P63 /mcm 0.7982,0.7982,0.5515,90,90,120 AlB2 family - 6.88 X 39505
Sb-Ti Ti5Sb3 Yb5Sb3,oP32,62 Pnma 1.02173,0.83281,0.71459,90,90,90 - gray 6.61 X 10339
Sb-Tl Tl0.9 Sb0.1 hp Cu,cF4,225 Fm-3m 0.48602,0.48602,0.48602,90,90,90 close-packed structure - 11.35 X 1266
Sb-Tl Tl0.988 Sb0.012 rt Mg,hP2,194 P63 /mmc 0.34622,0.34622,0.55408,90,90,120 close-packed structure - 11.74 X 1266
Sb-Tl Tl1.38 Sb0.62 ht CsCl,cP2,221 Pm-3m 0.385,0.385,0.385,90,90,90 b.c.c. family - 10.40 X 15
Sb-Tl Tl7Sb2 rt Tl7Sb2,cI54,229 Im-3m 1.1618,1.1618,1.1618,90,90,90 b.c.c. family - 10.64 X 10574
Sb-Tm TmSb rt NaCl,cF8,225 Fm-3m 0.6079,0.6079,0.6079,90,90,90 rocksalt family gray 8.60 X 30408
Sb-Tm TmSb2 hp-ht HoSb2,oS6,21 C222 0.3252,0.5851,0.7912,90,90,90 - - 9.10 A 4623
Handbook of Inorganic Substances – Edition 2015 : Data 167

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Sb-Tm Tm3 Sb Ti3P,tP32,86 P42/n 1.22294,1.22294,0.59852,90,90,90 - - 9.33 X 48402


Sb-Tm Tm5 Sb3 ht Yb5Sb3,oP32,62 Pnma 1.16034,0.91077,0.79841,90,90,90 - - 9.52 X 52282
Sb-Tm Tm5 Sb3 rt Y5Bi3,oP32,62 Pnma 0.79262,0.91375,1.16013,90,90,90 - - 9.56 X 52282
Sb-U USb hp CsCl,cP2,221 Pm-3m 0.3732,0.3732,0.3732,90,90,90 b.c.c. family - 11.49 X 23434
Sb-U USb NaCl,cF8,225 Fm-3m 0.6191,0.6191,0.6191,90,90,90 rocksalt family - 10.07 X 13620
Sb-U USb2 UAs2,tP6,129 P4/nmm 0.4272,0.4272,0.8741,90,90,90 - - 10.03 X 3703
Sb-U USbx Cu,cF4,225 Fm-3m 0.489,0.489,0.489,90,90,90 close-packed structure - 13.52 X 7286
Sb-U U3Sb4 Th3P 4,cI28,220 I-43d 0.9091,0.9091,0.9091,90,90,90 - - 10.62 X 9267
Sb-U U5Sb4 Ti5Ga4,hP18,193 P63/mcm 0.9237,0.9237,0.6211,90,90,120 AlB2 family - 12.14 A 30189
Sb-V VSb NiAs,hP4,194 P63/mmc 0.4266,0.4266,0.5448,90,90,120 AlB2 family - 6.68 X 48502
Sb-V V0.96 Sb2 ht CuAl2,tI12,140 I4/mcm 0.6562,0.6562,0.5643,90,90,90 - - 7.99 X 48451
Sb-V V1.4 Sb ht Co1.75 Ge,hP6,194 P63/mmc 0.429,0.429,0.5447,90,90,120 AlB2 family - 7.39 X 7587
Sb-V V3Sb Cr3Si,cP8,223 Pm-3n 0.494,0.494,0.494,90,90,90 Frank-Kasper phase - 7.56 X 11167
Sb-V V3Sb2 rt Fe3Sn2,hR30,166 R-3m 0.5551,0.5551,2.035,90,90,120 - - 7.27 X 10557
Sb-V V5Sb4 Ti5 Te4,tI18,87 I4/m 0.9581,0.9581,0.3559,90,90,90 Chevrel phase - 7.54 X 45006
Sb-V V7.5 Sb9 V7.5 Sb9,tP34,129 P4/nmm 0.95866,0.95866,0.70474,90,90,90 - - 7.58 X 29743
Sb-Y YSb NaCl,cF8,225 Fm-3m 0.619,0.619,0.619,90,90,90 rocksalt family gray 5.90 X 23590
Sb-Y YSb2 hp HoSb2,oS6,21 C222 0.3283,0.5907,0.7981,90,90,90 - - 7.13 A 4623
Sb-Y Y3Sb Ti3P,tP32,86 P42/n 1.2358,1.2358,0.6176,90,90,90 - - 5.47 A 43129
Sb-Y Y4Sb3 ht Th3P 4,cI28,220 I-43d 0.9139,0.9139,0.9139,90,90,90 - gray 6.27 A 5323
Sb-Y Y5Sb3 hex Mn5 Si3,hP16,193 P63/mcm 0.8878,0.8878,0.6254,90,90,120 - - 6.30 A 41647
Sb-Y Y5Sb3 orth Yb5Sb3,oP32,62 Pnma 1.1867,0.92247,0.80977,90,90,90 - - 6.07 A 38831
Sb-Yb YbSb rt NaCl,cF8,225 Fm-3m 0.6082,0.6082,0.6082,90,90,90 rocksalt family gray 8.70 X 30409
Sb-Yb YbSb2 ZrSi2,oS12,63 Cmcm 0.4536,1.663,0.4271,90,90,90 close-packed structure - 8.59 X 3066
Sb-Yb Yb11 Sb10 rt Ho11 Ge10,tI84,139 I4/mmm 1.186,1.186,1.71,90,90,90 - - 8.62 X 5235
Sb-Yb Yb16 Sb11 Ca16 Sb11,tP56,113 P-421m 1.21686,1.21686,1.132,90,90,90 - - 8.14 A 33066
Sb-Yb Yb4Sb3 Th3P 4,cI28,220 I-43d 0.932,0.932,0.932,90,90,90 - - 8.68 X 3534
Sb-Yb Yb5Sb3 (H) Yb5Sb3,oP32,62 Pnma 1.2398,0.9562,0.8246,90,90,90 - - 8.36 X 5931
Sb-Yb Yb5Sb3 ht Mn5 Si3,hP16,193 P63/mcm 0.90366,0.90366,0.69044,90,90,120 - - 8.37 X 46240
Sb-Yb Yb5Sb4 ht *,oP108,62 Pnma 0.813,1.597,2.439,90,90,90 - - - N 3534
Sb-Zn Zn0.40 Sb0.60 hp *,o*4,* - 0.282,0.325,0.506,90,90,90 - - - N 20743
Sb-Zn Zn0.96 Sb CdSb,oP16,61 Pbca 0.62501,0.77758,0.81188,90,90,90 - - 6.21 X 42799
Sb-Zn Zn1.077 Sb Zn1.077 Sb,aP60,2 P-1 0.781,1.531,1.551,119.4,91.13,90.58 - - 5.14 X 54471
Sb-Zn Zn13 Sb10 lt Zn13 Sb10,aP98,2 P-1 1.0874,1.2237,1.73522,110.316,98.445,90. - - 6.42 X 48241
Sb-Zn Zn13 Sb10 Zn13 Sb10,aP92,2 P-1 1.0862,1.22369,1.73806,110.611,98.205,90. - - 6.43 X 43054
Sb-Zn Zn2.66 Sb2 ht2 Zn2.66 Sb2,oP192,56 Pccn 1.5398,2.506,0.7283,90,90,90 - - 5.92 X 43162
Sb-Zn Zn3Sb2 ht1 *,oP30,59 Pmmn 0.7322,0.8032,1.134,90,90,90 - - - N 5273
Sb-Zn Zn5.38 Sb5 rt Zn5.38 Sb5,hR66,167 R-3c 1.22288,1.22288,1.2422,90,90,120 - - 5.95 X 42799
Sb-Zn Zn6Sb5 lt1 Zn6Sb5,mS68,15 C12/c1 1.0878,1.2225,0.8185,90,100.044,90 - - 6.20 X 46265
Sb-Zn Zn6.67 Sb5 rt Zn+ Zn6.67 Sb5,hR174,167 R-3c 1.2221,1.2221,1.23976,90,90,120 - - 6.49 X 53975
Sb-Zr ZrSb FeSi,cP8,198 P213 0.56358,0.56358,0.56358,90,90,90 - - 7.90 A 21474
Sb-Zr ZrSb ZrSb,oS24,63 Cmcm 0.3827,1.0426,1.4007,90,90,90 - - 7.59 X 21475
Sb-Zr ZrSb1.96 rt Zr+ PbCl2,oP12,62 Pnma 0.7393,0.3987,0.9581,90,90,90 - - 7.76 X 21475
Sb-Zr ZrSb2 ht TiAs2,oP24,58 Pnnm 0.994,1.498,0.386,90,90,90 - - 7.74 X 4309
Sb-Zr Zr11 Sb18 Zr11 Sb18,tI116,122 I-42d 0.67694,0.67694,6.0073,90,90,90 - black 7.71 X 40062
Sb-Zr Zr2Sb ht *,oP48,* - 0.7756,0.9058,1.4652,90,90,90 - - - N 21474
Sb-Zr Zr2Sb rt La2Sb,tI12,139 I4/mmm 0.41172,0.41172,1.5771,90,90,90 - - 7.56 A 21474
Sb-Zr Zr2Sb tet2 *,tP*,75 P4 0.6497,0.6497,0.7871,90,90,90 - - - N 40151
Sb-Zr Zr3Sb Ni3P,tI32,82 I-4 1.1329,1.1329,0.5656,90,90,90 - - 7.24 A 40151
Sb-Zr Zr5Sb3 ht Y5Bi3,oP32,62 Pnma 0.7465,0.8801,1.0865,90,90,90 - - 7.64 X 21170
Sb-Zr Zr5Sb3.16 rt Ti5Ga4,hP18,193 P63/mcm 0.84267,0.84267,0.57856,90,90,120 AlB2 family - 7.85 X 21170
Sb-Zr Zr7Sb4 (Hf0.86 Ti0.14)7Sb4,mP44,14 P121/c1 0.84905,1.11557,1.11217,90,111.443,90 - - 7.62 X 42991
Sc-Se ScSe ht NaCl,cF8,225 Fm-3m 0.5437,0.5437,0.5437,90,90,90 rocksalt family - 5.12 X 15931
Sc-Se Sc2Se3 ht Sc2S3,oF80,70 Fddd 0.7668,1.0846,2.3004,90,90,90 - brown red 4.54 X 2549
Sc-Si ScSi TlI,oS8,63 Cmcm 0.3988,0.9882,0.3659,90,90,90 CrB(TlI)-FeB gray silver 3.36 X 2482
Sc-Si ScSi1.22 *,o**,* - 0.827,0.869,0.998,90,90,90 - - - N 28740
Sc-Si ScSi2 ht AlB2 ,hP3,191 P6/mmm 0.366,0.366,0.387,90,90,120 AlB2 family gray 3.74 X 19641
Sc-Si Sc5Si3 Mn5 Si3,hP16,193 P63/mcm 0.7861,0.7861,0.5818,90,90,120 - - 3.30 X 1578
Sc-Si Sc5Si4 Sm5 Ge4,oP36,62 Pnma 0.678,1.311,0.703,90,90,90 - gray dark 3.58 A 28740
Sc-Sn ScSn CsCl,cP2,221 Pm-3m 0.3666,0.3666,0.3666,90,90,90 b.c.c. family - 5.52 X 29479
Sc-Sn ScSn2 ScSn2,tI24,141 I41/amd 0.4233,0.4233,3.1039,90,90,90 - - 6.74 X 29776
Sc-Sn Sc5Sn3 Mn5 Si3,hP16,193 P63/mcm 0.835,0.835,0.6055,90,90,120 - gray 5.28 X 33904
Sc-Sn Sc6Sn5 V6Si5,oI44,72 Ibam 0.883,1.9045,0.6057,90,90,90 - - 5.63 A 30197
Sc-Tc ScTc 2 MgZn2,hP12,194 P63/mmc 0.5224,0.5224,0.857,90,90,120 Friauf-Laves phase - 7.90 A 14287
Sc-Tc Sc0.125 Tc0.875 Mn,cI58,217 I-43m 0.9509,0.9509,0.9509,90,90,90 - - 10.24 A 1490
Sc-Te ScTe hex1 NiAs,hP4,194 P63/mmc 0.4122,0.4122,0.6735,90,90,120 AlB2 family - 5.78 X 15931
Sc-Te ScTe hex2 TiP,hP8,194 P63/mmc 0.40969,0.40969,1.3602,90,90,120 - black 5.80 X 55665
Sc-Te Sc0.67 Te Sc0.67 Te,hR24,166 R-3m 0.4109,0.4109,4.059,90,90,120 - gray 5.30 X 2608
Sc-Te Sc2Te Sc2Te,oP36,62 Pnma 2.0178,0.39186,1.0675,90,90,90 - - 5.14 X 32847
Sc-Te Sc2Te 3 cub *,cF*,* - 0.5817,0.5817,0.5817,90,90,90 - - - N 1432
Sc-Te Sc2Te 3 orth Sc2S3,oF80,70 Fddd 0.82223,1.16292,2.46085,90,90,90 - black 5.34 X 45978
Sc-Te Sc8Te 3 Ti8S3,mS88,12 C12/m1 2.8842,0.38517,2.2352,90,122.51,90 - black 4.71 X 34383
Sc-Te Sc9Te 2 Sc9Te2,mS88,9 C1c1 0.77576,1.5654,1.7283,90,90.01,90 - black 4.18 X 37259
Sc-Th Sc0.55 Th0.45 rt Cu,cF4,225 Fm-3m 0.4925,0.4925,0.4925,90,90,90 close-packed structure - 7.18 X 4836
Sc-Y Y0.5 Sc0.5 rt Mg,hP2,194 P63/mmc 0.3504,0.3504,0.5544,90,90,120 close-packed structure - 3.77 X 2024
Sc-Zn ZnSc CsCl,cP2,221 Pm-3m 0.3348,0.3348,0.3348,90,90,90 b.c.c. family - 4.88 X 33106
Sc-Zn Zn12 Sc ThMn12,tI26,139 I4/mmm 0.8814,0.8814,0.514,90,90,90 CaCu5-Zr4Al3 - 6.90 X 3098
Sc-Zn Zn17 Sc3 Be17 Ru3,cI160,204 Im-3 1.3852,1.3852,1.3852,90,90,90 - gray 6.23 X 22886
168 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Sc-Zn Zn2Sc hp MgZn2,hP12,194 P63 /mmc 0.52509,0.52509,0.84774,90,90,120 Friauf-Laves phase - 5.77 X 31797
Sc-Zn Zn2Sc Hg2U,hP3,191 P6/mmm 0.4365,0.4365,0.3186,90,90,120 AlB2 family - 5.55 X 33106
Sc-Zn Zn58Sc13 Zn58Gd13,hP142,194 P63 /mmc 1.3741,1.3741,1.3632,90,90,120 - - 6.52 A 33106
Sc-Zn Zn6Sc Cd6Y,cI184,204 Im-3 1.38311,1.38311,1.38311,90,90,90 - - 6.59 X 42953
Sc-Zr Sc0.9 Zr0.1 rt Mg,hP2,194 P63 /mmc 0.3302,0.3302,0.5235,90,90,120 close-packed structure - 3.33 X 13619
Se-Si SiSe2 SiS2,oI12,72 Ibam 0.5998,0.9669,0.5851,90,90,90 - colorless 3.64 X 14855
Se-Sm SmSe rt NaCl,cF8,225 Fm-3m 0.62,0.62,0.62,90,90,90 rocksalt family black gray 6.39 X 18454
Se-Sm SmSe tf ZnO,hP4,186 P63 mc 0.405,0.405,0.722,90,90,120 adamantane structure - 7.43 X 11078
Se-Sm SmSe1.84 UAs2,tP6,129 P4/nmm 0.408,0.408,0.8336,90,90,90 - black 7.08 X 53531
Se-Sm SmSe2 CeSe2,mP12,14 P121/c1 0.8399,0.41147,0.82763,90,90.05,90 - - 7.16 A 57465
Se-Sm Sm10Se19 Ce10Se19,tP58,86 P42 /n 0.9143,0.9143,1.6624,90,90,90 - black 7.18 X 38315
Se-Sm Sm2Se3 orth Th2S3,oP20,62 Pnma 1.1273,0.4091,1.1032,90,90,90 - black 7.02 X 31070
Se-Sm Sm2.67 Se4 ht Th3P 4,cI28,220 I-43d 0.8782,0.8782,0.8782,90,90,90 - - 7.04 A 53120
Se-Sm Sm2.67 Se4 ht Th3P 4,cI28,220 I-43d 0.8782,0.8782,0.8782,90,90,90 - brown 7.04 X 31070
Se-Sm Sm4Se4.83 Sm4Se4.83 ,tI128,88 I41/a 1.20,1.20,1.4075,90,90,90 - - 6.44 X 25952
Se-Sn SnSe ht1 TlI,oS8,63 Cmcm 0.4293,1.162,0.4282,90,90,90 CrB(TlI)-FeB - 6.15 X 19228
Se-Sn SnSe ht2 NaCl,cF8,225 Fm-3m 0.6,0.6,0.6,90,90,90 rocksalt family - 6.08 X 22894
Se-Sn SnSe rt GeS,oP8,62 Pnma 1.1501,0.4153,0.4445,90,90,90 - gray steel 6.18 X 19228
Se-Sn SnSe2 rhom CdI2,hR27,166 R-3m 0.381,0.381,5.52,90,90,120 CdI2 -PbI2 polytype - 5.96 A 13524
Se-Sn SnSe2 rt CdI2,hP3,164 P-3m1 0.3807,0.3807,0.6128,90,90,120 CdI2 -PbI2 polytype gray 5.97 A 10784
Se-Sn Sn2Se3 *,t*10,* - 0.677,0.677,0.586,90,90,90 - - - N 611
Se-Sr SrSe NaCl,cF8,225 Fm-3m 0.6245,0.6245,0.6245,90,90,90 rocksalt family - 4.54 X 16608
Se-Ta TaSe2 3R MoS2,hR9,160 R3m 0.34348,0.34348,1.9177,90,90,120 - gray 8.62 X 3416
Se-Ta TaSe2 4H2 TaSe2,hP12,186 P63 mc 0.3436,0.3436,2.5532,90,90,120 - - 8.62 X 4688
Se-Ta TaSe2 6R TaS2,hR18,160 R3m 0.34558,0.34558,3.7826,90,90,120 - - 8.63 X 3416
Se-Ta TaSe2 ht 1T CdI2,hP3,164 P-3m1 0.34769,0.34769,0.62722,90,90,120 CdI2 -PbI2 polytype - 8.57 X 3416
Se-Ta TaSe2 ht 4H1 TaSe2,hP12,194 P63 /mmc 0.346,0.346,2.518,90,90,120 - - 8.62 X 2454
Se-Ta TaSe2 ht TaSe2,hP156,176 P63 /m 1.24579,1.24579,2.51495,90,90,120 - - 8.66 X 36465
Se-Ta TaSe2 lt2 2H *,hP54,* - 1.029,1.029,1.27,90,90,120 - - - N 13612
Se-Ta TaSe2 rt 1T TaSe2,aP39,2 P-1 0.86899,0.93587,1.11251,74.819,77.315,87.789 - - 8.59 X 39585
Se-Ta TaSe2 rt 2H NbS2,hP6,194 P63 /mmc 0.343,0.343,1.271,90,90,120 - - 8.69 X 2454
Se-Ta TaSe3 hp NbSe3,mP24,11 P121/m1 1.0019,0.348,1.54978,90,107.931,90 - black 8.10 A 20518
Se-Ta TaSe3 TaSe3,mP16,11 P121/m1 0.9829,0.3495,1.0402,90,106.26,90 - - 8.09 X 2966
Se-Ta Ta1.1 Se2 2H2 Nb1.1 Se2,hP8,187 P-6m2 0.3442,0.3442,1.262,90,90,120 - - 9.16 X 3581
Se-Ta Ta1.14 Se2 3R Nb1.06 S2,hR12,160 R3m 0.3443,0.3443,1.893,90,90,120 - - 9.34 X 3416
Se-Ta Ta1.43 Se2 2H Nb1.35 S2,hP8,194 P63 /mmc 0.3432,0.3432,1.292,90,90,120 AlB2 family - 10.50 X 3416
Se-Ta Ta2Se Ta2Se,tP6,129 P4/nmm 0.3375,0.3375,0.9832,90,90,90 - - 13.07 X 22146
Se-Ta Ta2Se3 Mo2S3,mP10,11 P121/m1 0.6495,0.3408,0.9206,90,103.63,90 - - 10.04 X 3803
Se-Tb TbSe lt NiO,hR6,166 R-3m 0.40418,0.40418,0.99835,90,90,120 - - 8.39 X 12039
Se-Tb TbSe rt NaCl,cF8,225 Fm-3m 0.5746,0.5746,0.5746,90,90,90 rocksalt family - 8.33 X 22804
Se-Tb TbSe tf ZnO,hP4,186 P63 mc 0.4,0.4,0.695,90,90,120 adamantane structure - 8.20 X 11078
Se-Tb TbSe2 mon CeSe2,mP12,14 P121/c1 0.82666,0.40706,0.82093,90,90.087,90 - - 7.62 A 57465
Se-Tb TbSe2 tet NdS2,tP24,117 P-4b2 0.826,0.826,0.8472,90,90,90 - - 7.28 A 20081
Se-Tb Tb10Se19 Ce10Se19,tP58,86 P42 /n 0.90333,0.90333,1.65234,90,90,90 - - 7.61 A 59478
Se-Tb Tb2Se3 rt Th2S3,oP20,62 Pnma 1.113,0.4024,1.0951,90,90,90 - black 7.51 X 33778
Se-Tb Tb2.67 Se4 ht Th3P 4,cI28,220 I-43d 0.8677,0.8677,0.8677,90,90,90 - - 7.53 A 22804
Se-Tb Tb8Se14.8 Gd8Se14.9 ,oS150,38 Amm2 1.2094,1.6123,1.655,90,90,90 - gray silver 7.53 X 49617
Se-Te Te0.04 Se0.96 Se-b,mP32,14 P121/c1 0.9103,0.9104,1.46853,90,127.442,90 - black 4.45 X 21155
Se-Te Te0.15 Se0.85 S,mP28,14 P121/c1 1.0701,0.8427,0.9516,90,102.31,90 - black 4.78 X 21156
Se-Te Te0.4 Se0.6 (Te0.4 Se0.6),mS54,8 C1m1 0.81643,2.78559,0.69262,90,108.03,90 - - 5.89 X 30743
Se-Te Te0.5 Se0.5 Se,hP3,152 P3121 0.441,0.441,0.541,90,90,120 - - 5.65 A 47335
Se-Th ThSe hp CsCl,cP2,221 Pm-3m 0.36,0.36,0.36,90,90,90 b.c.c. family - 11.07 X 21158
Se-Th ThSe rt NaCl,cF8,225 Fm-3m 0.588,0.588,0.588,90,90,90 rocksalt family golden 10.16 X 23673
Se-Th ThSe2 PbCl2,oP12,62 Pnma 0.761,0.442,0.9064,90,90,90 - gray 8.50 X 518
Se-Th ThSe3 ZrSe3,mP8,11 P121/m1 0.572,0.421,0.964,90,97.08,90 - - 6.76 A 13374
Se-Th Th2Se3 Th2S3,oP20,62 Pnma 1.134,0.427,1.157,90,90,90 - black gray 8.31 A 446
Se-Th Th2Se5 Th2S5,oP28,60 Pbcn 0.79223,1.07155,0.79375,90,90,90 - violet dark 8.47 X 36697
Se-Th Th7Se12 Th7S12,hP20,176 P63 /m 1.158,1.158,0.436,90,90,120 - gray 8.43 A 446
Se-Ti TiSe rt hex *,hP*,* - 0.715,0.715,1.2,90,90,120 - black - N 957
Se-Ti TiSe rt orth FeAs,oP8,62 Pnma 0.6222,0.3494,0.6462,90,90,90 AlB2 family - 6.00 X 1404
Se-Ti TiSe2 rt CdI2,hP3,164 P-3m1 0.354,0.354,0.6008,90,90,120 CdI2 -PbI2 polytype violet dark 5.24 X 9983
Se-Ti Ti0.89 Se rt *,hP*,186 P63 mc 1.0684,1.0684,0.6248,90,90,120 - - - N 6571
Se-Ti Ti0.95 Se ht NiAs,hP4,194 P63 /mmc 0.3571,0.3571,0.6301,90,90,120 AlB2 family black 5.94 X 1404
Se-Ti Ti1.2 Se0.8 NiAs,hP4,194 P63 /mmc 0.3574,0.3574,0.6322,90,90,120 AlB2 family - 5.73 X 1158
Se-Ti Ti11Se4 *,mS90,12 C12/m1 2.5516,0.34481,1.9201,90,117.84,90 - - - N 32197
Se-Ti Ti2Se orth1 Ta2P,oP36,58 Pnnm 1.1737,1.455,0.3451,90,90,90 - gray silver 5.91 X 32608
Se-Ti Ti2Se orth2 Sc2Te,oP36,62 Pnma 1.7934,0.3453,0.9526,90,90,90 - - 5.90 X 36801
Se-Ti Ti2Se3 rt Cr2S3,hP20,163 P-31c 0.6233,0.6233,1.1984,90,90,120 - - 5.48 A 21629
Se-Ti Ti3Se4 rt hex Nb3Te4,hP14,176 P63 /m 0.9881,0.9881,0.35874,90,90,120 - - 5.03 X 29474
Se-Ti Ti3Se4 rt mon Cr3S4,mS14,12 C12/m1 1.35557,0.357,0.636,90,117.499,90 - - 5.59 A 20353
Se-Ti Ti45Se16 Ti45Se16,mS122,12 C12/m1 3.6534,0.3453,1.6984,90,91.73,90 - - 5.30 X 38348
Se-Ti Ti5Se4 Ti5 Te4,tI18,87 I4/m 0.96728,0.96728,0.35083,90,90,90 Chevrel phase - 5.62 X 44013
Se-Ti Ti8Se3 Ti8S3,mS88,12 C12/m1 2.5562,0.3441,1.9701,90,122.25,90 - gray silver 5.62 X 32609
Se-Ti Ti9Se2 Ti9Se2,oP22,55 Pbam 0.6917,1.5505,0.3454,90,90,90 - gray 5.28 X 32478
Se-Tl TlSe hp CsCl,cP2,221 Pm-3m 0.331,0.331,0.331,90,90,90 b.c.c. family - 12.97 X 21720
Se-Tl TlSe ht *,cI8,* - 0.6187,0.6187,0.6187,90,90,90 - - - N 14083
Se-Tl TlSe rt TlSe,tI16,140 I4/mcm 0.802,0.802,0.6971,90,90,90 - - 8.39 X 29492
Se-Tl Tl2Se3 rt Tl2 Te3,mS20,15 C12/c1 1.31318,0.7182,0.8064,90,104.046,90 - - 5.81 A 10262
Handbook of Inorganic Substances – Edition 2015 : Data 169

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Se-Tl Tl5Se 3 Tl5Se3,tP32,85 P4/n 0.854,0.854,1.238,90,90,90 - - 9.26 X 13731


Se-Tm TmSe ht2 NaCl,cF8,225 Fm-3m 0.5704,0.5704,0.5704,90,90,90 rocksalt family - 8.87 X 18154
Se-Tm TmSe 2 UAs2,tP6,129 P4/nmm 0.3961,0.3961,0.8188,90,90,90 - - 8.45 A 5254
Se-Tm Tm0.76 Se Tm0.76 Se,oP32,48 Pnnn 0.79524,0.79591,1.12513,90,90,90 - blue deep 7.74 X 20204
Se-Tm Tm10 Se19 Ce10 Se19,tP58,86 P42/n 0.88689,0.88689,1.63671,90,90,90 - - 8.23 A 59478
Se-Tm Tm2 Se3 Sc2S3,oF80,70 Fddd 0.806,1.131,2.406,90,90,90 - yellow 6.96 X 2549
Se-Tm Tm2.67 Se4 hp Th3P 4,cI28,220 I-43d 0.85992,0.85992,0.85992,90,90,90 - - 8.01 A 5250
Se-U USe lt NiO,hR6,166 R-3m 0.4035,0.4035,1.00057,90,90,120 rocksalt family - 11.19 X 46621
Se-U USe rt NaCl,cF8,225 Fm-3m 0.5757,0.5757,0.5757,90,90,90 rocksalt family gray 11.04 X 31927
Se-U USe 2 hp Fe2P,hP9,189 P-62m 0.76376,0.76376,0.41924,90,90,120 Fe2P family gray dark 9.31 X 33833
Se-U USe 2 ht PbCl2,oP12,62 Pnma 0.7455,0.4232,0.8964,90,90,90 - black 9.30 X 32115
Se-U USe 3 ZrSe 3,mP8,11 P121/m1 0.5652,0.4056,0.95643,90,97.344,90 - black 7.25 X 16938
Se-U USe x Cu,cF4,225 Fm-3m 0.488,0.488,0.488,90,90,90 close-packed structure - 13.60 X 7286
Se-U U2Se 3 Th2S3,oP20,62 Pnma 1.13,0.406,1.094,90,90,90 - black 9.44 A 9283
Se-U U2.75 Se5 rt U2.75 S5,tP32,130 P4/ncc 1.0765,1.0765,0.666,90,90,90 - black 9.03 X 17217
Se-U U3Se 4 rt Th3P 4,cI28,220 I-43d 0.882,0.882,0.882,90,90,90 - gray 9.97 X 18385
Se-U U3Se 5 Yb5Sb3,oP32,62 Pnma 1.243,0.848,0.777,90,90,90 - black 8.99 X 6401
Se-U U7Se 12 Th7S12,hP20,176 P63/m 1.1385,1.1385,0.4099,90,90,120 - - 9.43 X 6794
Se-V VSe rt NiAs,hP4,194 P63/mmc 0.3697,0.3697,0.599,90,90,120 AlB2 family - 6.08 X 3165
Se-V V0.5 Se rt Cr0.88 S,hP4,164 P-3m1 0.3356,0.3356,0.6104,90,90,120 CdI2-PbI2 polytype - 5.83 X 14876
Se-V V2Se 9 V2Se9,mS44,15 C12/c1 1.05899,1.24127,0.81198,90,94.910,90 - gray dark 5.08 X 16790
Se-V V29Se 32 *,hP61,* - 0.7211,0.7211,2.4002,90,90,120 - - 6.15 N 3165
Se-V V3Se 4 rt Cr3S4,mS14,12 C12/m1 1.32468,0.3463,0.6204,90,116.183,90 - - 6.09 X 17104
Se-V V5Se 4 rt Ti5 Te4,tI18,87 I4/m 0.9294,0.9294,0.3417,90,90,90 Chevrel phase - 6.42 A 2401
Se-V V5Se 8 rt V5S8 ,mS26,12 C12/m1 1.174,0.696,0.82466,90,134.037,90 - - 6.08 X 2160
Se-W WSe 2 MoS2,hP6,194 P63/mmc 0.3282,0.3282,1.296,90,90,120 - gray dark 9.39 X 20408
Se-Y YSe NaCl,cF8,225 Fm-3m 0.5704,0.5704,0.5704,90,90,90 rocksalt family green 6.01 X 3930
Se-Y Y0.75 Se rhom Sc0.685 S,hR12,166 R-3m 0.40429,0.40429,1.97981,90,90,120 - - 5.18 A 3930
Se-Y Y0.75 Se rt Zr0.65 S,cF64,227 Fd-3m 1.14211,1.14211,1.14211,90,90,90 rocksalt family - 5.19 X 21363
Se-Y Y0.92 Se1.68 Y0.92 Se1.68 ,tP12,129 P4/nmm 0.4011,0.4011,1.6485,90,90,90 - - 5.37 X 29902
Se-Y Y2Se 3 Sc2S3,oF80,70 Fddd 0.818,1.145,2.438,90,90,90 - brown 4.83 X 2549
Se-Y Y2.67 Se4 hp Th3P 4,cI28,220 I-43d 0.86626,0.86626,0.86626,90,90,90 - - 5.65 A 5250
Se-Y Y4.68 Se7 rt Y4.68 Se7,mS24,8 C1m1 1.3213,0.3949,1.2035,90,104.82,90 - blue 5.30 X 21327
Se-Y Y8Se 14.8 Gd8Se14.9 ,oS150,38 Amm2 1.2054,1.6072,1.6626,90,90,90 - gray silver 5.82 X 49617
Se-Yb YbSe tf ZnO,hP4,186 P63mc 0.412,0.412,0.726,90,90,120 adamantane structure - 7.84 X 11078
Se-Yb YbSe NaCl,cF8,225 Fm-3m 0.59321,0.59321,0.59321,90,90,90 rocksalt family black 8.02 X 27409
Se-Yb YbSe 2 hp UAs2,tP6,129 P4/nmm 0.397,0.397,0.8151,90,90,90 - - 8.56 A 5254
Se-Yb Yb0.75 Se ht Sc0.685 S,hR12,166 R-3m 0.404,0.404,2.042,90,90,120 - - 7.21 A 4506
Se-Yb Yb0.91 Se Yb0.91 Se,cF64,225 Fm-3m 1.17496,1.17496,1.17496,90,90,90 rocksalt family - 7.75 X 27409
Se-Yb Yb2Se 3 ht Sc2S3,oF80,70 Fddd 0.80183,1.1272,2.3961,90,90,90 - black 7.15 X 41192
Se-Yb Yb2.67 Se4 hp Th3P 4,cI28,220 I-43d 0.8615,0.8615,0.8615,90,90,90 - - 8.08 A 5250
Se-Yb Yb3Se 4 rt Yb2.9 S4,oP28,62 Pnma 1.3277,0.3974,1.3512,90,90,90 - black 7.78 X 20551
Se-Yb Yb5Se 7 rt Yb5Se7,mS26,12 C12/m1 1.3074,0.39435,1.2046,90,104.77,90 - black 7.84 X 23500
Se-Zn ZnSe ht ZnO,hP4,186 P63mc 0.3975,0.3975,0.6503,90,90,120 adamantane structure - 5.39 A 56182
Se-Zn ZnSe rt ZnS,cF8,216 F-43m 0.5674,0.5674,0.5674,90,90,90 stilleite yellow 5.25 X 32947
Se-Zn ZnSe 2 hp FeS2 ,cP12,205 Pa-3 0.6293,0.6293,0.6293,90,90,90 pyrite-marcasite family - 5.95 A 4031
Se-Zr ZrSe 0.67 WC,hP2,187 P-6m2 0.3546,0.3546,0.3614,90,90,120 AlB2 family gray 6.08 X 1160
Se-Zr ZrSe 2 rt CdI2 ,hP3,164 P-3m1 0.3772,0.3772,0.61297,90,90,120 CdI2-PbI2 polytype bronze 5.48 X 5399
Se-Zr ZrSe 3 ZrSe 3,mP8,11 P121/m1 0.54109,0.37488,0.94444,90,97.48,90 - purple dark 5.74 X 8707
Se-Zr Zr0.62 Se Ti0.62 S,hP8,186 P63mc 0.3744,0.3744,1.251,90,90,120 - - 5.93 X 4242
Se-Zr Zr0.63 Se Sc0.685 S,hR12,166 R-3m 0.3753,0.3753,1.8703,90,90,120 - black 5.96 X 4242
Se-Zr Zr0.8 Se0.2 rt Mg,hP2,194 P63/mmc 0.3252,0.3252,0.5186,90,90,120 close-packed structure - 6.21 X 1160
Se-Zr Zr2Se Ta2P,oP36,58 Pnnm 1.25985,1.57448,0.36126,90,90,90 - - 7.27 X 43586
Se-Zr Zr4Se 3 (Si) *,t**,* - 0.362,0.362,0.834,90,90,90 - - - N 19082
Si-Sm SmSi FeB-b,oP8,62 Pnma 0.81,0.388,0.584,90,90,90 CrB(TlI)-FeB gray 6.46 A 17566
Si-Sm SmSi1.67 rt AlB2 ,hP3,191 P6/mmm 0.3903,0.3903,0.4207,90,90,120 AlB2 family - 5.90 X 4275
Si-Sm SmSi2 ht ThSi2,tI12,141 I41/amd 0.4049,0.4049,1.336,90,90,90 - - 6.26 X 459
Si-Sm SmSi2 rt GdSi1.4 ,oI12,74 Imma 0.4048,0.4094,1.352,90,90,90 - - 6.12 A 34597
Si-Sm Sm5 Si3 Mn5 Si3,hP16,193 P63/mcm 0.858,0.858,0.648,90,90,120 - - 6.72 X 4619
Si-Sm Sm5 Si4 Gd5Si4,oP36,62 Pnma 0.75738,1.489,0.78156,90,90,90 - - 6.51 X 49349
Si-Sr SrSi orth1 TlI,oS8,63 Cmcm 0.48162,1.1303,0.40388,90,90,90 CrB(TlI)-FeB gray silver 3.50 X 32497
Si-Sr SrSi orth2 SrSi,oI40,71 Immm 0.489,1.298,1.803,90,90,90 - - 3.36 X 8678
Si-Sr SrSi1.693 hp-ht ThSi2,tI12,141 I41/amd 0.4403,0.4403,1.3916,90,90,90 - reddish 3.33 X 43147
Si-Sr SrSi2 rt SrSi2,cP12,213 P4132 0.6515,0.6515,0.6515,90,90,90 - gray 3.45 X 6424
Si-Sr SrSi6 hp Eu(Ga0.33 Ge0.67)6,oS28,63 Cmcm 0.44692,1.0256,1.1698,90,90,90 clathrate - 3.17 X 47770
Si-Sr Sr0.028 Si0.972 C,cF8,227 Fd-3m 0.54248,0.54248,0.54248,90,90,90 - - 2.48 X 58876
Si-Sr Sr2Si Co2Si-b,oP12,62 Pnma 0.811,0.515,0.954,90,90,90 - - 3.39 X 10309
Si-Sr Sr5Si3 Cr5B3,tI32,140 I4/mcm 0.80966,0.80966,1.5703,90,90,90 - black gray 3.37 X 39140
Si-Ta TaSi2 CrSi2,hP9,180 P6222 0.47839,0.47839,0.657,90,90,120 - - 9.07 X 38624
Si-Ta Ta2Si CuAl2,tI12,140 I4/mcm 0.616,0.616,0.5056,90,90,90 - - 13.50 X 6743
Si-Ta Ta3Si Ti3P,tP32,86 P42/n 1.0193,1.0193,0.5175,90,90,90 - - 14.11 X 2863
Si-Ta Ta3.28 Si0.72 Mg3 Cd,hP8,194 P63/mmc 0.6105,0.6105,0.4919,90,90,120 close-packed structure - 12.84 X 524
Si-Ta Ta5Si2.97 rt Cr5B3,tI32,140 I4/mcm 0.65246,0.65246,1.18853,90,90,90 - - 12.97 X 58902
Si-Ta Ta5Si3 ht W5Si3,tI32,140 I4/mcm 0.9892,0.9892,0.5042,90,90,90 - - 13.32 A 14135
Si-Ta Ta5Si3 stab Mn5 Si3,hP16,193 P63/mcm 0.7474,0.7474,0.5226,90,90,120 - - 12.99 X 524
Si-Tb TbSi ht FeB-b,oP8,62 Pnma 0.78895,0.38136,0.56813,90,90,90 CrB(TlI)-FeB gray 7.27 X 27588
Si-Tb TbSi1.67 hex AlB2 ,hP3,191 P6/mmm 0.38417,0.38417,0.41405,90,90,120 AlB2 family - 6.46 X 22473
Si-Tb TbSi1.67 orth GdSi1.4 ,oI12,74 Imma 0.40431,0.39496,1.3353,90,90,90 - gray 6.41 X 22473
170 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Si-Tb TbSi1.75 lt TbSi1.75 ,oI12,46 Ima2 0.4037,1.33743,0.39462,90,90,90 - - 6.49 X 23564


Si-Tb Tb2Si3 orth V2B3,oS20,63 Cmcm 0.42178,2.3912,0.3823,90,90,90 - - 6.93 X 27576
Si-Tb Tb5Si3 Mn5Si3,hP16,193 P63 /mcm 0.8425,0.8425,0.6333,90,90,120 - - 7.50 X 22470
Si-Tb Tb5Si4 Sm5Ge4,oP36,62 Pnma 0.7403,1.46,0.766,90,90,90 - - 7.28 A 36712
Si-Tc TcSi FeSi,cP8,198 P213 0.4755,0.4755,0.4755,90,90,90 - - 7.79 A 2668
Si-Tc Tc0.8 Si0.2 W,cI2,229 Im-3m 0.3009,0.3009,0.3009,90,90,90 b.c.c. family - 10.24 X 2668
Si-Tc Tc10Si3 Zn9(Zn0.5 Fe0.5)2Fe2,cI52,217 I-43m 0.9014,0.9014,0.9014,90,90,90 γ-brass - 9.65 A 2668
Si-Tc Tc4Si7 Mn4Si7,tP44,116 P-4c2 0.5737,0.5737,1.8098,90,90,90 chimney-ladder structure - 6.56 A 2678
Si-Tc Tc5Si3 W5Si3,tI32,140 I4/mcm 0.9403,0.9403,0.4849,90,90,90 - - 8.90 A 2668
Si-Te Si17.5 Te9.5 Si12(Si0.69 Te0.31)8Te7,cF432,228 Fd-3c 2.1136,2.1136,2.1136,90,90,90 - - 4.79 X 42245
Si-Te Si19Te8 cub Si19Te8,cP78,218 P-43n 1.0457,1.0457,1.0457,90,90,90 clathrate gray 4.51 X 43869
Si-Te Si19Te8 rhom Si19Te8,hR162,161 R3c 1.47842,1.47842,1.81638,90,90,120 clathrate gray 4.50 X 43869
Si-Te Si2Te3 rt Si2Te3,hP40,163 P-31c 0.7430,0.7430,1.3482,90,90,120 - red 4.52 X 10053
Si-Th ThSi FeB-b,oP8,62 Pnma 0.78895,0.41482,0.58972,90,90,90 CrB(TlI)-FeB - 8.95 X 59625
Si-Th ThSi2 rt ThSi2,tI12,141 I41/amd 0.4126,0.4126,1.4346,90,90,90 - - 7.84 X 223
Si-Th ThSi2 AlB2,hP3,191 P6/mmm 0.3985,0.3985,0.422,90,90,120 AlB2 family - 8.25 X 773
Si-Th Th3Si2 U3Si2,tP10,127 P4/mbm 0.7835,0.7835,0.4154,90,90,90 - - 9.80 X 773
Si-Ti TiSi ht FeB-b,oP8,62 Pnma 0.65383,0.36413,0.5002,90,90,90 CrB(TlI)-FeB - 4.24 A 41639
Si-Ti TiSi rt *,oS32,65 Cmmm 0.7081,1.874,0.3596,90,90,90 - - 4.23 N 5602
Si-Ti TiSi2 m TiSi2,oF12,69 Fmmm 0.4428,0.4779,0.9078,90,90,90 - - 3.60 X 34984
Si-Ti TiSi2 orth1 TiSi2,oF24,70 Fddd 0.48000,0.82671,0.85505,90,90,90 - - 4.07 X 10400
Si-Ti TiSi2 orth2 ZrSi2,oS12,63 Cmcm 0.355,1.349,0.355,90,90,90 close-packed structure - 4.07 A 27484
Si-Ti Ti0.983 Si0.017 rt Mg,hP2,194 P63 /mmc 0.2954,0.2954,0.4672,90,90,120 close-packed structure - 4.47 X 55163
Si-Ti Ti3Si rt Ti3P,tP32,86 P42 /n 1.0159,1.0159,0.5085,90,90,90 - - 4.35 A 43115
Si-Ti Ti5Si3 Mn5Si3,hP16,193 P63 /mcm 0.7461,0.7461,0.51508,90,90,120 - - 4.33 X 19415
Si-Ti Ti5Si4 ht Zr5Si4,tP36,92 P41212 0.67113,0.67113,1.218,90,90,90 - - 4.26 A 50375
Si-Ti Ti5Si4 rt Gd5Si4,oP36,62 Pnma 0.64892,1.26759,0.6627,90,90,90 - - 4.29 A 50358
Si-Tm TmSi TlI,oS8,63 Cmcm 0.41813,1.03406,0.37743,90,90,90 CrB(TlI)-FeB gray 8.02 A 57358
Si-Tm TmSi1.74 AlB2,hP3,191 P6/mmm 0.3768,0.3768,0.40702,90,90,120 AlB2 family - 7.23 X 57358
Si-Tm Tm5Si3 Mn5Si3,hP16,193 P63 /mcm 0.826,0.826,0.618,90,90,120 - - 8.45 X 4619
Si-U USi (O) FeB-b,oP8,62 Pnma 0.767,0.391,0.566,90,90,90 CrB(TlI)-FeB - 10.41 X 311
Si-U USi0.1 stab Cu,cF4,225 Fm-3m 0.496,0.496,0.496,90,90,90 close-packed structure - 13.11 F 7286
Si-U USi1.67 AlB2,hP3,191 P6/mmm 0.384,0.384,0.407,90,90,120 AlB2 family - 9.10 X 23663
Si-U USi1.78 GdSi1.4 ,oI12,74 Imma 0.3929,0.3953,1.3656,90,90,90 - - 9.02 A 26402
Si-U USi1.84 ht ThSi2,tI12,141 I41/amd 0.3937,0.3937,1.3654,90,90,90 - - 9.09 X 26402
Si-U USi2 rt AlB2,hP3,191 P6/mmm 0.3839,0.3839,0.472,90,90,120 AlB2 family - 8.11 X 15617
Si-U USi3 ht Cu3Au,cP4,221 Pm-3m 0.40597,0.40597,0.40597,90,90,90 close-packed structure - 8.00 X 41639
Si-U U3Si ht Cu3Au,cP4,221 Pm-3m 0.4346,0.4346,0.4346,90,90,90 close-packed structure - 15.01 X 2575
Si-U U3Si lt U3Si,oF32,69 Fmmm 0.8523,0.8549,0.8654,90,90,90 close-packed structure - 15.64 X 13013
Si-U U3Si rt U3Si,tI16,140 I4/mcm 0.60358,0.60358,0.86925,90,90,90 close-packed structure - 15.57 X 23879
Si-U U3Si2 U3Si2,tP10,127 P4/mbm 0.73314,0.73314,0.39001,90,90,90 - - 12.20 X 26402
Si-U U3Si5 Si+ *,oP*,47 Pmmm 0.3892,0.4027,0.674,90,90,90 - - - N 39059
Si-U U34Si34.5 U34Si34.5,tI138,139 I4/mmm 1.0587,1.0587,2.431,90,90,90 - gray 11.05 X 31763
Si-U U5Si4 *,hP36,191 P6/mmm 1.0467,1.0467,0.7835,90,90,120 - - 11.64 N 44809
Si-V VSi2 CrSi2,hP9,180 P6222 0.45726,0.45726,0.63744,90,90,120 - brown 4.62 X 38624
Si-V V0.97 Si0.03 W,cI2,229 Im-3m 0.30232,0.30232,0.30232,90,90,90 b.c.c. family - 6.04 X 3707
Si-V V3Si lt1 *,t*8,* - 0.47255,0.47255,0.4717,90,90,90 - - - N 16431
Si-V V3Si rt Cr3Si,cP8,223 Pm-3n 0.4724,0.4724,0.4724,90,90,90 Frank-Kasper phase - 5.70 X 11917
Si-V V5Si3 rt W5Si3,tI32,140 I4/mcm 0.94245,0.94245,0.47575,90,90,90 - - 5.33 X 44180
Si-V V5Si3 stab Mn5Si3,hP16,193 P63 /mcm 0.715,0.715,0.483,90,90,120 - - 5.26 A 2778
Si-V V6Si5 ht V6Si5,oI44,72 Ibam 0.7501,1.5966,0.4858,90,90,90 - - 5.09 X 5108
Si-W WSi2 tf CrSi2,hP9,180 P6222 0.4614,0.4614,0.6414,90,90,120 - - 10.11 A 13286
Si-W WSi2 MoSi2,tI6,139 I4/mmm 0.32178,0.32178,0.78403,90,90,90 b.c.c. family - 9.82 X 27543
Si-W W3Si tf Cr3Si,cP8,223 Pm-3n 0.491,0.491,0.491,90,90,90 Frank-Kasper phase - 16.26 X 1132
Si-W W5Si3 W5Si3,tI32,140 I4/mcm 0.9645,0.9645,0.497,90,90,90 - - 14.42 X 671
Si-Y YSi TlI,oS8,63 Cmcm 0.4251,1.0526,0.3826,90,90,90 CrB(TlI)-FeB - 4.54 X 1055
Si-Y YSi1.67 hex AlB2,hP3,191 P6/mmm 0.3838,0.3838,0.4141,90,90,120 AlB2 family gray 4.27 X 43129
Si-Y YSi2 orth GdSi1.4 ,oI12,74 Imma 0.3963,0.4056,1.3437,90,90,90 - - 4.46 A 57891
Si-Y YSi2 tet ThSi2,tI12,141 I41/amd 0.404,0.404,1.342,90,90,90 - - 4.40 A 1118
Si-Y YSi3 hp YbSi3,tI32,139 I4/mmm 0.7231,0.7231,1.0792,90,90,90 - - 4.08 X 58432
Si-Y Y2Si2.67 Ho2Si2.67 ,oS24,63 Cmcm 0.42,2.3838,0.3819,90,90,90 - - 4.39 A 46652
Si-Y Y5Si3 Mn5Si3,hP16,193 P63 /mcm 0.84096,0.84096,0.63437,90,90,120 - - 4.52 X 47006
Si-Y Y5Si4 mon Gd5(Ge0.5 Si0.5)4,mP36,14 P121/c1 1.4625,0.7671,0.7473,90,93.343,90 - - 4.42 X 56294
Si-Y Y5Si4 orth Gd5Si4,oP36,62 Pnma 0.7499,1.4763,0.7751,90,90,90 - - 4.31 A 46652
Si-Yb YbSi TlI,oS8,63 Cmcm 0.4178,1.031,0.3768,90,90,90 CrB(TlI)-FeB gray 8.23 X 3597
Si-Yb YbSi1.375 YbSi1.375 ,oI38,44 Imm2 0.416,0.756,2.351,90,90,90 - - 7.61 X 45741
Si-Yb YbSi1.74 ht AlB2,hP3,191 P6/mmm 0.377,0.377,0.4098,90,90,120 AlB2 family - 7.31 X 41617
Si-Yb YbSi2 rt ThSi2,tI12,141 I41/amd 0.39868,0.39868,1.3542,90,90,90 - gray 7.07 X 59490
Si-Yb YbSi3 hp YbSi3,tI32,139 I4/mmm 0.71657,0.71657,1.06581,90,90,90 - gray 6.25 X 57472
Si-Yb Yb2Si PbCl2,oP12,62 Pnma 0.7501,0.4781,0.8951,90,90,90 - - 7.74 A 41617
Si-Yb Yb2Si2.8 rt Ho2Si2.67 ,oS24,63 Cmcm 0.4159,2.351,0.3775,90,90,90 - - 7.64 X 45741
Si-Yb Yb3Si5 Th3Pd5,hP8,189 P-62m 0.65049,0.65049,0.40923,90,90,120 AlB2 family gray dark 7.30 X 47701
Si-Yb Yb5Si3 Mn5Si3,hP16,193 P63 /mcm 0.825,0.825,0.628,90,90,120 - - 8.52 X 4619
Si-Yb Yb5Si4 Gd5Si4,oP36,62 Pnma 0.72695,1.47988,0.77103,90,90,90 - gray 7.83 X 45477
Si-Zn Zn0.004 Si0.996 C,cF8,227 Fd-3m 0.54417,0.54417,0.54417,90,90,90 - - 2.33 X 58876
Si-Zr ZrSi ht TlI,oS8,63 Cmcm 0.37716,0.9936,0.37538,90,90,90 CrB(TlI)-FeB - 5.63 A 58846
Si-Zr ZrSi rt FeB-b,oP8,62 Pnma 0.6995,0.3786,0.5296,90,90,90 CrB(TlI)-FeB gray steel 5.65 X 2642
Si-Zr ZrSi2 ZrSi2,oS12,63 Cmcm 0.3706,1.4735,0.3672,90,90,90 close-packed structure - 4.88 X 40258
Handbook of Inorganic Substances – Edition 2015 : Data 171

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Si-Zr Zr2Si CuAl2,tI12,140 I4/mcm 0.6609,0.6609,0.5298,90,90,90 - - 6.04 X 6743


Si-Zr Zr3Si Ti3P,tP32,86 P42/n 1.09883,1.09883,0.54305,90,90,90 - - 6.11 A 30758
Si-Zr Zr3Si2 U3Si2,tP10,127 P4/mbm 0.70923,0.70923,0.37367,90,90,90 - - 5.83 A 58846
Si-Zr Zr5Si3 ht Mn5 Si3,hP16,193 P63/mcm 0.7886,0.7886,0.5558,90,90,120 - - 6.00 X 527
Si-Zr Zr5Si4 rt Zr5Si4,tP36,92 P41212 0.7123,0.7123,1.3002,90,90,90 - gray olive 5.72 X 4042
Sm-Sn SmSn2 ZrGa2,oS12,65 Cmmm 0.44203,1.58399,0.45054,90,90,90 close-packed structure - 8.17 A 26419
Sm-Sn SmSn3 rt Cu3Au,cP4,221 Pm-3m 0.469,0.469,0.469,90,90,90 close-packed structure - 8.15 X 28969
Sm-Sn Sm11 Sn10 ht Ho11 Ge10,tI84,139 I4/mmm 1.176,1.176,1.732,90,90,90 - - 7.88 A 5633
Sm-Sn Sm2 Sn3 Nd2Sn3,aP20,2 P-1 0.6337,0.8351,1.0995,108.38,96.51,99.99 - - 8.16 X 42507
Sm-Sn Sm2 Sn5 Ce2Sn5,oS28,65 Cmmm 0.45379,3.49123,0.45861,90,90,90 close-packed structure - 8.18 A 26419
Sm-Sn Sm3 Sn7 Tb3Sn7,oS28,65 Cmmm 0.44468,2.59918,0.45229,90,90,90 close-packed structure - 8.15 A 26419
Sm-Sn Sm4 Sn3 Th3P 4,cI28,220 I-43d 0.915,0.915,0.915,90,90,90 - - 8.30 A 5197
Sm-Sn Sm5 Sn3 Mn5 Si3,hP16,193 P63/mcm 0.9106,0.9106,0.6651,90,90,120 - - 7.71 A 3333
Sm-Sn Sm5 Sn4 Sm5 Ge4,oP36,62 Pnma 0.819,1.581,0.819,90,90,90 - - 7.68 A 5197
Sm-Te SmTe hp CsCl,cP2,221 Pm-3m 0.3656,0.3656,0.3656,90,90,90 b.c.c. family - 9.45 X 6294
Sm-Te SmTe rt NaCl,cF8,225 Fm-3m 0.66,0.66,0.66,90,90,90 rocksalt family black gray 6.42 X 18454
Sm-Te SmTe 1.9 UAs2,tP6,129 P4/nmm 0.437,0.437,0.9,90,90,90 - - 7.59 A 1878
Sm-Te SmTe 3 SmTe 3,oS24,63 Cmcm 0.4341,2.573,0.4335,90,90,90 - orange 7.31 X 28570
Sm-Te Sm2 Te3 Th2S3,oP20,62 Pnma 1.186,0.434,1.204,90,90,90 - - 7.33 A 5977
Sm-Te Sm2 Te5 ht Sm2 Te5,aP14,1 P1 0.43392,0.43483,2.18438,90.,95.679,90. - purple red 7.60 X 50527
Sm-Te Sm2.67 Te4 ht Th3P 4,cI28,220 I-43d 0.948,0.948,0.948,90,90,90 - gray silver 7.11 A 2057
Sm-Te Sm3 Te4 Th3P 4,cI28,220 I-43d 0.9506,0.9506,0.9506,90,90,90 - - 7.44 A 1871
Sm-Te Sm5 Te9 rt Sm5 Te9,tP60,85 P4/n 0.97026,0.97026,1.80072,90,90,90 - black 7.45 X 47064
Sm-Th Th0.5 Sm0.5 rt Cu,cF4,225 Fm-3m 0.508,0.508,0.508,90,90,90 close-packed structure - 9.69 X 4836
Sm-Tl TlSm lt CuAu,tP2,123 P4/mmm 0.3576,0.3576,0.4322,90,90,90 close-packed structure - 10.66 X 16686
Sm-Tl TlSm rt CsCl,cP2,221 Pm-3m 0.381,0.381,0.381,90,90,90 b.c.c. family - 10.65 X 16686
Sm-Tl TlSm2 Co1.75 Ge,hP6,194 P63/mmc 0.544,0.544,0.677,90,90,120 AlB2 family - 9.67 X 16686
Sm-Tl Tl3Sm rt Cu3Au,cP4,221 Pm-3m 0.47125,0.47125,0.47125,90,90,90 close-packed structure - 12.12 X 16686
Sm-Tl Tl3Sm5 W5Si3,tI32,140 I4/mcm 1.234,1.234,0.616,90,90,90 - - 9.67 A 16686
Sm-Tl Tl5Sm3 Pu3Pd5,oS32,63 Cmcm 1.01,0.815,1.043,90,90,90 - - 11.40 A 16686
Sm-Zn ZnSm CsCl,cP2,221 Pm-3m 0.3627,0.3627,0.3627,90,90,90 b.c.c. family - 7.51 X 2220
Sm-Zn Zn11 Sm3 La3Al11,oI28,71 Immm 0.4452,0.8838,1.3179,90,90,90 - - 7.50 A 5331
Sm-Zn Zn11.77 Sm1.11 ht Zn11.78 Sm1.11 ,hP42,191 P6/mmm 0.8974,0.8974,0.8918,90,90,120 CaCu5-Zr4Al3 - 7.50 X 5009
Sm-Zn Zn12 Sm rt ThMn12,tI26,139 I4/mmm 0.893,0.893,0.5214,90,90,90 CaCu5-Zr4Al3 - 7.47 A 3117
Sm-Zn Zn17 Sm2 hex Th2Ni17,hP38,194 P63/mmc 0.8979,0.8979,0.8876,90,90,120 CaCu5-Zr4Al3 - 7.57 A 2632
Sm-Zn Zn17 Sm2 rhom Zn17 Th2,hR57,166 R-3m 0.90189,0.90189,1.31947,90,90,120 CaCu5-Zr4Al3 gray 7.57 X 20156
Sm-Zn Zn2Sm rt KHg2,oI12,74 Imma 0.4552,0.7299,0.759,90,90,90 AlB2 family - 7.41 X 3312
Sm-Zn Zn22 Sm3 rt Zn22 Ce3,tI100,141 I41/amd 0.8856,0.8856,2.1175,90,90,90 - - 7.56 A 5331
Sm-Zn Zn3Sm Zn3Y,oP16,62 Pnma 0.6725,0.4489,1.0199,90,90,90 - - 7.48 A 5331
Sm-Zn Zn5Sm CaCu5,hP6,191 P6/mmm 0.5357,0.5357,0.4268,90,90,120 - - 7.47 X 7490
Sm-Zn Zn59.08 Sm12.72 Zn59.08 Sm12.72 ,hP158,186 P63mc 1.4374,1.4374,1.4052,90,90,120 - - 7.63 X 47696
Sn-Sr SrSn rt TlI,oS8,63 Cmcm 0.5045,1.204,0.4494,90,90,90 CrB(TlI)-FeB - 5.02 X 14253
Sn-Sr SrSn3 Mg3 In,hR48,166 R-3m 0.694,0.694,3.301,90,90,120 close-packed structure gray silver 6.42 X 38121
Sn-Sr SrSn4 SrSn4,oS20,63 Cmcm 0.4625,1.7383,0.707,90,90,90 - gray silver 6.57 X 43206
Sn-Sr Sr2Sn rt Co2Si-b,oP12,62 Pnma 0.8402,0.5378,1.0078,90,90,90 - - 4.29 X 14253
Sn-Sr Sr3Sn5 Pu3Pd5,oS32,63 Cmcm 1.0644,0.8588,1.0895,90,90,90 - gray 5.71 X 38719
Sn-Sr Sr5Sn3 Cr5B3,tI32,140 I4/mcm 0.854,0.854,1.606,90,90,90 - - 4.50 X 11095
Sn-Ta Ta1.2 Sn1.8 Mg2 Cu,oF48,70 Fddd 0.5628,0.9801,1.9177,90,90,90 - - 10.82 X 5774
Sn-Ta Ta3Sn Cr3Si,cP8,223 Pm-3n 0.5285,0.5285,0.5285,90,90,90 Frank-Kasper phase - 14.88 X 15182
Sn-Tb TbSn2 ZrSi2,oS12,63 Cmcm 0.4387,1.623,0.4281,90,90,90 close-packed structure - 8.64 X 54585
Sn-Tb TbSn3 hp Cu3Au,cP4,221 Pm-3m 0.466,0.466,0.466,90,90,90 close-packed structure - 8.45 X 28969
Sn-Tb TbSn3 GdSn2.75 ,oS16,38 Amm2 0.435,0.439,2.1913,90,90,90 - - 8.17 A 27463
Sn-Tb Tb11 Sn10 Ho11 Ge10,tI84,139 I4/mmm 1.16,1.16,1.7,90,90,90 - - 8.52 A 5633
Sn-Tb Tb3Sn7 ht1 Tb3Sn7,oS28,65 Cmmm 0.4363,2.6347,0.4441,90,90,90 close-packed structure - 8.51 X 27463
Sn-Tb Tb3Sn7 ht2 *,o*28,* - 0.4335,0.4425,2.6667,90,90,90 - - - N 27463
Sn-Tb Tb5Sn3 Mn5 Si3,hP16,193 P63/mcm 0.8937,0.8937,0.6531,90,90,120 - - 8.46 A 23307
Sn-Tb Tb5Sn4 Sm5 Ge4,oP36,62 Pnma 0.8004,1.5418,0.8139,90,90,90 - - 8.39 A 23307
Sn-Tc Tc0.63 Sn0.37 Mg,hP2,194 P63/mmc 0.2736,0.2736,0.4396,90,90,120 close-packed structure - 12.31 X 9260
Sn-Te SnTe hp1 GeS,oP8,62 Pnma 1.159,0.437,0.448,90,90,90 - - 7.21 A 3431
Sn-Te SnTe hp2 CsCl,cP2,221 Pm-3m 0.3468,0.3468,0.3468,90,90,90 b.c.c. family - 9.81 X 19434
Sn-Te SnTe rt NaCl,cF8,225 Fm-3m 0.6315,0.6315,0.6315,90,90,90 rocksalt family gray 6.50 X 21585
Sn-Th ThSn2 ZrSi2,oS12,63 Cmcm 0.4463,1.7062,0.4379,90,90,90 close-packed structure - 9.35 X 16142
Sn-Th ThSn3 Cu3Au,cP4,221 Pm-3m 0.4719,0.4719,0.4719,90,90,90 close-packed structure - 9.29 X 16142
Sn-Th Th5Sn3 Mn5 Si3,hP16,193 P63/mcm 0.9332,0.9332,0.6477,90,90,120 - - 10.31 X 16142
Sn-Th Th5Sn4 Ti5Ga4,hP18,193 P63/mcm 0.9643,0.9643,0.6445,90,90,120 AlB2 family - 10.46 X 16142
Sn-Ti Ti0.992 Sn0.008 rt Mg,hP2,194 P63/mmc 0.2964,0.2964,0.4713,90,90,120 close-packed structure - 4.49 X 55163
Sn-Ti Ti2Sn Co1.75 Ge,hP6,194 P63/mmc 0.46305,0.46305,0.566,90,90,120 AlB2 family - 6.78 X 56215
Sn-Ti Ti2Sn3 Ti2Sn3,oS40,64 Cmce 0.59556,1.9964,0.70281,90,90,90 - gray silver 7.18 X 37040
Sn-Ti Ti3Sn hp Cu3Au,cP4,221 Pm-3m 0.4176,0.4176,0.4176,90,90,90 close-packed structure - 5.98 X 17351
Sn-Ti Ti3Sn Mg3 Cd,hP8,194 P63/mmc 0.59189,0.59189,0.47738,90,90,120 close-packed structure - 6.02 X 56215
Sn-Ti Ti5Sn3 Mn5 Si3,hP16,193 P63/mcm 0.8052,0.8052,0.5454,90,90,120 - - 6.46 A 44810
Sn-Ti Ti6Sn5 ht Ti6Sn5,hP22,194 P63/mmc 0.9248,0.9248,0.569,90,90,120 AlB2 family - 6.94 X 1979
Sn-Ti Ti6Sn5 rt Ti6Sn5,oI44,71 Immm 0.5735,0.9144,1.6930,90,90,90 AlB2 family - 6.59 X 2333
Sn-Tl TlSn ht CuAu,tP2,123 P4/mmm 0.3615,0.3615,0.4375,90,90,90 close-packed structure - 9.38 X 9447
Sn-Tl Tl0.05 Sn0.95 rt Sn,tI4,141 I41/amd 0.5816,0.5816,0.3161,90,90,90 - - 7.64 X 6917
Sn-Tl Tl0.1 Sn0.9 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3205,0.3205,0.3004,90,90,120 - - 7.91 X 6917
Sn-Tl Tl0.275 Sn0.725 m Ti,hP3,191 P6/mmm 0.5389,0.5389,0.3199,90,90,120 - - 8.81 X 6917
Sn-Tl Tl0.4 Sn0.6 m In,tI2,139 I4/mmm 0.3605,0.3605,0.4199,90,90,90 close-packed structure - 9.31 X 6917
172 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Sn-Tl Tl0.8 Sn0.2 Cu,cF4,225 Fm-3m 0.4807,0.4807,0.4807,90,90,90 close-packed structure - 11.20 X 6917
Sn-Tl Tl0.9 Sn0.1 ht W,cI2,229 Im-3m 0.3823,0.3823,0.3823,90,90,90 b.c.c. family - 11.64 X 6917
Sn-Tl Tl0.95 Sn0.05 rt Mg,hP2,194 P63 /mmc 0.3444,0.3444,0.5492,90,90,120 close-packed structure - 11.78 X 6917
Sn-Tm TmSn2 ZrSi2,oS12,63 Cmcm 0.435,1.598,0.4254,90,90,90 close-packed structure - 9.13 X 54585
Sn-Tm TmSn3 GdSn2.75 ,oS16,38 Amm2 0.4331,0.4361,2.1625,90,90,90 - - 8.54 A 27463
Sn-Tm Tm11Sn10 Ho11Ge10,tI84,139 I4/mmm 1.142,1.142,1.668,90,90,90 - - 9.30 A 5633
Sn-Tm Tm2Sn5 Er2Ge5,oP14,59 Pmmn 0.4299,0.4372,1.8835,90,90,90 - - 8.74 A 27463
Sn-Tm Tm5Sn3 Mn5Si3,hP16,193 P63 /mcm 0.8773,0.8773,0.6406,90,90,120 - - 9.34 A 3333
Sn-U USn ThIn,oP24,57 Pbcm 1.0488,0.9552,0.6213,90,90,90 - - 11.42 A 30202
Sn-U USn2 ZrGa2,oS12,65 Cmmm 0.44228,1.5451,0.44683,90,90,90 close-packed structure - 10.34 X 38914
Sn-U USn3 Cu3Au,cP4,221 Pm-3m 0.4626,0.4626,0.4626,90,90,90 close-packed structure - 9.97 X 13909
Sn-U U3Sn7 Ce3Sn7,oS20,65 Cmmm 0.4473,2.459,0.4498,90,90,90 close-packed structure - 10.37 X 38914
Sn-U U5Sn4 Ti5Ga4,hP18,193 P63 /mcm 0.9327,0.9327,0.623,90,90,120 AlB2 family - 11.78 A 30202
Sn-V VSn2 Mg2Cu,oF48,70 Fddd 0.5485,0.9488,1.8667,90,90,90 - - 7.89 X 28807
Sn-V V0.89 Sn0.11 W,cI2,229 Im-3m 0.31,0.31,0.31,90,90,90 b.c.c. family - 6.51 X 7748
Sn-V V3Sn Sn+ Mg3Cd,hP8,194 P63 /mmc 0.5694,0.5694,0.4555,90,90,120 close-packed structure - 7.05 X 5774
Sn-V V3Sn rt Cr3Si,cP8,223 Pm-3n 0.4953,0.4953,0.4953,90,90,90 Frank-Kasper phase - 7.42 X 7748
Sn-Y YSn2 ZrSi2,oS12,63 Cmcm 0.43809,1.6296,0.43034,90,90,90 close-packed structure gray silver 7.05 X 49187
Sn-Y YSn3 hp Cu3Au,cP4,221 Pm-3m 0.4667,0.4667,0.4667,90,90,90 close-packed structure - 7.27 X 55276
Sn-Y YSn3 GdSn2.75 ,oS16,38 Amm2 0.4341,0.4398,2.1901,90,90,90 - - 7.07 A 58184
Sn-Y Y11Sn10 Ho11Ge10,tI84,139 I4/mmm 1.1532,1.1532,1.688,90,90,90 - - 6.41 A 58184
Sn-Y Y2Sn5 Er2Ge5,oP14,59 Pmmn 0.4301,0.4407,1.9071,90,90,90 - - 7.09 A 58184
Sn-Y Y5Sn3 Mn5Si3,hP16,193 P63 /mcm 0.8902,0.8902,0.6536,90,90,120 - - 5.93 X 2129
Sn-Y Y5Sn4 Sm5Ge4,oP36,62 Pnma 0.805,1.529,0.805,90,90,90 - - 6.16 A 4092
Sn-Yb YbSn CuAu,tP2,123 P4/mmm 0.35214,0.35214,0.442,90,90,90 close-packed structure - 8.84 X 53290
Sn-Yb YbSnx rt Cu,cF4,225 Fm-3m 0.5489,0.5489,0.5489,90,90,90 close-packed structure - 6.95 X 54245
Sn-Yb Yb0.92 Sn3.08 Cu3Au,cP4,221 Pm-3m 0.4677,0.4677,0.4677,90,90,90 close-packed structure - 8.52 X 54245
Sn-Yb Yb2Sn Co1.75 Ge,hP6,194 P63 /mmc 0.536,0.536,0.708,90,90,120 AlB2 family - 8.76 X 54245
Sn-Yb Yb3Sn5 Pu3Pd5,oS32,63 Cmcm 1.0193,0.8168,1.0375,90,90,90 - blackish 8.56 X 57481
Sn-Yb Yb36Sn23 Yb36Sn23,tP118,127 P4/mbm 1.23869,1.23869,2.2935,90,90,90 - black 8.46 X 35779
Sn-Yb Yb5Sn3 ht (H) Cr5B3,tI32,140 I4/mcm 0.7939,0.7939,1.4686,90,90,90 - - 8.76 A 9911
Sn-Yb Yb5Sn3 rt (H) Mn5Si3,hP16,193 P63 /mcm 0.947,0.947,0.69,90,90,120 - - 7.57 A 9911
Sn-Yb Yb5Sn4 Sm5Ge4,oP36,62 Pnma 0.7822,1.5813,0.828,90,90,90 - - 8.69 A 9911
Sn-Zn Zn0.15 Sn0.85 m (Hg0.1 Sn0.9 ),hP1,191 P6/mmm 0.3181,0.3181,0.2963,90,90,120 - - 7.08 X 2985
Sn-Zr ZrSn2 TiSi2,oF24,70 Fddd 0.5644,0.9573,0.9927,90,90,90 - - 8.14 X 525
Sn-Zr Zr3.2 Sn0.8 rt Cr3Si,cP8,223 Pm-3n 0.5625,0.5625,0.5625,90,90,90 Frank-Kasper phase - 7.22 X 50058
Sn-Zr Zr5Sn3.18 Ti5Ga4,hP18,193 P63 /mcm 0.85036,0.85036,0.582,90,90,120 AlB2 family - 7.60 X 23286
Sr-Te SrTe hp CsCl,cP2,221 Pm-3m 0.3708,0.3708,0.3708,90,90,90 b.c.c. family - 7.01 X 18416
Sr-Te SrTe rt NaCl,cF8,225 Fm-3m 0.6663,0.6663,0.6663,90,90,90 rocksalt family yellow 4.83 X 28378
Sr-Tl SrTl CsCl,cP2,221 Pm-3m 0.4038,0.4038,0.4038,90,90,90 b.c.c. family - 7.36 X 2996
Sr-Tl SrTl2 CaIn2,hP6,194 P63 /mmc 0.5074,0.5074,0.8217,90,90,120 AlB2 family - 9.00 X 2405
Sr-Tl SrTl3 SrPb3,tP4,123 P4/mmm 0.4882,0.4882,0.4843,90,90,90 close-packed structure - 10.08 X 2996
Sr-Tl Sr3Tl *,oP*,* - 0.5771,0.8073,2.3723,90,90,90 - - - N 2996
Sr-Tl Sr3Tl5 Pu3Pd5,oS32,63 Cmcm 1.0604,0.8675,1.0985,90,90,90 - white silver8.44 X 59344
Sr-Tl Sr5Tl3 Cr5B3,tI32,140 I4/mcm 0.8635,0.8635,1.6389,90,90,90 - - 5.71 A 11624
Sr-Zn SrZn FeB-b,oP8,62 Pnma 0.8724,0.4607,0.6417,90,90,90 CrB(TlI)-FeB - 3.94 X 15269
Sr-Zn SrZn11 BaCd11,tI48,141 I41/amd 1.0749,1.0749,0.6899,90,90,90 - - 6.72 X 47874
Sr-Zn SrZn13 NaZn13,cF112,226 Fm-3c 1.2222,1.2222,1.2222,90,90,90 - - 6.82 X 46673
Sr-Zn SrZn2 orth KHg2,oI12,74 Imma 0.4779,0.7795,0.782,90,90,90 AlB2 family - 4.98 X 2104
Sr-Zn SrZn5 ht CaCu5,hP6,191 P6/mmm 0.5541,0.5541,0.4282,90,90,120 - gray silver 6.05 X 49745
Sr-Zn SrZn5 rt SrZn5,oP24,62 Pnma 1.3133,0.52991,0.66972,90,90,90 - gray silver 5.91 X 49745
T-U UT3 ht UH3,cP32,223 Pm-3n 0.6625,0.6625,0.6625,90,90,90 - - 11.29 A 9954
T-U UT3 rt Cr3Si,cP8,223 Pm-3n 0.4142,0.4142,0.4142,90,90,90 Frank-Kasper phase - 11.55 X 9954
Ta-Tc TaTc CsCl,cP2,221 Pm-3m 0.3172,0.3172,0.3172,90,90,90 b.c.c. family - 14.51 X 1682
Ta-Tc Ta0.17 Tc0.83 Mn,cI58,217 I-43m 0.9565,0.9565,0.9565,90,90,90 - - 12.34 A 1490
Ta-Te TaTe *,hR*,166 R-3m 1.0904,1.0904,2.0102,90,90,120 - - - N 1693
Ta-Te TaTe2 hex TaTe2,mS54,12 C12/m1 1.4792,1.08829,0.93005,90,110.693,90 - - 9.31 X 47216
Ta-Te TaTe2 mon NbTe2,mS18,12 C12/m1 1.4784,0.36372,0.9345,90,110.926,90 - - 9.26 X 47216
Ta-Te TaTe4 hp *,oS20,63 Cmcm 0.3618,1.3272,0.8685,90,90,90 - - - N 3880
Ta-Te TaTe4 TaTe4,tP60,130 P4/ncc 0.9204,0.9204,2.0401,90,90,90 - black 7.97 X 27547
Ta-Te Ta2Te3 Ta2Te3,mS20,12 C12/m1 1.4495,0.34996,1.2237,90,123.25,90 - - 9.53 X 26152
Ta-Te Ta21Te13 Ta21Te13,hP136,183 P6mm 1.95,1.95,1.03,90,90,120 - - 10.69 X 37878
Ta-Te Ta97Te60 Ta97Te60,oP628,19 P212121 2.0613,2.7627,2.7627,90,90,90 - - 10.64 X 39896
Ta-Ti Ti0.5 Ta0.5 W,cI2,229 Im-3m 0.3287,0.3287,0.3287,90,90,90 b.c.c. family - 10.70 X 447
Ta-Ti Ti0.75 Ta0.25 m (Cu0.75 Ti0.25),oS4,63 Cmcm 0.3101,0.486,0.4624,90,90,90 close-packed structure - 7.74 A 53131
Ta-Ti Ti0.9 Ta0.1 m Mg,hP2,194 P63 /mmc 0.2932,0.2932,0.4682,90,90,120 close-packed structure - 5.83 X 53131
Ta-Ti Ti0.96 Ta0.04 rt Mg,hP2,194 P63 /mmc 0.2937,0.2937,0.46,90,90,120 close-packed structure - 5.14 X 532
Ta-V TaV2 ht MgZn2,hP12,194 P63 /mmc 0.5058,0.5058,0.825,90,90,120 Friauf-Laves phase - 10.28 A 2649
Ta-V TaV2 rt MgCu2,cF24,227 Fd-3m 0.716,0.716,0.716,90,90,90 Friauf-Laves phase - 10.24 X 3115
Ta-V Ta0.5 V0.5 ht W,cI2,229 Im-3m 0.3175,0.3175,0.3175,90,90,90 b.c.c. family - 12.03 X 21083
Ta-W Ta0.5 W0.5 ht W,cI2,229 Im-3m 0.323,0.323,0.323,90,90,90 b.c.c. family - 17.98 X 6970
Ta-Zn Zn2Ta hex1 MgZn2,hP12,194 P63 /mmc 0.507,0.507,0.821,90,90,120 Friauf-Laves phase - 11.33 A 4130
Ta-Zn Zn2Ta hex2 MgNi2,hP24,194 P63 /mmc 0.504,0.504,1.621,90,90,120 Friauf-Laves phase - 11.61 A 4130
Ta-Zn Zn7Ta6 W6Fe7,hR39,166 R-3m 0.5035,0.5035,2.7528,90,90,120 Frank-Kasper phase - 12.72 A 4130
Ta-Zr Zr0.1 Ta0.9 W,cI2,229 Im-3m 0.3318,0.3318,0.3318,90,90,90 b.c.c. family - 15.64 X 4591
Tb-Tc TbTc2 MgZn2,hP12,194 P63 /mmc 0.5375,0.5375,0.8843,90,90,120 Friauf-Laves phase - 10.66 A 2225
Tb-Te TbTe lt NiO,hR6,166 R-3m 0.43064,0.43064,1.06017,90,90,120 - - 8.38 X 12039
Tb-Te TbTe rt NaCl,cF8,225 Fm-3m 0.611,0.611,0.611,90,90,90 rocksalt family gray 8.34 X 20081
Handbook of Inorganic Substances – Edition 2015 : Data 173

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Tb-Te TbTe 2 UAs2,tP6,129 P4/nmm 0.4334,0.4334,0.89,90,90,90 - - 8.23 A 20081


Tb-Te TbTe 3 NdTe 3,oS16,63 Cmcm 0.431,2.552,0.431,90,90,90 - - 7.59 A 18466
Tb-Te Tb0.5 Te0.5 tf Po,cP1,221 Pm-3m 0.31465,0.31465,0.31465,90,90,90 - - 7.64 X 7727
Tb-Te Tb2Te 3 rt Sc2S3,oF80,70 Fddd 0.8679,1.2276,2.6037,90,90,90 - - 6.71 X 2549
Tb-Te Tb2.67 Te4 ht Th3P 4,cI28,220 I-43d 0.8677,0.8677,0.8677,90,90,90 - - 9.50 A 16097
Tb-Te Tb5Te 9 Tb5Te9,tP60,75 P4 0.9607,0.9607,1.7875,90,90,90 - - 7.82 X 48543
Tb-Th Th0.43 Tb0.57 rt Cu,cF4,225 Fm-3m 0.5035,0.5035,0.5035,90,90,90 close-packed structure - 9.91 X 4836
Tb-Tl TlTb lt CuTi,tP2,123 P4/mmm 0.353,0.353,0.424,90,90,90 b.c.c. family - 11.42 X 14458
Tb-Tl TlTb rt CsCl,cP2,221 Pm-3m 0.376,0.376,0.376,90,90,90 b.c.c. family gray silver 11.35 X 2673
Tb-Tl TlTb2 Co1.75 Ge,hP6,194 P63/mmc 0.5362,0.5362,0.6663,90,90,120 AlB2 family - 10.45 X 21290
Tb-Tl Tl3 Tb Cu3Au,cP4,221 Pm-3m 0.468,0.468,0.468,90,90,90 close-packed structure - 12.51 X 3135
Tb-Tl Tl3 Tb5 Tl+ Cr5B3,tI32,140 I4/mcm 0.8073,0.8073,1.4281,90,90,90 - - 10.05 A 21290
Tb-Tl Tl3 Tb5 ht Mn5 Si3,hP16,193 P63/mcm 0.8978,0.8978,0.6596,90,90,120 - - 10.15 X 4709
Tb-Tl Tl3 Tb5 rt W5Si3,tI32,140 I4/mcm 1.2126,1.2126,0.6135,90,90,90 - - 10.37 A 21290
Tb-Tl Tl5 Tb3 Pu3Pd5,oS32,63 Cmcm 0.999,0.806,1.035,90,90,90 - - 11.94 A 14288
Tb-Zn ZnTb lt1 CuTi,tP2,123 P4/mmm 0.3579,0.3579,0.3563,90,90,90 b.c.c. family - 8.16 X 8492
Tb-Zn ZnTb rt CsCl,cP2,221 Pm-3m 0.3577,0.3577,0.3577,90,90,90 b.c.c. family gray silver 8.14 X 8492
Tb-Zn Zn11 Tb3 La3Al11,oI28,71 Immm 0.4408,0.8825,1.2989,90,90,90 - - 7.86 A 5331
Tb-Zn Zn12 Tb ThMn12,tI26,139 I4/mmm 0.8856,0.8856,0.5199,90,90,90 CaCu5-Zr4Al3 - 7.68 A 2632
Tb-Zn Zn17 Tb2 ht Zn17 Th2,hR57,166 R-3m 0.89787,0.89787,1.31482,90,90,120 CaCu5-Zr4Al3 gray 7.76 X 20156
Tb-Zn Zn17 Tb2 rt Th2Ni17,hP38,194 P63/mmc 0.8984,0.8984,0.877,90,90,120 CaCu5-Zr4Al3 - 7.74 X 2632
Tb-Zn Zn2Tb KHg2,oI12,74 Imma 0.4481,0.7122,0.7576,90,90,90 AlB2 family - 7.96 X 6756
Tb-Zn Zn23 Tb6 Th6Mn23,cF116,225 Fm-3m 1.269,1.269,1.269,90,90,90 - - 7.99 A 2632
Tb-Zn Zn3Tb Zn3Y,oP16,62 Pnma 0.669,0.4411,1.0104,90,90,90 - - 7.91 A 5331
Tb-Zn Zn58 Tb13 Zn58 Gd13,hP142,194 P63/mmc 1.4332,1.4332,1.4104,90,90,120 - - 7.75 A 45789
Tb-Zn Zn59 Tb13 Zn59 Tb13,oP288,19 P212121 1.4008,1.4304,2.4803,90,90,90 - - 7.92 X 47696
Tb-Zr Tb0.2 Zr0.8 m Mg,hP2,194 P63/mmc 0.329,0.329,0.5215,90,90,120 close-packed structure - 7.12 X 6916
Tc-Te TcTe 2 *,mS48,15 C12/c1 1.2522,0.7023,1.3828,90,101.26,90 - - - N 6022
Tc-Te Tc2Te 5 Re2Te5,oP84,61 Pbca 1.2917,1.4237,1.2987,90,90,90 Chevrel phase - 6.96 X 54131
Tc-Th ThTc 2 MgZn2,hP12,194 P63/mmc 0.5394,0.5394,0.9222,90,90,120 Friauf-Laves phase - 12.24 A 2679
Tc-Ti TiTc rt CsCl,cP2,221 Pm-3m 0.311,0.311,0.311,90,90,90 b.c.c. family - 8.05 X 1682
Tc-Ti Ti0.125 Tc0.875 Mn,cI58,217 I-43m 0.9579,0.9579,0.9579,90,90,90 - - 10.05 A 1490
Tc-Tm TmTc 2 MgZn2,hP12,194 P63/mmc 0.5334,0.5334,0.8775,90,90,120 Friauf-Laves phase - 11.21 A 2225
Tc-U U2Tc *,mS12,* - 0.5213,0.3271,1.3407,90,96.38,90 - - - N 2679
Tc-V VTc CsCl,cP2,221 Pm-3m 0.302,0.302,0.302,90,90,90 b.c.c. family - 8.98 X 4100
Tc-V V0.05 Tc0.95 Mg,hP2,194 P63/mmc 0.2737,0.2737,0.4405,90,90,120 close-packed structure - 11.12 X 4100
Tc-V V0.7 Tc0.3 W,cI2,229 Im-3m 0.3015,0.3015,0.3015,90,90,90 b.c.c. family - 7.88 X 4100
Tc-W W0.15 Tc0.85 Mg,hP2,194 P63/mmc 0.2753,0.2753,0.4444,90,90,120 close-packed structure - 12.62 X 18389
Tc-W W0.4 Tc0.6 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9526,0.9526,0.5,90,90,90 Frank-Kasper phase - 14.53 A 18389
Tc-W W0.5 Tc0.5 W,cI2,229 Im-3m 0.3118,0.3118,0.3118,90,90,90 b.c.c. family - 15.44 X 18389
Tc-Y YTc 2 MgZn2,hP12,194 P63/mmc 0.5371,0.5371,0.8862,90,90,120 Friauf-Laves phase - 8.55 A 14287
Tc-Zn Zn7Tc CuPt7,cF32,225 Fm-3m 0.7588,0.7588,0.7588,90,90,90 close-packed structure - 8.45 X 2238
Tc-Zr ZrTc 2 MgZn2,hP12,194 P63/mmc 0.5216,0.5216,0.86345,90,90,120 Friauf-Laves phase - 9.38 X 54297
Tc-Zr Zr0.138 Tc0.862 Mn,cI58,217 I-43m 0.96104,0.96104,0.96104,90,90,90 - - 10.53 X 54297
Te-Th ThTe hp CsCl,cP2,221 Pm-3m 0.3827,0.3827,0.3827,90,90,90 b.c.c. family - 10.66 X 21158
Te-Th ThTe 2 *,hP*,* - 0.849,0.849,0.901,90,90,120 - black - N 1222
Te-Th ThTe 3 ZrSe 3,mP8,11 P121/m1 0.614,0.431,1.044,90,98.4,90 - black 7.47 A 1222
Te-Th Th7.6 Te11.4 *,hP*,176 P63/m 1.249,1.249,0.4354,90,90,120 - - - N 1222
Te-Ti TiTe NiAs,hP4,194 P63/mmc 0.3834,0.3834,0.639,90,90,120 AlB2 family black 7.17 X 325
Te-Ti TiTe 2 CdI2 ,hP3,164 P-3m1 0.3777,0.3777,0.6498,90,90,120 CdI2-PbI2 polytype black 6.27 X 14417
Te-Ti Ti0.95 Te0.05 ht W,cI2,229 Im-3m 0.33065,0.33065,0.33065,90,90,90 b.c.c. family - 4.77 X 28830
Te-Ti Ti0.995 Te0.005 rt Mg,hP2,194 P63/mmc 0.2951,0.2951,0.4683,90,90,120 close-packed structure - 4.54 X 23522
Te-Ti Ti2 Te 3 hex *,h**,* - 0.3874,0.3874,1.2723,90,90,120 - black - N 28830
Te-Ti Ti3 Te 4 ht *,h**,* - 0.3887,0.3887,1.269,90,90,120 - brown - N 28830
Te-Ti Ti3 Te 4 rt Cr3S4,mS14,12 C12/m1 1.43777,0.38406,0.69232,90,118.316,90 - - 6.45 A 28830
Te-Ti Ti5 Te 4 rt Ti5 Te4,tI18,87 I4/m 1.0164,1.0164,0.3772,90,90,90 Chevrel phase gray dark 6.39 X 1396
Te-Ti Ti5 Te 8 V5S8 ,mS26,12 C12/m1 1.26683,0.77,0.927,90,132.635,90 - - 6.29 A 29407
Te-Ti Tix Te Se,hP3,152 P3121 0.446,0.446,0.593,90,90,120 - - 6.22 A 23522
Te-Tl TlTe lt TlTe,tP64,137 P42/nmc 1.8229,1.8229,0.6157,90,90,90 - - 8.62 X 37544
Te-Tl TlTe rt TlTe-b,tI32,140 I4/mcm 1.2953,1.2953,0.6173,90,90,90 - - 8.52 X 37544
Te-Tl Tl2 Te Tl2 Te,mS132,15 C12/c1 1.56621,0.89873,3.1196,90,100.761,90 - gray dark 9.08 X 39765
Te-Tl Tl2 Te 3 Tl2 Te3,mS20,15 C12/c1 1.3275,0.6562,0.7918,90,107.14,90 - gray silver 7.98 X 36618
Te-Tl Tl3 Te 2 tf *,hR*,166 R-3m 0.9,0.9,2.19,90,90,120 - - - N 2953
Te-Tl Tl5 Te 3 In5Bi3,tI32,140 I4/mcm 0.893,0.893,1.2589,90,90,90 - - 9.29 X 23049
Te-Tm TmTe hp TmTe,tP2,99 P4mm 0.408,0.408,0.297,90,90,90 - - 9.96 X 30309
Te-Tm TmTe rt NaCl,cF8,225 Fm-3m 0.636,0.636,0.636,90,90,90 rocksalt family gray 7.66 X 18153
Te-Tm TmTe 2 UAs2,tP6,129 P4/nmm 0.424,0.424,0.8831,90,90,90 - - 8.87 A 5233
Te-Tm TmTe 3 NdTe 3,oS16,63 Cmcm 0.427,2.534,0.427,90,90,90 - - 7.93 A 18466
Te-Tm Tm0.77 Te NiO,hR6,166 R-3m 0.4309,0.4309,1.0838,90,90,120 rocksalt family blue 7.37 X 22417
Te-Tm Tm2 Te3 Sc2S3,oF80,70 Fddd 0.8552,1.2096,2.5656,90,90,90 - - 7.21 X 2549
Te-Tm Tm2 Te5 Nd2Te5,oS28,63 Cmcm 0.444,4.497,0.444,90,90,90 - - 7.31 A 10114
Te-U UTe hp CsCl,cP2,221 Pm-3m 0.3765,0.3765,0.3765,90,90,90 b.c.c. family - 11.38 X 23434
Te-U UTe lt NiO,hR6,166 R-3m 0.43197,0.43197,1.06588,90,90,120 rocksalt family - 10.58 X 46621
Te-U UTe rt NaCl,cF8,225 Fm-3m 0.6153,0.6153,0.6153,90,90,90 rocksalt family - 10.43 X 31927
Te-U UTe 1.87 ht UAs2,tP6,129 P4/nmm 0.4243,0.4243,0.8946,90,90,90 - - 9.83 X 4697
Te-U UTe 2 UTe 2,oI12,71 Immm 0.41622,0.61329,1.3971,90,90,90 - black gray 9.19 X 32132
Te-U UTe 3 ZrSe 3,mP8,11 P121/m1 0.6097,0.42206,1.0312,90,97.87,90 - black 7.84 X 32398
Te-U UTe 3.38 *,tP*,* - 0.8703,0.8703,1.3086,90,90,90 - - - N 6082
174 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Te-U UTe3.4 *,oP*,* - 0.6382,0.6475,1.2408,90,90,90 - - - N 26052


Te-U UTe5 UTe5,oP24,62 Pnma 1.7915,1.0407,0.4220,90,90,90 - - 7.40 X 17933
Te-U UTex stab Cu,cF4,225 Fm-3m 0.488,0.488,0.488,90,90,90 close-packed structure - 13.60 X 7286
Te-U U2Te3 Th2S3,oP20,62 Pnma 1.218,0.4377,1.1823,90,90,90 - gray 9.05 X 34303
Te-U U2Te5 U2Te5,mS28,12 C12/m1 3.442,0.4181,0.6074,90,95.43,90 - black 8.50 X 33289
Te-U U2.25 Te3.32 ht Th3P 4,cI28,220 I-43d 0.94,0.94,0.94,90,90,90 - - 7.67 X 30190
Te-U U3Te5 U3Te5,oP32,62 Pnma 1.6098,0.4210,1.4060,90,90,90 - gray 9.43 X 34830
Te-U U7Te12 Cr12P 7,hP19,174 P-6 1.2312,1.2312,0.426,90,90,120 - - 9.49 X 34358
Te-V VTe2 ht CdI2,hP3,164 P-3m1 0.3636,0.3636,0.651,90,90,120 CdI2 -PbI2 polytype - 6.82 A 19100
Te-V VTe2 rt NbTe2,mS18,12 C12/m1 1.43409,0.35947,0.9069,90,109.57,90 - - 6.92 X 17250
Te-V V0.86 Te ht NiAs,hP4,194 P63 /mmc 0.395,0.395,0.617,90,90,120 AlB2 family - 6.83 X 15402
Te-V V2 Te3 rt *,mP*,* - 0.6429,0.3831,1.26,90,90.82,90 - - - N 2418
Te-V V3 Te4 rt Cr3S4,mS14,12 C12/m1 1.40999,0.3715,0.6687,90,117.003,90 - - 7.06 X 22931
Te-V V4.64 Te4 Nb4.7 Te4,mS18,12 C12/m1 1.38526,0.393,0.939,90,133.864,90 Chevrel phase gray silver 6.73 X 33914
Te-V V5 Te8 rt V5S8,mS26,12 C12/m1 1.2591,0.7584,0.89349,90,133.89,90 - - 6.89 A 19100
Te-W WTe2 WTe2,oP12,31 Pmn21 0.3477,0.6249,1.4018,90,90,90 - - 9.57 X 26020
Te-Y YTe NaCl,cF8,225 Fm-3m 0.6103,0.6103,0.6103,90,90,90 rocksalt family gray 6.33 X 57162
Te-Y YTe2 hp UAs2,tP6,129 P4/nmm 0.4291,0.4291,0.8912,90,90,90 - - 6.96 A 5233
Te-Y YTe3 NdTe3,oS16,63 Cmcm 0.4303,2.549,0.4303,90,90,90 - - 6.64 A 18466
Te-Y Y2 Te3 Sc2S3,oF80,70 Fddd 0.8645,1.2228,2.5935,90,90,90 - - 5.43 X 2549
Te-Y Y7 Te2 Y7 Te2,oP36,62 Pnma 2.13282,0.40562,1.1401,90,90,90 - - 5.91 X 49061
Te-Y Y8 Te3 Ti8S3,mS88,12 C12/m1 3.1153,0.40703,2.4375,90,122.8,90 - - 5.59 A 34383
Te-Yb YbTe NaCl,cF8,225 Fm-3m 0.6345,0.6345,0.6345,90,90,90 rocksalt family - 7.82 X 26032
Te-Yb YbTe2 UAs2,tP6,129 P4/nmm 0.421,0.421,0.882,90,90,90 - - 9.10 A 18444
Te-Yb Yb2 Te3 Sc2S3,oF80,70 Fddd 0.898,1.27,2.693,90,90,90 - - 6.31 A 18444
Te-Zn ZnTe hp1 HgS,hP6,152 P3121 0.4092,0.4092,0.9376,90,90,120 - - 7.07 X 28504
Te-Zn ZnTe hp2 ZnTe,hP6,144 P31 0.4045,0.4045,0.9342,90,90,120 - - 7.26 X 28503
Te-Zn ZnTe hp3 ZnTe,oS8,63 Cmcm 0.5379,0.5971,0.5010,90,90,90 - - 7.97 X 29381
Te-Zn ZnTe hp4 NaCl,cF8,225 Fm-3m 0.537,0.537,0.537,90,90,90 - - 8.28 X 27998
Te-Zn ZnTe rhom SiC,hR30,160 R3m 0.437,0.437,5.3,90,90,120 adamantane structure - 5.48 A 1271
Te-Zn ZnTe rt ZnS,cF8,216 F-43m 0.6106,0.6106,0.6106,90,90,90 adamantane structure red 5.63 X 30748
Te-Zn ZnTe tf ZnO,hP4,186 P63 mc 0.4303,0.4303,0.7088,90,90,120 adamantane structure - 5.64 A 44723
Te-Zn ZnTe2 CdI2,hP3,164 P-3m1 0.398,0.398,0.525,90,90,120 CdI2 -PbI2 polytype - 7.39 X 26361
Te-Zr ZrTe ht FeAs,oP8,62 Pnma 0.73915,0.37723,0.69434,90,90,90 AlB2 family - 7.51 X 38743
Te-Zr ZrTe ht2 WC,hP2,187 P-6m2 0.37706,0.37706,0.38605,90,90,120 AlB2 family gray silver 7.64 X 36771
Te-Zr ZrTe3 rt ZrSe3,mP8,11 P121/m1 0.5898,0.39269,1.0103,90,97.81,90 - black 6.79 X 34799
Te-Zr ZrTe5 mon1 *,mP12,11 P121/m1 0.412,1.37,0.71468,90,101.56,90 - - - N 20320
Te-Zr ZrTe5 mon2 *,mS*,* - 1.459,0.398,3.129,90,96.7,90 - - - N 18574
Te-Zr ZrTe5 rt HfTe5,oS24,63 Cmcm 0.39875,1.453,1.3724,90,90,90 - - 6.09 X 19625
Te-Zr Zr0.65 Te 4H Ti0.62 S,hP8,186 P63 mc 0.3984,0.3984,1.3366,90,90,120 - black 6.76 X 34350
Te-Zr Zr0.92 Te ht1 NiAs,hP4,194 P63 /mmc 0.3962,0.3962,0.6693,90,90,120 AlB2 family brown gray 7.72 X 12572
Te-Zr Zr0.92 Te *,o**,* - 0.391,0.70635,2.03096,90,90,90 - - - N 33235
Te-Zr Zr0.99 Te0.01 rt Mg,hP2,194 P63 /mmc 0.3246,0.3246,0.5198,90,90,120 close-packed structure - 6.41 X 5734
Te-Zr Zr2Te Sc2Te,oP36,62 Pnma 1.995,0.38236,1.06563,90,90,90 - - 7.60 X 35747
Te-Zr Zr3Te Ni3P,tI32,82 I-4 1.1327,1.1327,0.56264,90,90,90 - gray silver 7.38 X 31752
Te-Zr Zr5Te4 Ti5 Te4,tI18,87 I4/m 1.0766,1.0766,0.3842,90,90,90 Chevrel phase gray silver 7.21 X 36765
Te-Zr Zr5Te6 Zr5Te6,hP33,164 P-3m1 1.1728,1.1728,0.707,90,90,120 - - 7.23 X 37007
Te-Zr ZrxTe Se,hP3,152 P3121 0.446,0.446,0.593,90,90,120 - - 6.22 A 22507
Th-Tl TlTh ThIn,oP24,57 Pbcm 1.077,0.9932,0.6554,90,90,90 - - 12.40 X 18141
Th-Tl TlTh2 CuAl2,tI12,140 I4/mcm 0.7708,0.7708,0.6212,90,90,90 - - 12.03 A 18141
Th-Tl Tl3 Th Cu3Au,cP4,221 Pm-3m 0.4751,0.4751,0.4751,90,90,90 close-packed structure - 13.09 X 18141
Th-Tl Tl3 Th5 Mn5Si3,hP16,193 P63 /mcm 0.9388,0.9388,0.642,90,90,120 - - 12.02 A 18141
Th-Tl Tl5 Th3 Pu3Pd5,oS32,63 Cmcm 1.0249,0.826,1.0419,90,90,90 - - 12.94 A 18141
Th-Tm Th0.805 Tm0.195 rt Cu,cF4,225 Fm-3m 0.5083,0.5083,0.5083,90,90,90 close-packed structure - 11.11 X 6933
Th-U Th0.925 U0.075 rt Cu,cF4,225 Fm-3m 0.5154,0.5154,0.5154,90,90,90 close-packed structure - 11.28 X 1018
Th-Y Y0.47 Th0.53 ht W,cI2,229 Im-3m 0.41,0.41,0.41,90,90,90 b.c.c. family - 7.94 X 1321
Th-Y Y0.49 Th0.51 rt Cu,cF4,225 Fm-3m 0.5078,0.5078,0.5078,90,90,90 close-packed structure - 8.21 X 4836
Th-Y Y0.67 Th0.33 rt Mg,hP2,194 P63 /mmc 0.3431,0.3431,0.5802,90,90,120 close-packed structure - 7.64 X 1258
Th-Zn ZnTh2 CuAl2,tI12,140 I4/mcm 0.7614,0.7614,0.5658,90,90,90 - - 10.72 X 6743
Th-Zn Zn17Th2 hex Th2Ni17,hP38,194 P63 /mmc 0.9032,0.9032,0.8929,90,90,120 CaCu5-Zr4Al3 - 8.30 A 3579
Th-Zn Zn17Th2 rhom Zn17Th2,hR57,166 R-3m 0.903,0.903,1.32,90,90,120 CaCu5-Zr4Al3 - 8.42 X 800
Th-Zn Zn2Th AlB2,hP3,191 P6/mmm 0.42,0.42,0.417,90,90,120 AlB2 family - 9.46 X 801
Th-Zn Zn4Th BaAl4,tI10,139 I4/mmm 0.426,0.426,1.04,90,90,90 - - 8.69 X 801
Th-Zr Th0.1 Zr0.9 rt Mg,hP2,194 P63 /mmc 0.3258,0.3258,0.5248,90,90,120 close-packed structure - 7.25 X 11618
Th-Zr Th0.2 Zr0.8 m *,o**,* - 0.3392,0.5332,0.5541,90,90,90 - - - N 11618
Th-Zr Th0.3 Zr0.7 ht W,cI2,229 Im-3m 0.37272,0.37272,0.37272,90,90,90 b.c.c. family - 8.56 X 12445
Th-Zr Th0.9 Zr0.1 rt Cu,cF4,225 Fm-3m 0.502,0.502,0.502,90,90,90 close-packed structure - 11.44 X 1143
Ti-Tl Tl0.8 Ti3.2 Cr3Si,cP8,223 Pm-3n 0.5256,0.5256,0.5256,90,90,90 Frank-Kasper phase - 7.25 X 3745
Ti-U U0.5 Ti0.5 ht W,cI2,229 Im-3m 0.337,0.337,0.337,90,90,90 b.c.c. family - 12.41 X 629
Ti-U U0.996 Ti0.004 rt U,oS4,63 Cmcm 0.2861,0.58234,0.49736,90,90,90 close-packed structure - 19.02 X 17995
Ti-U U2Ti rt Hg2U,hP3,191 P6/mmm 0.48238,0.48238,0.28481,90,90,120 AlB2 family - 15.16 X 41639
Ti-V Ti0.5 V0.5 W,cI2,229 Im-3m 0.3158,0.3158,0.3158,90,90,90 b.c.c. family - 5.21 X 20767
Ti-V Ti0.84 V0.16 hp (Ti0.95 Cr0.05),hP3,164 P-3m1 0.45795,0.45795,0.27933,90,90,120 - - 4.75 X 35828
Ti-V Ti0.981 V0.019 rt Mg,hP2,194 P63 /mmc 0.2976,0.2976,0.4725,90,90,120 close-packed structure - 4.39 X 55163
Ti-W Ti0.90 W0.10 ht W,cI2,229 Im-3m 0.3255,0.3255,0.3255,90,90,90 b.c.c. family - 5.92 X 4590
Ti-Zn ZnTi CsCl,cP2,221 Pm-3m 0.315,0.315,0.315,90,90,90 b.c.c. family - 6.02 X 1782
Ti-Zn ZnTi2 CuZr2,tI6,139 I4/mmm 0.304,0.304,1.068,90,90,90 close-packed structure - 5.42 A 2862
Ti-Zn Zn16Ti Zn16Ti,oS68,63 Cmcm 0.7699,1.1414,1.18,90,90,90 - gray 7.01 X 30653
Handbook of Inorganic Substances – Edition 2015 : Data 175

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ti-Zn Zn2Ti MgZn2,hP12,194 P63/mmc 0.5064,0.5064,0.821,90,90,120 Friauf-Laves phase - 6.51 X 639


Ti-Zn Zn22.16 Ti2.84 Zn22 (Zn0.16 Ti0.84 )Ti2,tP100,135 P42/mbc 1.1523,1.1523,1.1456,90,90,90 - gray 6.92 X 30653
Ti-Zn Zn3Ti Cu3Au,cP4,221 Pm-3m 0.39322,0.39322,0.39322,90,90,90 close-packed structure - 6.67 X 639
Ti-Zr Zr0.11 Ti0.89 ht W,cI2,229 Im-3m 0.3353,0.3353,0.3353,90,90,90 b.c.c. family - 4.64 X 58557
Ti-Zr Zr0.5 Ti0.5 rt Mg,hP2,194 P63/mmc 0.312,0.312,0.49,90,90,120 close-packed structure - 5.59 X 20571
Ti-Zr Zr0.504 Ti0.496 ht-hp Ti,hP3,191 P6/mmm 0.45198,0.45198,0.27787,90,90,120 - - 7.07 X 47314
Tl-Tm TlTm CsCl,cP2,221 Pm-3m 0.3711,0.3711,0.3711,90,90,90 b.c.c. family gray silver 12.13 X 2673
Tl-Tm Tl3 Tm Cu3Au,cP4,221 Pm-3m 0.4657,0.4657,0.4657,90,90,90 close-packed structure - 12.86 X 3135
Tl-Tm Tl3 Tm5 Mn5 Si3,hP16,193 P63/mcm 0.8798,0.8798,0.6495,90,90,120 - - 11.12 A 4709
Tl-U Tl3U Cu3Au,cP4,221 Pm-3m 0.4688,0.4688,0.4688,90,90,90 close-packed structure - 13.72 X 7733
Tl-Y TlY ht CsCl,cP2,221 Pm-3m 0.3751,0.3751,0.3751,90,90,90 b.c.c. family - 9.23 X 1568
Tl-Y Tl3Y Cu3Au,cP4,221 Pm-3m 0.4685,0.4685,0.4685,90,90,90 close-packed structure - 11.34 X 22425
Tl-Y Tl3Y5 Mn5 Si3,hP16,193 P63/mcm 0.8935,0.8935,0.6594,90,90,120 - - 7.70 A 22425
Tl-Y Tl5Y3 Pu3Pd5,oS32,63 Cmcm 0.9965,0.808,1.037,90,90,90 - - 10.25 A 14288
Tl-Yb TlYb CsCl,cP2,221 Pm-3m 0.3826,0.3826,0.3826,90,90,90 b.c.c. family gray silver 11.19 X 2673
Tl-Yb TlYb2 Co2Si-b,oP12,62 Pnma 0.7217,0.527,0.9821,90,90,90 - - 9.79 X 22424
Tl-Yb Tl3Yb Cu3Au,cP4,221 Pm-3m 0.4613,0.4613,0.4613,90,90,90 close-packed structure - 13.30 X 2405
Tl-Yb Tl3Yb8 Ca8In3,aP22,2 P-1 0.9489,0.95569,0.9646,98.977,101.3,119.598 - - 9.31 X 22424
Tl-Zr Tl0.8 Zr3.2 Cr3Si,cP8,223 Pm-3n 0.5626,0.5626,0.5626,90,90,90 Frank-Kasper phase - 8.49 X 3745
Tm-Zn ZnTm rt CsCl,cP2,221 Pm-3m 0.3514,0.3514,0.3514,90,90,90 b.c.c. family gray silver 8.97 X 24131
Tm-Zn Zn12 Tm ThMn12,tI26,139 I4/mmm 0.8852,0.8852,0.519,90,90,90 CaCu5-Zr4Al3 - 7.79 X 3579
Tm-Zn Zn17 Tm2 ht Zn17 Th2,hR57,166 R-3m 0.89374,0.89374,1.31089,90,90,120 CaCu5-Zr4Al3 gray 7.96 X 20156
Tm-Zn Zn17 Tm2 rt Th2Ni17,hP38,194 P63/mmc 0.8939,0.8939,0.8736,90,90,120 CaCu5-Zr4Al3 - 7.96 A 2632
Tm-Zn Zn2Tm KHg2,oI12,74 Imma 0.4433,0.6944,0.7604,90,90,90 AlB2 family - 8.50 A 3312
Tm-Zn Zn23 Tm6 Th6Mn23,cF116,225 Fm-3m 1.256,1.256,1.256,90,90,90 - - 8.44 A 3117
Tm-Zn Zn3Tm Zn3Y,oP16,62 Pnma 0.6661,0.433,0.9997,90,90,90 - - 8.41 A 5331
Tm-Zn Zn5Tm Zn5Er,hP36,194 P63/mmc 0.8833,0.8833,0.9147,90,90,120 - - 7.99 A 6030
Tm-Zn Zn58.64 Tm12.88 Zn58.82 Er12.89 ,oP312,33 Pna21 1.3948,2.4515,1.4165,90,90,90 - - 8.24 X 48452
U-Zn Zn11.76 U1.12 rt Zn11.74 U1.13 ,hP45,191 P6/mmm 0.895,0.895,0.8902,90,90,120 CaCu5-Zr4Al3 - 8.35 X 5666
U-Zn Zn17 U2 ht Th2Ni17,hP38,194 P63/mmc 0.8962,0.8962,0.8809,90,90,120 CaCu5-Zr4Al3 - 8.60 X 1538
U-Zn Zn17 U2 rt Zn17 Th2,hR57,166 R-3m 0.89812,0.89812,1.31625,90,90,120 CaCu5-Zr4Al3 - 8.60 X 20156
U-Zr U0.5 Zr0.5 ht W,cI2,229 Im-3m 0.3546,0.3546,0.3546,90,90,90 b.c.c. family - 12.26 X 18390
U-Zr U0.87 Zr2.13 rt Hg2U,hP3,191 P6/mmm 0.50317,0.50317,0.30888,90,90,120 AlB2 family - 9.84 X 30356
V-W V0.7 W0.3 W,cI2,229 Im-3m 0.306,0.306,0.306,90,90,90 b.c.c. family - 10.53 X 3742
V-Zn Zn3V Cu3Au,cP4,221 Pm-3m 0.3848,0.3848,0.3848,90,90,90 close-packed structure - 7.20 X 2021
V-Zn Zn5V4 Zn5V4,tI18,139 I4/mmm 0.891,0.891,0.3224,90,90,90 b.c.c. family - 6.89 X 2429
V-Zr ZrV2 ht MgZn2,hP12,194 P63/mmc 0.5277,0.5277,0.8647,90,90,120 Friauf-Laves phase - 6.15 A 220
V-Zr ZrV2 rt MgCu2,cF24,227 Fd-3m 0.7482,0.7482,0.7482,90,90,90 Friauf-Laves phase - 6.12 X 35965
V-Zr Zr0.013 V0.987 W,cI2,229 Im-3m 0.3025,0.3025,0.3025,90,90,90 b.c.c. family - 6.17 X 18441
V-Zr Zr0.33 V0.67 m Cu,cF4,225 Fm-3m 0.4232,0.4232,0.4232,90,90,90 close-packed structure - 5.63 X 51156
V-Zr Zr2V stab Ti2Ni,cF96,227 Fd-3m 1.2153,1.2153,1.2153,90,90,90 - - 6.91 A 3743
W-Zr ZrW2 MgCu2,cF24,227 Fd-3m 0.7613,0.7613,0.7613,90,90,90 Friauf-Laves phase - 13.82 X 16140
W-Zr Zr0.035W0.965 W,cI2,229 Im-3m 0.3171,0.3171,0.3171,90,90,90 b.c.c. family - 18.81 X 4691
W-Zr Zr0.33 W0.67 ht W,cI2,229 Im-3m 0.3172,0.3172,0.3172,90,90,90 b.c.c. family - 15.95 X 16140
W-Zr Zr0.65 W0.35 ht W,cI2,229 Im-3m 0.331,0.331,0.331,90,90,90 b.c.c. family - 11.32 X 5320
W-Zr Zr3W5 stab W5Si3,tI32,140 I4/mcm 0.95,0.95,0.485,90,90,90 - - 18.10 A 1413
Y-Yb Y0.2 Yb0.8 hp Cu,cF4,225 Fm-3m 0.5358,0.5358,0.5358,90,90,90 close-packed structure - 6.75 X 22427
Y-Yb Y0.3 Yb0.7 hp Nd,hP4,194 P63/mmc 0.3758,0.3758,1.2192,90,90,120 close-packed structure - 6.58 X 22427
Y-Yb Y0.5 Yb0.5 hp Mg,hP2,194 P63/mmc 0.3686,0.3686,0.5967,90,90,120 close-packed structure - 6.20 X 22427
Y-Zn ZnY lt CsCl,cP2,221 Pm-3m 0.35769,0.35769,0.35769,90,90,90 b.c.c. family - 5.60 X 5996
Y-Zn Zn11 Y3 La3Al11,oI28,71 Immm 0.4388,0.8871,1.2929,90,90,90 - - 6.51 A 5331
Y-Zn Zn12 Y ThMn12,tI26,139 I4/mmm 0.8861,0.8861,0.5205,90,90,90 CaCu5-Zr4Al3 - 7.10 A 2632
Y-Zn Zn17 Y2 hex Th2Ni17,hP38,194 P63/mmc 0.8991,0.8991,0.8764,90,90,120 CaCu5-Zr4Al3 - 6.98 A 2632
Y-Zn Zn17 Y2 ht Zn17 Th2,hR57,166 R-3m 0.89719,0.89719,1.31414,90,90,120 CaCu5-Zr4Al3 - 7.01 X 20156
Y-Zn Zn23 Y6 Th6Mn23,cF116,225 Fm-3m 1.269,1.269,1.269,90,90,90 - - 6.62 A 2632
Y-Zn Zn3Y Zn3Y,oP16,62 Pnma 0.6690,0.4405,1.0111,90,90,90 - - 6.35 X 3809
Y-Zn Zn5Y Zn5Er,hP36,194 P63/mmc 0.8885,0.8885,0.9207,90,90,120 - - 6.58 A 6030
Y-Zn Zn58.7 Y12.65 Zn58.7 Y12.65 ,hP146,194 P63/mmc 1.424,1.424,1.400,90,90,120 - - 6.70 X 6373
Y-Zr Y0.6 Zr0.4 m Mg,hP2,194 P63/mmc 0.3477,0.3477,0.5495,90,90,120 close-packed structure - 5.19 X 6916
Yb-Zn ZnYb CsCl,cP2,221 Pm-3m 0.3629,0.3629,0.3629,90,90,90 b.c.c. family gray silver 8.28 X 2673
Yb-Zn Zn11 Yb BaCd11,tI48,141 I41/amd 1.0643,1.0643,0.68079,90,90,90 - - 7.69 X 53393
Yb-Zn Zn11 Yb3 La3Al11,oI28,71 Immm 0.4421,0.8889,1.3122,90,90,90 - - 7.98 A 5331
Yb-Zn Zn13 Yb NaZn13,cF112,226 Fm-3c 1.215,1.215,1.215,90,90,90 - - 7.58 A 3117
Yb-Zn Zn17 Yb2 hex Th2Ni17,hP38,194 P63/mmc 0.9022,0.9022,0.8798,90,90,120 CaCu5-Zr4Al3 - 7.81 A 3117
Yb-Zn Zn17 Yb2 rhom Zn17 Th2,hR57,166 R-3m 0.90336,0.90336,1.32135,90,90,120 CaCu5-Zr4Al3 gray 7.78 X 20156
Yb-Zn Zn2Yb rt orth KHg2,oI12,74 Imma 0.4573,0.7325,0.7569,90,90,90 AlB2 family - 7.96 X 2502
Yb-Zn Zn58 Yb13 Zn58 Gd13,hP142,194 P63/mmc 1.4317,1.4317,1.4173,90,90,120 - - 7.98 A 54250
Yb-Zn Zn73.42 Yb12.52 Zn6.95 (Zn0.94Al0.06)66 Yb12.70 ,cI194,204 Im-3 1.4298,1.4298,1.4298,90,90,90 - - 7.92 X 51638
Zn-Zr ZnZr CsCl,cP2,221 Pm-3m 0.3336,0.3336,0.3336,90,90,90 b.c.c. family - 7.00 X 4856
Zn-Zr ZnZr2 CuZr2,tI6,139 I4/mmm 0.33,0.33,1.126,90,90,90 close-packed structure - 6.71 A 2862
Zn-Zr Zn2Zr MgCu2,cF24,227 Fd-3m 0.73927,0.73927,0.73927,90,90,90 Friauf-Laves phase - 7.30 X 16422
Zn-Zr Zn2Zr3 Zr3Al2,tP20,136 P42/mnm 0.7633,0.7633,0.6965,90,90,90 - - 6.62 A 1373
Zn-Zr Zn21.80 Zr Zn22 Zr,cF184,227 Fd-3m 1.4105,1.4105,1.4105,90,90,90 - gray 7.18 X 31997
Zn-Zr Zn3Zr (C) *,c**,* - 1.27,1.27,1.27,90,90,90 - - - N 1150
Zn-Zr Zn3Zr rt *,tI64,* - 0.816,0.816,1.623,90,90,90 - - 7.07 N 2862
Zn-Zr Zn38.92 Zr5 Zn39 Zr5,mS88,12 C12/m1 1.7855,0.8596,1.2546,90,134.40,90 - gray 7.24 X 31997
Handbook of Inorganic Substances – Edition 2015 : Data 177

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ac-Br-O AcBrO PbClF,tP6,129 P4/nmm 0.428,0.428,0.741,90,90,90 - - 7.90 A 309


Ac-Cl-O AcClO PbClF,tP6,129 P4/nmm 0.425,0.425,0.708,90,90,90 - - 7.23 A 309
Ac-F-O AcOF CaF2 ,cF12,225 Fm-3m 0.5943,0.5943,0.5943,90,90,90 fluorite family - 8.29 X 367
Ag-Al-Ba BaAg0.3 Al3.7 CeAl2Ga2,tI10,139 I4/mmm 0.4528,0.4528,1.1453,90,90,90 - - 3.81 X 23588
Ag-Al-Ba BaAg2.4 Al2.6 BaAg2(Ag0.4 Al0.6 )Al2,oS24,63 Cmcm 1.1026,0.8723,0.552,90,90,90 - gray silver 5.83 X 24862
Ag-Al-Ba BaAg5.59 Al7.41 NaZn13,cF112,226 Fm-3c 1.2677,1.2677,1.2677,90,90,90 - - 6.13 A 35768
Ag-Al-Ba Ba3Ag14.6 Al6.4 Ba3Ag12(Ag0.4 Al0.6 )6 Al3,hP24,189 P-62m 0.8913,0.8913,0.7278,90,90,120 - gray silver 7.16 X 24862
Ag-Al-Ba Ba8Ag3.5 Al13.5 Ba8(Ag0.4 Al0.6 )8Al9,mP50,14 P121/c1 0.6182,2.0041,1.22625,90,120.174,90 - - 4.65 X 24862
Ag-Al-Ca CaAgAl MgZn2,hP12,194 P63/mmc 0.5698,0.5698,0.9177,90,90,120 Friauf-Laves phase - 4.50 X 49663
Ag-Al-Ca CaAg0.4 Al1.6 MgNi2,hP24,194 P63/mmc 0.5698,0.5698,1.8418,90,90,120 Friauf-Laves phase - 3.24 X 49663
Ag-Al-Ca CaAg0.7 Al3.3 CeAl2Ga2,tI10,139 I4/mmm 0.4193,0.4193,1.1794,90,90,90 - - 3.28 X 23588
Ag-Al-Ca CaAg0.77 Al1.23 MgZn2,hP12,194 P63/mmc 0.5716,0.5716,0.9133,90,90,120 Friauf-Laves phase gray 4.02 X 24845
Ag-Al-Ca CaAg1.24 Al1.76 CeNi3,hP24,194 P63/mmc 0.5597,0.5597,1.8002,90,90,120 Laves-CaCu5 gray 4.52 X 24845
Ag-Al-Ca CaAg2.2 Al2.8 PrNi2Al3,hP6,191 P6/mmm 0.5521,0.5521,0.443,90,90,120 - gray silver 5.01 X 27375
Ag-Al-Ca Ca3Ag12 Al21 Ca3Ag(Ag0.35 Al0.65)32 ,cP36,221 Pm-3m 0.8685,0.8685,0.8685,90,90,90 - - 5.02 X 18075
Ag-Al-Ca Ca3Ag2 Al7 Ca3Cu2Al7,hR36,166 R-3m 0.5614,0.5614,2.6788,90,90,120 Laves-CaCu5 gray 3.58 X 24845
Ag-Al-Ce AgCeAl KHg2,oI12,74 Imma 0.4706,0.7516,0.7942,90,90,90 AlB2 family - 6.50 A 50734
Ag-Al-Ce AgCeAl3 BaAl4,tI10,139 I4/mmm 0.432,0.432,1.1043,90,90,90 - - 5.30 A 52258
Ag-Al-Ce Ag0.6 CeAl3.4 CeAl2Ga2,tI10,139 I4/mmm 0.4322,0.4322,1.1052,90,90,90 - - 4.77 X 23588
Ag-Al-Ce Ag0.87 CeAl2.13 PuNi3,hR36,166 R-3m 0.5637,0.5637,2.6913,90,90,120 Laves-CaCu5 - 5.88 A 21419
Ag-Al-Ce Ag2.7 Ce3Al6.3 Ca3Cu2Al7,hR36,166 R-3m 0.5637,0.5637,2.6913,90,90,120 Laves-CaCu5 gray 5.93 X 24845
Ag-Al-Ce Ag3CeAl2 PrNi2Al3,hP6,191 P6/mmm 0.5565,0.5565,0.4521,90,90,120 - gray silver 7.09 X 27375
Ag-Al-Ce Ag3.1 CeAl7.9 BaHg11,cP36,221 Pm-3m 0.8653,0.8653,0.8653,90,90,90 - - 5.29 A 21419
Ag-Al-Ce Ag6.39 CeAl4.61 BaCd11,tI48,141 I41/amd 1.10466,1.10466,0.71101,90,90,90 - - 7.30 X 29051
Ag-Al-Ce Ag6.5 Ce1.8 Al10.5 Th2Ni17,hP38,194 P63/mmc 0.9332,0.9332,0.9129,90,90,120 CaCu5-Zr4Al3 gray silver 5.97 X 26140
Ag-Al-Ce Ag7.44 Ce1.62 Al9.91 Ag0.3 (Ag0.46 Al0.54)17Dy1.7 ,hP42,194 P63/mmc 0.93742,0.93742,0.91525,90,90,120 - - 6.18 X 29051
Ag-Al-Ce Ag8.8 Ce2Al8.2 Zn17 Th2,hR57,166 R-3m 0.9403,0.9403,1.3687,90,90,120 CaCu5-Zr4Al3 gray silver 6.90 X 26140
Ag-Al-Cu Ag0.005Cu0.004 Al0.991 Cu,cF4,225 Fm-3m 0.40472,0.40472,0.40472,90,90,90 close-packed structure - 2.76 X 1002
Ag-Al-Dy AgDyAl KHg2,oI12,74 Imma 0.4576,0.7125,0.7859,90,90,90 AlB2 family - 7.71 A 37142
Ag-Al-Dy Ag0.55 DyAl3.45 Ce(Ni0.59 Sb0.41 )4,oI10,71 Immm 0.4296,0.4179,0.9995,90,90,90 - - 5.83 X 24046
Ag-Al-Dy Ag2.3 Dy3Al8.7 La3Al11,oI28,71 Immm 0.4302,0.9981,1.253,90,90,90 - - 5.99 X 37386
Ag-Al-Dy Ag2.4 DyAl2.6 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63/mmc 0.9132,0.9132,0.9414,90,90,120 - - 7.20 X 26724
Ag-Al-Dy Ag5.6 DyAl6.4 ThMn12,tI26,139 I4/mmm 0.9143,0.9143,0.5434,90,90,90 CaCu5-Zr4Al3 - 6.87 X 26685
Ag-Al-Dy Ag8.1 Dy1.75 Al9.2 Ag0.3 (Ag0.46Al0.54)17Dy1.7 ,hP42,194 P63/mmc 0.9285,0.9285,0.9098,90,90,120 - - 6.88 X 24583
Ag-Al-Dy Ag8.5 Dy4Al24.5 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.8793,0.8793,1.68,90,90,90 - - 5.70 X 26685
Ag-Al-Er AgErAl KHg2,oI12,74 Imma 0.455,0.7023,0.7854,90,90,90 AlB2 family - 8.00 A 37142
Ag-Al-Er Ag2.5 ErAl2.5 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63/mmc 0.913,0.913,0.9336,90,90,120 - - 7.46 A 28073
Ag-Al-Er Ag8.5 Er4Al24.5 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.8772,0.8772,1.6691,90,90,90 - - 5.81 A 26685
Ag-Al-Eu Ag0.88 EuAl3.12 BaAl4,tI10,139 I4/mmm 0.43147,0.43147,1.1471,90,90,90 - - 5.15 A 29476
Ag-Al-Eu Ag2.5 EuAl2.5 PrNi2Al3,hP6,191 P6/mmm 0.5577,0.5577,0.4464,90,90,120 - - 6.75 X 28073
Ag-Al-Eu Ag3.5 EuAl7.5 BaHg11,cP36,221 Pm-3m 0.87208,0.87208,0.87208,90,90,90 - - 5.50 X 53970
Ag-Al-Eu Ag5.07 EuAl5.93 BaCd11,tI48,141 I41/amd 1.10613,1.10613,0.71302,90,90,90 - - 6.54 X 52004
Ag-Al-F AgAlF4 RbFeF4,oP24,18 P21212 0.7108,0.7111,0.5568,90,90,90 - white 4.98 A 12865
Ag-Al-F Ag3 AlF6 ht [NH4]3FeF6,cF40,225 Fm-3m 0.8101,0.8101,0.8101,90,90,90 perovskite family - 5.80 A 21878
Ag-Al-Gd Ag0.36 GdAl1.64 MgCu2,cF24,227 Fd-3m 0.79096,0.79096,0.79096,90,90,90 Friauf-Laves phase - 6.45 X 43074
Ag-Al-Gd Ag0.7 GdAl0.3 CsCl,cP2,221 Pm-3m 0.3634,0.3634,0.3634,90,90,90 b.c.c. family - 8.33 X 43074
Ag-Al-Gd Ag0.8 GdAl1.2 KHg2,oI12,74 Imma 0.45899,0.72479,0.7889,90,90,90 AlB2 family - 6.98 X 43074
Ag-Al-Gd Ag10 Gd4Al23 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.88177,0.88177,1.68624,90,90,90 - - 5.90 X 43074
Ag-Al-Gd Ag2Gd3 Al7 Ca3Cu2Al7,hR36,166 R-3m 0.55668,0.55668,2.6382,90,90,120 Laves-CaCu5 - 6.17 X 43074
Ag-Al-Gd Ag2.3 GdAl2.7 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63/mmc 0.92305,0.92305,0.94111,90,90,120 - - 6.86 X 43074
Ag-Al-Gd Ag2.55 Gd3Al8.45 La3Al11,oI28,71 Immm 0.43306,1.00145,1.26706,90,90,90 - - 5.89 X 43074
Ag-Al-Gd Ag3.5 GdAl1.5 (Ag0.73 Al0.27 )5Sm,hP12,189 P-62m 0.54,0.54,0.9268,90,90,120 - - 8.16 A 43074
Ag-Al-Gd Ag5.2 GdAl6.8 ht ThMn12,tI26,139 I4/mmm 0.91555,0.91555,0.54318,90,90,90 CaCu5-Zr4Al3 - 6.58 X 38104
Ag-Al-Gd Ag9.3 Gd1.85 Al7.7 Th2Ni17,hP38,194 P63/mmc 0.93026,0.93026,0.90991,90,90,120 CaCu5-Zr4Al3 - 7.31 X 43074
Ag-Al-Hf Ag0.43 HfAl1.57 MgCu2,cF24,227 Fd-3m 0.74631,0.74631,0.74631,90,90,90 Friauf-Laves phase - 8.54 X 42157
Ag-Al-Hf Ag1.09 Hf6Al5.91 W6Fe7,hR39,166 R-3m 0.5337,0.5337,2.911,90,90,120 Frank-Kasper phase - 9.35 X 49533
Ag-Al-Hf Ag1.1 Hf4Al1.9 (Ag0.37 Al0.63 )3Hf4,hP7,174 P-6 0.5332,0.5332,0.54279,90,90,120 - - 10.98 X 42157
Ag-Al-Ho Ag0.12 HoAl2.88 Cu3Au,cP4,221 Pm-3m 0.42364,0.42364,0.42364,90,90,90 close-packed structure - 5.58 X 54202
Ag-Al-Ho Ag0.8 HoAl1.2 KHg2,oI12,74 Imma 0.4551,0.7065,0.78572,90,90,90 AlB2 family - 7.46 A 54202
Ag-Al-Ho Ag0.8 HoAl2.2 PuNi3,hR36,166 R-3m 0.55195,0.55195,2.616,90,90,120 Laves-CaCu5 - 6.73 A 54202
Ag-Al-Ho Ag2.1 Ho3Al8.9 La3Al11,oI28,71 Immm 0.42983,0.99721,1.25215,90,90,90 - - 5.95 X 37386
Ag-Al-Ho Ag2.5 HoAl2.5 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63/mmc 0.9146,0.9146,0.935,90,90,120 - - 7.39 A 28073
Ag-Al-Ho Ag5.6 HoAl6.4 ThMn12,tI26,139 I4/mmm 0.913,0.913,0.5432,90,90,90 CaCu5-Zr4Al3 - 6.91 A 26685
Ag-Al-Ho Ag8.5 Ho4Al24.5 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.8774,0.8774,1.6705,90,90,90 - - 5.78 A 26685
Ag-Al-La AgLaAl KHg2,oI12,74 Imma 0.4729,0.7659,0.797,90,90,90 AlB2 family - 6.30 A 37142
Ag-Al-La Ag1.2 La2Al6.8 (Ag0.4 Al0.6 )3La2Al5,tP20,129 P4/nmm 0.618,0.618,1.1051,90,90,90 - - 4.65 X 33902
Ag-Al-La Ag2.21 La0.47 Al2.79 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63/mmc 0.9408,0.9408,0.9144,90,90,120 - - 5.39 A 29051
Ag-Al-La Ag3LaAl2 PrNi2Al3,hP6,191 P6/mmm 0.5513,0.5513,0.4513,90,90,120 - gray silver 7.22 X 27375
Ag-Al-La Ag6LaAl5 BaCd11,tI48,141 I41/amd 1.1065,1.1065,0.7123,90,90,90 - - 7.02 A 29051
Ag-Al-La Ag6.5 La1.8 Al10.5 Th2Ni17,hP38,194 P63/mmc 0.9404,0.9404,0.9153,90,90,120 CaCu5-Zr4Al3 gray silver 5.85 X 26140
Ag-Al-La Ag9.7 La2Al7.3 Zn17 Th2,hR57,166 R-3m 0.9451,0.9451,1.3726,90,90,120 CaCu5-Zr4Al3 gray silver 7.14 X 26140
Ag-Al-Li LiAg0.062 Al0.938 NaTl,cF16,227 Fd-3m 0.6364,0.6364,0.6364,90,90,90 b.c.c. family - 2.01 X 14500
Ag-Al-Li LiAg2 Al Li2AgSb,cF16,216 F-43m 0.63124,0.63124,0.63124,90,90,90 b.c.c. family - 6.59 X 43857
Ag-Al-Li Li1.745 Ag0.218 Al1.034 MgAgAs,cF12,216 F-43m 0.6344,0.6344,0.6344,90,90,90 - - 1.65 X 43857
Ag-Al-Li Li2AgAl Li2AgSb,cF16,216 F-43m 0.635,0.635,0.635,90,90,90 b.c.c. family pink 3.86 X 4311
Ag-Al-Lu Ag2.5 LuAl2.5 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63/mmc 0.9063,0.9063,0.9344,90,90,120 - - 7.68 A 28073
Ag-Al-Mg Mg0.067 Ag0.003 Al0.930 Cu,cF4,225 Fm-3m 0.4076,0.4076,0.4076,90,90,90 close-packed structure - 2.65 X 897
Ag-Al-Mg Mg0.95 Ag0.01 Al0.04 Mg,hP2,194 P63/mmc 0.3182,0.3182,0.5171,90,90,120 close-packed structure - 1.85 X 253
178 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Al-Mg Mg30Ag19 Al24 Mg30Ag19Al24,cP146,200 Pm-3 1.45,1.45,1.45,90,90,90 - - 3.73 X 33272


Ag-Al-Mg Mg32Ag13 Al36 Mg32Ag13Al36,cI162,204 Im-3 1.45,1.45,1.45,90,90,90 - - 3.43 X 33272
Ag-Al-Mg Mg32Ag8Al41 Mg32(Zn0.65 Al0.35)49,cI162,204 Im-3 1.452,1.452,1.452,90,90,90 Frank-Kasper phase - 2.98 A 2942
Ag-Al-Mn AgxMn1.1 Al0.9 CuAu,tP2,123 P4/mmm 0.2786,0.2786,0.358,90,90,90 close-packed structure - 5.06 X 6929
Ag-Al-Nd AgNdAl KHg2,oI12,74 Imma 0.4661,0.7417,0.7903,90,90,90 AlB2 family - 6.79 A 37142
Ag-Al-Nd Ag0.6 NdAl3.4 BaAl4,tI10,139 I4/mmm 0.42744,0.42744,1.1126,90,90,90 - - 4.91 X 29476
Ag-Al-Nd Ag2.21 Nd0.47 Al2.79 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63 /mmc 0.9344,0.9344,0.913,90,90,120 - - 5.51 A 29051
Ag-Al-Nd Ag2.5 NdAl2.5 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63 /mmc 0.93,0.93,0.9515,90,90,120 - - 6.73 A 28073
Ag-Al-Nd Ag3.50 NdAl1.50 (Ag0.73 Al0.27 )5Sm,hP12,189 P-62m 0.5436,0.5436,0.9303,90,90,120 - - 7.84 A 35902
Ag-Al-O AgAlO2 hex AgFeO2,hP8,194 P63 /mmc 0.2896,0.2896,1.2219,90,90,120 - yellow pale 6.24 X 14114
Ag-Al-O AgAlO2 orth NaFeO2,oP16,33 Pna21 0.54306,0.69802,0.53751,90,90,90 adamantane structure - 5.44 X 43551
Ag-Al-O AgAl11O17 AgAl11O17 ,hP68,194 P63 /mmc 0.55913,0.55913,2.25293,90,90,120 β-alumina brown 3.68 X 23608
Ag-Al-Pr Ag0.3 PrAl1.7 MgCu2,cF24,227 Fd-3m 0.817,0.817,0.817,90,90,90 Friauf-Laves phase - 5.34 X 3595
Ag-Al-Pr Ag0.52 PrAl1.48 AlB2,hP3,191 P6/mmm 0.4216,0.4216,0.42128,90,90,120 AlB2 family - 6.07 X 35929
Ag-Al-Pr Ag0.60 PrAl0.40 rt CsCl,cP2,221 Pm-3m 0.3738,0.3738,0.3738,90,90,90 b.c.c. family - 6.88 X 35929
Ag-Al-Pr Ag0.7 PrAl3.3 CeAl2Ga2,tI10,139 I4/mmm 0.4303,0.4303,1.1067,90,90,90 - - 4.95 X 23588
Ag-Al-Pr Ag1.4 PrAl0.6 KHg2,oI12,74 Imma 0.467,0.7448,0.7899,90,90,90 AlB2 family - 7.45 A 55404
Ag-Al-Pr Ag1.43 Pr3Al9.57 rt La3Al11,oI28,71 Immm 0.4296,1.0137,1.3074,90,90,90 - - 4.87 A 35929
Ag-Al-Pr Ag10Pr2Al7 Zn17Th2,hR57,166 R-3m 0.9417,0.9417,1.3673,90,90,120 CaCu5-Zr4Al3 gray silver 7.35 X 26140
Ag-Al-Pr Ag13Pr6Al10 Th6Mn23,cF116,225 Fm-3m 1.3271,1.3271,1.3271,90,90,90 - - 7.15 A 21419
Ag-Al-Pr Ag2.42 PrAl2.58 CaCu5,hP6,191 P6/mmm 0.5506,0.5506,0.4417,90,90,120 - gray silver 6.75 X 35929
Ag-Al-Pr Ag3PrAl2 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63 /mmc 0.9321,0.9321,0.9582,90,90,120 - - 7.17 A 35929
Ag-Al-Pr Ag3.15 Pr3Al5.85 Ca3Cu2Al7 ,hR36,166 R-3m 0.5632,0.5632,2.7045,90,90,120 Laves-CaCu5 gray 6.17 X 24845
Ag-Al-Pr Ag3.5 PrAl1.5 (Ag0.73 Al0.27 )5Sm,hP12,189 P-62m 0.54498,0.54498,0.9332,90,90,120 - - 7.73 A 35929
Ag-Al-Pr Ag5.9 PrAl5.1 BaCd11,tI48,141 I41/amd 1.10262,1.10262,0.70979,90,90,90 - - 7.04 X 35929
Ag-Al-Pr Ag8.85 Pr1.65 Al8.85 Th2Ni17,hP38,194 P63 /mmc 0.93484,0.93484,0.91033,90,90,120 CaCu5-Zr4Al3 - 6.87 X 35929
Ag-Al-Pt Ag0.5 PtAl0.5 NiAs,hP4,194 P63 /mmc 0.4096,0.4096,0.544,90,90,120 AlB2 family - 11.03 X 6345
Ag-Al-S AgAlS2 hp CuScS2,hP4,156 P3m1 0.35,0.35,0.684,90,90,120 - - 4.55 X 8670
Ag-Al-S AgAlS2 CuFeS2,tI16,122 I-42d 0.5695,0.5695,1.026,90,90,90 adamantane structure brown 3.97 X 538
Ag-Al-S Ag0.5 Al2.5 S4 MgAl2O4,cF56,227 Fd-3m 1.0052,1.0052,1.0052,90,90,90 spinel family - 3.27 X 1420
Ag-Al-S Ag9 AlS6 ht Ag9 AlS6,cF208,216 F-43m 1.0739,1.0739,1.0739,90,90,90 - black 6.38 X 47734
Ag-Al-S Ag9 AlS6 rt *,o**,* - 0.7365,0.7654,1.0604,90,90,90 - black - N 13498
Ag-Al-Sc Ag2ScAl Cu2MnAl,cF16,225 Fm-3m 0.6564,0.6564,0.6564,90,90,90 b.c.c. family - 6.76 X 20154
Ag-Al-Se AgAlSe2 CuFeS2,tI16,122 I-42d 0.5956,0.5956,1.075,90,90,90 adamantane structure brown 5.10 X 538
Ag-Al-Se Ag9 AlSe6 rt Ag9 AlSe6,cF244,216 F-43m 1.10947,1.10947,1.10947,90,90,90 - black 7.16 X 39578
Ag-Al-Si Ag0.75 Al0.2 Si0.05 rt Mn,cP20,213 P4132 0.708,0.708,0.708,90,90,90 - - 8.21 A 10607
Ag-Al-Sm Ag0.78 SmAl1.22 MgCu2,cF24,227 Fd-3m 0.79542,0.79542,0.79542,90,90,90 Friauf-Laves phase - 7.06 X 31746
Ag-Al-Sm Ag0.9 SmAl0.1 CsCl,cP2,221 Pm-3m 0.368,0.368,0.368,90,90,90 b.c.c. family - 8.34 X 31746
Ag-Al-Sm Ag1.15 SmAl1.85 PuNi3,hR36,166 R-3m 0.55903,0.55903,2.656,90,90,120 Laves-CaCu5 - 6.74 X 31746
Ag-Al-Sm Ag1.46 SmAl0.54 KHg2,oI12,74 Imma 0.4656,0.7237,0.7951,90,90,90 AlB2 family - 7.99 X 31746
Ag-Al-Sm Ag10.9 Sm2 Al6.1 Zn17Th2,hR57,166 R-3m 0.937,0.937,1.3641,90,90,120 CaCu5-Zr4Al3 - 7.88 X 31746
Ag-Al-Sm Ag2.43 Sm3 Al8.57 La3Al11,oI28,71 Immm 0.4326,1.0079,1.2747,90,90,90 - - 5.64 A 31746
Ag-Al-Sm Ag2.6 SmAl2.5 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63 /mmc 0.92272,0.92272,0.94821,90,90,120 - - 7.10 X 28073
Ag-Al-Sm Ag3.65 SmAl1.35 (Ag0.73 Al0.27 )5Sm,hP12,189 P-62m 0.54081,0.54081,0.92583,90,90,120 - - 8.22 X 35902
Ag-Al-Sm Ag7.5 Sm1.6 Al9.5 Ag0.3 (Ag0.46 Al0.54)17Dy1.7 ,hP42,194 P63 /mmc 0.9318,0.9318,0.9111,90,90,120 - - 6.33 A 29051
Ag-Al-Sr SrAg0.8 Al3.2 CeAl2Ga2,tI10,139 I4/mmm 0.4343,0.4343,1.161,90,90,90 - - 3.95 X 23588
Ag-Al-Sr SrAg2.5 Al2.5 PrNi2Al3,hP6,191 P6/mmm 0.5633,0.5633,0.4479,90,90,120 - gray silver 5.73 X 27375
Ag-Al-Sr SrAg7.36 Al5.64 NaZn13,cF112,226 Fm-3c 1.2543,1.2543,1.2543,90,90,90 - black 6.96 X 18075
Ag-Al-Tb AgTbAl3 Ce(Ni0.59 Sb0.41 )4,oI10,71 Immm 0.4189,0.4304,1.0003,90,90,90 - - 6.40 A 24046
Ag-Al-Tb Ag0.24 TbAl1.76 MgCu2,cF24,227 Fd-3m 0.78676,0.78676,0.78676,90,90,90 Friauf-Laves phase - 6.34 X 38856
Ag-Al-Tb Ag0.5 TbAl0.5 CsCl,cP2,221 Pm-3m 0.3607,0.3607,0.3607,90,90,90 b.c.c. family - 8.01 X 38856
Ag-Al-Tb Ag0.9 TbAl2.1 PuNi3,hR36,166 R-3m 0.55461,0.55461,2.6286,90,90,120 Laves-CaCu5 - 6.67 X 38856
Ag-Al-Tb Ag1.1 TbAl0.9 KHg2,oI12,74 Imma 0.45866,0.71666,0.78652,90,90,90 AlB2 family - 7.76 X 38856
Ag-Al-Tb Ag10.55 Tb4 Al22.45 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.88099,0.88099,1.6771,90,90,90 - - 6.07 X 38856
Ag-Al-Tb Ag2.5 Tb3Al8.5 La3Al11,oI28,71 Immm 0.43026,1.0016,1.25972,90,90,90 - - 5.97 X 38856
Ag-Al-Tb Ag2.7 TbAl2.5 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63 /mmc 0.91739,0.91739,0.94151,90,90,120 - - 7.52 X 38856
Ag-Al-Tb Ag5.5 TbAl6.5 ThMn12,tI26,139 I4/mmm 0.91442,0.91442,0.54461,90,90,90 CaCu5-Zr4Al3 - 6.77 X 38104
Ag-Al-Tb Ag8.6 Tb1.8 Al8.4 Th2Ni17,hP38,194 P63 /mmc 0.92815,0.92815,0.90715,90,90,120 CaCu5-Zr4Al3 - 7.07 X 38856
Ag-Al-Te AgAlTe2 CuFeS2,tI16,122 I-42d 0.6296,0.6296,1.183,90,90,90 adamantane structure brown 5.52 X 538
Ag-Al-Th Ag0.5 Th2Al0.5 CuAl2,tI12,140 I4/mcm 0.768,0.768,0.575,90,90,90 - - 10.41 A 6743
Ag-Al-Ti Ag0.32 Ti1.04 Al2.64 Cu3Au,cP4,221 Pm-3m 0.39882,0.39882,0.39882,90,90,90 close-packed structure - 4.07 X 26692
Ag-Al-Tm Ag2.5 TmAl2.5 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63 /mmc 0.9085,0.9085,0.9348,90,90,120 - - 7.55 A 28073
Ag-Al-Tm Ag8.5 Tm4 Al24.5 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.8768,0.8768,1.6599,90,90,90 - - 5.87 A 26685
Ag-Al-Y AgYAl3 Ce(Ni0.59 Sb0.41 )4,oI10,71 Immm 0.4184,0.4295,1.0039,90,90,90 - - 5.11 A 24046
Ag-Al-Y Ag0.11 YAl1.89 MgCu2,cF24,227 Fd-3m 0.78609,0.78609,0.78609,90,90,90 Friauf-Laves phase - 4.15 X 37321
Ag-Al-Y Ag0.4 YAl0.6 CsCl,cP2,221 Pm-3m 0.36145,0.36145,0.36145,90,90,90 b.c.c. family - 5.21 X 37321
Ag-Al-Y Ag0.6 YAl1.4 KHg2,oI12,74 Imma 0.45399,0.71551,0.78712,90,90,90 AlB2 family - 4.97 X 37321
Ag-Al-Y Ag1.5 Y3 Al9.5 La3Al11,oI28,71 Immm 0.42827,1.00312,1.26026,90,90,90 - - 4.20 X 37297
Ag-Al-Y Ag2 Y3 Al7 Ca3Cu2Al7 ,hR36,166 R-3m 0.55422,0.55422,2.6259,90,90,120 Laves-CaCu5 - 4.79 X 37321
Ag-Al-Y Ag2.5 YAl2.7 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63 /mmc 0.91523,0.91523,0.94167,90,90,120 - - 6.29 X 37297
Ag-Al-Y Ag3.8 YAl1.2 *,h**,* - 0.5362,0.5362,0.9198,90,90,120 - - - N 37321
Ag-Al-Y Ag5.2 YAl6.8 ThMn12,tI26,139 I4/mmm 0.91303,0.91303,0.54645,90,90,90 CaCu5-Zr4Al3 - 6.08 X 37297
Ag-Al-Y Ag8.3 Y1.8 Al8.7 Th2Ni17,hP38,194 P63 /mmc 0.92852,0.92852,0.90702,90,90,120 CaCu5-Zr4Al3 - 6.33 X 37297
Ag-Al-Y Ag9.7 Y4 Al23.3 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.88277,0.88277,1.66994,90,90,90 - - 5.18 X 37297
Ag-Al-Yb AgYbAl MgZn2,hP12,194 P63 /mmc 0.5663,0.5663,0.9087,90,90,120 Friauf-Laves phase - 8.10 X 37142
Ag-Al-Yb Ag0.3 YbAl1.7 MgCu2,cF24,227 Fd-3m 0.7915,0.7915,0.7915,90,90,90 Friauf-Laves phase gray 6.73 X 24845
Ag-Al-Yb Ag1.33 YbAl1.67 CeNi3,hP24,194 P63 /mmc 0.559,0.559,1.7908,90,90,120 Laves-CaCu5 gray 7.43 X 24845
Ag-Al-Yb Ag2.37 Yb3 Al6.63 Ca3Cu2Al7 ,hR36,166 R-3m 0.5555,0.5555,2.6384,90,90,120 Laves-CaCu5 gray 6.74 X 24845
Handbook of Inorganic Substances – Edition 2015 : Data 179

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Al-Yb Ag2.5 YbAl2.5 Ag0.2 (Ag0.55 Al0.45)4...,hP42,194 P63/mmc 0.936,0.936,0.9418,90,90,120 - - 7.11 A 28073
Ag-Al-Yb Ag7 Yb1.8 Al10 Th2Ni17,hP38,194 P63/mmc 0.935,0.935,0.9111,90,90,120 CaCu5-Zr4Al3 gray silver 6.43 X 26140
Ag-Al-Yb Ag9 Yb2 Al8 Zn17 Th2,hR57,166 R-3m 0.94,0.94,1.3661,90,90,120 CaCu5-Zr4Al3 gray silver 7.30 X 26140
Ag-Al-Yb Ag9.25 Yb4 Al23.75 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.8898,0.8898,1.6612,90,90,90 - - 5.89 X 48829
Ag-Al-Zn Ag0.04 Zn0.02 Al0.94 cub Cu,cF4,225 Fm-3m 0.40488,0.40488,0.40488,90,90,90 close-packed structure - 3.10 X 53540
Ag-Al-Zn Ag0.04 Zn0.02 Al0.94 hex Mg,hP2,194 P63/mmc 0.2872,0.2872,0.4553,90,90,120 close-packed structure - 3.16 X 53540
Ag-Al-Zr AgZr6Al6 W6Fe7,hR39,166 R-3m 0.5393,0.5393,2.9092,90,90,120 Frank-Kasper phase - 5.56 X 42157
Ag-Al-Zr Ag0.16 ZrAl1.84 MgCu2,cF24,227 Fd-3m 0.75147,0.75147,0.75147,90,90,90 Friauf-Laves phase - 4.95 X 38105
Ag-Al-Zr Ag0.32 ZrAl2.68 Cu3Au,cP4,221 Pm-3m 0.41016,0.41016,0.41016,90,90,90 close-packed structure - 4.77 X 38105
Ag-As-Ba BaAgAs BeZrSi,hP6,194 P63/mmc 0.4613,0.4613,0.8896,90,90,120 AlB2 family gray 6.49 X 12867
Ag-As-Ba BaAg2As2 CeAl2Ga2,tI10,139 I4/mmm 0.46025,0.46025,1.08672,90,90,90 - - 7.26 X 58959
Ag-As-Ca CaAgAs ZrNiAl,hP9,189 P-62m 0.7204,0.7204,0.427,90,90,120 Fe2P family gray 5.79 X 12868
Ag-As-Ce AgCeAs2 orth AgCeAs2,oP32,57 Pbcm 0.57852,2.1066,0.57586,90,90,90 - black 7.53 X 44019
Ag-As-Ce AgCeAs2 tet CuHfSi2,tP8,129 P4/nmm 0.40845,0.40845,1.0482,90,90,90 - gray 7.56 X 42505
Ag-As-Cu Ag6Cu14 As7 Ag6Cu14 As7,cP116,221 Pm-3m 1.17808,1.17808,1.17808,90,90,90 kutinaite - 8.37 X 39879
Ag-As-Dy AgDyAs2 *,oP8,59 Pmmn 0.39452,0.39573,1.0378,90,90,90 - - - N 38770
Ag-As-Eu AgEuAs BeZrSi,hP6,194 P63/mmc 0.4516,0.4516,0.8107,90,90,120 AlB2 family blue gray 7.76 X 14785
Ag-As-Eu Ag4EuAs2 SrAg4 As2,hR48,166 R-3m 0.45352,0.45352,2.37221,90,90,120 - - 8.65 X 58944
Ag-As-F AgAsF6 AgPF6,cF80,225 Fm-3m 0.77548,0.77548,0.77548,90,90,90 - colorless 4.23 X 38072
Ag-As-F AgAsF7 AgAsF7,oP36,62 Pnma 0.7575,0.697,0.9792,90,90,90 - blue 4.06 X 26380
Ag-As-F Ag1.5 As0.5 F6 Ag(Ag0.5 As0.5 )F6,mP18,13 P12/c1 0.56045,0.52567,0.78061,90,96.594,90 - black 4.55 X 35764
Ag-As-Gd AgGdAs2 orth1 *,oP8,59 Pmmn 0.397,0.39886,1.042,90,90,90 - - - N 38770
Ag-As-Gd AgGdAs2 orth2 SrZnSb2,oP16,62 Pnma 2.0842,0.3973,0.3976,90,90,90 - black 8.37 X 55021
Ag-As-K K2AgAs K2AgAs,oS16,20 C222 1 0.792,1.002,0.602,90,90,90 - red dark 3.63 X 11119
Ag-As-K K3Ag3 As2 K3Cu3P2,hR24,166 R-3m 0.599,0.599,2.135,90,90,120 - - 4.44 X 12851
Ag-As-La AgLaAs2 orth AgCeAs2,oP32,57 Pbcm 0.5814,2.1219,0.5801,90,90,90 - black 7.36 X 55021
Ag-As-La AgLaAs2 tet1 AgLaAs2,tI28,139 I4/mmm 0.4134,0.4134,2.1131,90,90,90 - - 7.30 X 40013
Ag-As-La AgLaAs2 tet2 CuHfSi2,tP8,129 P4/nmm 0.41089,0.41089,1.0614,90,90,90 - gray 7.35 A 38770
Ag-As-Mg MgAgAs MgAgAs,cF12,216 F-43m 0.621,0.621,0.621,90,90,90 - - 5.74 X 1276
Ag-As-Na Na2AgAs K2AgAs,oS16,20 C222 1 0.736,0.879,0.559,90,90,90 - gray silver 4.20 X 12030
Ag-As-Nd AgNdAs2 orth1 CuGd(As0.58 P0.42 )2,oP8,59 Pmmn 0.40516,0.40121,1.05012,90,90,90 - - 7.82 X 38770
Ag-As-Nd AgNdAs2 orth2 SrZnSb2,oP16,62 Pnma 2.0977,0.4032,0.4032,90,90,90 - black 7.83 X 55021
Ag-As-O AgAsO3 AgAsO3,oP120,29 Pca21 1.9488,0.66,1.2661,90,90,90 - - 5.65 X 44009
Ag-As-O Ag3[AsO4] Ag3[PO4],cP22,218 P-43n 0.61391,0.61391,0.61391,90,90,90 - brown 6.64 X 42493
Ag-As-Pd Ag0.5 Pd3As0.5 Cu3Au,cP4,221 Pm-3m 0.3975,0.3975,0.3975,90,90,90 close-packed structure - 10.86 X 5603
Ag-As-Pr AgPrAs2 orth1 *,oP8,59 Pmmn 0.40268,0.4072,1.05364,90,90,90 - - - N 38770
Ag-As-Pr AgPrAs2 orth2 SrZnSb2,oP16,62 Pnma 2.1027,0.4017,0.4062,90,90,90 - black 7.72 X 55021
Ag-As-S AgAsS CuAsS,oP12,62 Pnma 1.22,0.377,0.547,90,90,90 - - 5.67 A 5952
Ag-As-S AgAsS2 ht AgAsS2,mS96,15 C12/c1 1.519,0.778,1.723,90,101.2,90 smithite - 4.93 X 2321
Ag-As-S AgAsS2 rt AgAsS2,hR72,148 R-3 1.398,1.398,0.912,90,90,120 trechmannite - 4.78 X 4934
Ag-As-S Ag3 AsS3 pro lt Ag3 AsS3,mS28,9 C1c1 0.8388,1.0705,0.69908,90,111.976,90 - - 5.64 X 18392
Ag-As-S Ag3 AsS3 pro Ag3 AsS3,hR42,161 R3c 1.0814,1.0814,0.8692,90,90,120 proustite red 5.60 X 52964
Ag-As-S Ag3 AsS3 xan Ag3 AsS3,mS56,15 C12/c1 1.2,0.626,1.708,90,110.,90 xanthoconite - 5.45 X 3853
Ag-As-S Ag3 AsS4 Cu3AsS4,oP16,31 Pmn21 0.7801,0.6973,0.6567,90,90,90 adamantane structure red dark 4.90 X 27897
Ag-As-S Ag7 AsS6 ht *,cF*,216 F-43m 1.055,1.055,1.055,90,90,90 - - - N 13865
Ag-As-S Ag7 AsS6 rt Ag7 AsS6,cP56,198 P213 1.0475,1.0475,1.0475,90,90,90 billingsleyite white silver5.91 X 29133
Ag-As-Se AgAsSe CuAsS,oP12,62 Pnma 1.184,0.346,0.556,90,90,90 - - 7.63 A 3502
Ag-As-Se AgAsSe 2 m NaFeO2,hR12,166 R-3m 0.391,0.391,2.037,90,90,120 rocksalt family - 6.29 X 17994
Ag-As-Se AgAsSe 2 *,tP72,* - 1.2548,1.2548,1.114,90,90,90 - - - N 10176
Ag-As-Se AgAs3Se5 (Ag0.5 As0.5 )2As2Se5,hR27,166 R-3m 0.38195,0.38195,5.0082,90,90,120 - - 5.73 X 50104
Ag-As-Se Ag3 AsSe3 orth Ag3 AsSe 3,oP84,62 Pnma 0.8111,1.1344,2.0728,90,90,90 - black 6.64 X 32130
Ag-As-Se Ag3 AsSe3 rhom Ag3 AsS3,hR42,161 R3c 1.1299,1.1299,0.8759,90,90,120 - - 6.54 X 19761
Ag-As-Se Ag7 AsSe6 ht Ag8GeTe 6,cF220,216 F-43m 1.092,1.092,1.092,90,90,90 - - 6.65 A 12598
Ag-As-Se Ag7 AsSe6 rt Ag7 AsS6,cP56,198 P213 1.0876,1.0876,1.0876,90,90,90 - - 6.73 A 12598
Ag-As-Sm AgSmAs2 orth1 *,oP8,59 Pmmn 0.39854,0.40185,1.0448,90,90,90 - - - N 38770
Ag-As-Sm AgSmAs2 orth2 SrZnSb2,oP16,62 Pnma 2.0782,0.3995,0.4013,90,90,90 - black 8.14 X 55021
Ag-As-Sr SrAgAs BeZrSi,hP6,194 P63/mmc 0.4529,0.4529,0.8291,90,90,120 AlB2 family red ruby 6.10 X 12038
Ag-As-Sr SrAg4 As2 SrAg4 As2,hR48,166 R-3m 0.45555,0.45555,2.4041,90,90,120 - - 7.71 X 58944
Ag-As-Tb AgTbAs2 orth1 *,oP8,59 Pmmn 0.39621,0.39745,1.0432,90,90,90 - - - N 38770
Ag-As-Tb AgTbAs2 orth2 SrZnSb2,oP16,62 Pnma 2.0841,0.3956,0.3955,90,90,90 - black 8.49 X 55021
Ag-As-Zn AgZnAs MgAgAs,cF12,216 F-43m 0.5912,0.5912,0.5912,90,90,90 - blue gray 7.98 X 394
Ag-Au-Cd AgAuCd2 Cu2MnAl,cF16,225 Fm-3m 0.66462,0.66462,0.66462,90,90,90 b.c.c. family - 11.98 X 2906
Ag-Au-Cl AgAuCl4 AgAuCl4,mS24,15 C12/c1 1.2612,0.4101,1.3089,90,118.106,90 - - 4.97 X 11118
Ag-Au-Cu Ag0.04 CuAu0.96 orth rt CuAu,oI40,74 Imma 0.36775,0.39551,3.965,90,90,90 close-packed structure - 14.80 A 171
Ag-Au-Cu Ag0.04 CuAu0.96 tet rt CuAu,tP2,123 P4/mmm 0.27966,0.27966,0.3685,90,90,90 close-packed structure - 14.81 X 16399
Ag-Au-Cu Ag0.06 Cu2.94 Au rt Cu3Au,cP4,221 Pm-3m 0.375,0.375,0.375,90,90,90 close-packed structure - 12.29 X 18017
Ag-Au-Cu Ag0.25 Cu0.25 Au0.5 ht Cu,cF4,225 Fm-3m 0.3983,0.3983,0.3983,90,90,90 close-packed structure - 14.86 X 18017
Ag-Au-F AgAuF4 KBrF4-b,tI24,140 I4/mcm 0.57911,0.57911,1.08168,90,90,90 - yellow 6.97 X 37175
Ag-Au-F AgAuF5 *,aP7,2 P-1 0.3933,0.4769,0.5906,90.75,99.46,107.01 - - - N 26380
Ag-Au-F AgAuF7 AgAsF7,oP36,62 Pnma 0.76167,0.71706,1.01361,90,90,90 - green 5.25 X 56672
Ag-Au-F AgAu2F8 Au2PdF8,mP22,14 P121/c1 0.5223,1.1013,0.72521,90,130.867,90 - green 6.88 X 33777
Ag-Au-F Ag1.5 Au0.5 F6 Ag(Ag0.5 As0.5 )F6,mP18,13 P12/c1 0.566,0.524,0.779,90,97.5,90 - - 5.43 A 35764
Ag-Au-Gd Ag0.5 Au0.5 Gd CsCl,cP2,221 Pm-3m 0.3622,0.3622,0.3622,90,90,90 b.c.c. family - 10.82 X 3185
Ag-Au-Pd Ag0.125 Au0.125Pd0.75 Cu,cF4,225 Fm-3m 0.39331,0.39331,0.39331,90,90,90 close-packed structure - 12.87 X 19080
Ag-Au-S AgAuS rt *,mS48,* - 0.838,1.342,0.909,90,111.4,90 - - 9.40 N 5433
Ag-Au-S Ag1.5 Au0.5 S ht Ag1.4 Au0.6 S,cP42,224 Pn-3m 0.495,0.495,0.495,90,90,90 - - 8.01 X 9918
Ag-Au-S Ag1.8 Au0.2 S ht1 Ag1.8 Au0.2 S,cI52,229 Im-3m 0.4905,0.4905,0.4905,90,90,90 - - 7.48 X 9918
Ag-Au-S Ag3 AuS2 rt Ag3 AuS2,cP48,213 P4132 0.972,0.972,0.972,90,90,90 uytenbogaardtite - 8.46 X 3009
180 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Au-S Ag3 AuS2 trig Ag3 AuS2,hR180,167 R-3c 1.37104,1.37104,1.7117,90,90,120 - - 8.36 X 55888
Ag-Au-Sb Ag2.6 Au0.8 Sb0.6 Cu3Ti,oP8,59 Pmmn 0.4811,0.5928,0.5127,90,90,90 close-packed structure - 11.61 A 1166
Ag-Au-Se Ag3 AuSe2 ht Ag3 AuTe2 ,cI48,214 I4132 0.9965,0.9965,0.9965,90,90,90 fischesserite white silver9.11 X 42742
Ag-Au-Sn Ag0.513 Au0.35 Sn0.137 Mg,hP2,194 P63 /mmc 0.29242,0.29242,0.47775,90,90,120 close-packed structure - 13.19 X 5067
Ag-Au-Sn Ag2.6 Au0.4 Sn Cu3Ti,oP8,59 Pmmn 0.4801,0.6042,0.5175,90,90,90 close-packed structure - 10.57 A 1166
Ag-Au-Te AgAuTe2 lt AgAuTe2,mP8,10 P12/m1 0.5124,0.4419,0.7437,90,90.04,90 muthmannite black 11.05 X 42671
Ag-Au-Te AgAuTe4 AgAuTe4,mP12,13 P12/c1 0.88636,0.4478,1.01778,90,124.444,90 sylvanite - 8.13 X 17558
Ag-Au-Te Ag0.05 Au0.95 Te2 (Ag0.05 Au0.95 )Te2,mS10,12 C12/m1 0.72115,0.44123,0.50912,90,90.028,90 calaverite yellow 9.18 X 51841
Ag-Au-Te Ag0.5 Au1.5 Te4 (Ag0.33 Au0.67 )AuTe4,oP24,28 Pma2 1.659,0.8867,0.44886,90,90,90 krennerite - 8.65 X 57800
Ag-Au-Te Ag3 AuTe2 ht2 *,cI*,* - 0.526,0.526,0.526,90,90,90 - - - N 5433
Ag-Au-Te Ag3 AuTe2 rt Ag3 AuTe2 ,cI48,214 I4132 1.0385,1.0385,1.0385,90,90,90 petzite white 9.20 X 11883
Ag-Au-U Ag9 Au42U14 Ag51Gd14,hP68,175 P6/m 1.2668,1.2668,0.9125,90,90,120 - - 16.47 A 21339
Ag-Au-Zn AgAuZn2 rt Cu2MnAl,cF16,225 Fm-3m 0.62956,0.62956,0.62956,90,90,90 b.c.c. family - 11.60 X 3130
Ag-Au-Zn Ag0.5 Au0.5 Zn ht CsCl,cP2,221 Pm-3m 0.3272,0.3272,0.3272,90,90,90 b.c.c. family - 10.32 X 3130
Ag-B-Cl AgB6Cl6 AgB6Cl6,cP104,205 Pa-3 1.23832,1.23832,1.23832,90,90,90 - colorless 2.70 X 42394
Ag-B-F Ag[BF4] Ba[SO4],oP24,62 Pnma 0.8089,0.5312,0.6752,90,90,90 - - 4.46 X 45570
Ag-B-F Ag[BF4]F Ag[BF4]F,tP14,85 P4/n 0.67,0.67,0.40113,90,90,90 - violet 3.94 X 26380
Ag-B-Mg Mg0.99 Ag0.01 B2 AlB2,hP3,191 P6/mmm 0.3085,0.3085,0.3522,90,90,120 AlB2 family - 2.67 X 55306
Ag-B-O AgBO2 AgBO2,oP128,60 Pbcn 0.8441,0.868,1.9741,90,90,90 - yellow 5.54 X 14703
Ag-B-O Ag2B8O13 ht (Na0.4 Ag0.6 )2B8O13,mP92,14 P121/c1 0.655,0.8671,1.7511,90,90.3,90 - - 3.41 A 2464
Ag-B-O Ag2B8O13 rt Na2B8O13,mP100,14 P121/c1 1.1936,0.7801,1.0558,90,99.846,90 - - 3.50 X 42283
Ag-B-O Ag3[BO3] rhom1 Ag3[BO3],hR21,155 R32 0.9873,0.9873,0.3381,90,90,120 - yellow 6.67 X 14702
Ag-B-O Ag3[BO3] rhom2 Ag3[BO3],hR84,167 R-3c 0.9878,0.9878,1.3512,90,90,120 - - 6.67 X 15648
Ag-B-S Ag3B5S9 Ag3B5S9,mS356,15 C12/c1 2.1663,2.1639,1.6572,90,129.4,90 - orange 2.95 X 17630
Ag-B-S Ag5BS4 *,cF60,227 Fd-3m 1.056,1.056,1.056,90,90,90 - - - N 3495
Ag-Ba-Bi BaAgBi BeZrSi,hP6,194 P63 /mmc 0.49423,0.49423,0.91251,90,90,120 AlB2 family gray 7.81 X 39798
Ag-Ba-Bi BaAg1.837 Bi2 UCo1.41 Sn1.85 ,tP12,129 P4/nmm 0.49202,0.49202,1.1628,90,90,90 - gray 8.89 X 48587
Ag-Ba-Ga BaAg0.4 Ga3.6 CeAl2Ga2,tI10,139 I4/mmm 0.4617,0.4617,1.0755,90,90,90 - - 6.25 X 23588
Ag-Ba-Ga BaAg6Ga7 NaZn13,cF112,226 Fm-3c 1.2757,1.2757,1.2757,90,90,90 - - 8.14 A 35768
Ag-Ba-Ge BaAg0.5Ge 1.5 AlB2,hP3,191 P6/mmm 0.4427,0.4427,0.4882,90,90,120 AlB2 family - 6.02 X 55648
Ag-Ba-Ge BaAg1.8 Ge 2.2 CeAl2Ga2,tI10,139 I4/mmm 0.461,0.461,1.0697,90,90,90 - - 7.18 X 55648
Ag-Ba-Ge BaAg4.76 Ge0.24 CaCu5,hP6,191 P6/mmm 0.5819,0.5819,0.4599,90,90,120 - - 8.23 X 55648
Ag-Ba-Ge Ba4Ag3Ge 20 Na4Si23,cP54,223 Pm-3n 1.08472,1.08472,1.08472,90,90,90 clathrate gray 6.05 X 55297
Ag-Ba-Ge Ba6Ag0.47 Ge 24.53 K6Sn25,cP124,213 P4132 1.4561,1.4561,1.4561,90,90,90 clathrate - 5.71 A 55648
Ag-Ba-In BaAg6In7 NaZn13,cF112,226 Fm-3c 1.3442,1.3442,1.3442,90,90,90 - black 8.69 A 35768
Ag-Ba-O BaAg6O4 SrAg6O4,oP44,52 Pnna 0.663,1.27,0.909,90,90,90 - red ruby 7.36 X 7854
Ag-Ba-P BaAgP BeZrSi,hP6,194 P63 /mmc 0.4496,0.4496,0.8828,90,90,120 AlB2 family gray 5.94 X 12867
Ag-Ba-Pb BaAgPb KHg2,oI12,74 Imma 0.5119,0.8223,0.8744,90,90,90 AlB2 family - 8.16 A 31703
Ag-Ba-S BaAg2S2 Ce2SO2,hP5,164 P-3m1 0.4386,0.4386,0.7194,90,90,120 - red dark 5.78 X 33748
Ag-Ba-S BaAg8S5 BaAg8S5,mP56,11 P121/m1 0.7672,1.7666,0.8937,90,107.89,90 - black 6.69 X 36189
Ag-Ba-S Ba2Ag10S7 *,mS38,12 C12/m1 1.446,0.4295,1.3467,90,103.88,90 - black - N 35413
Ag-Ba-S Ba2Ag8S7 Ba2Ag8S7,oP38,59 Pmmn 0.4407,1.5643,1.0869,90,90,90 - orange red 6.04 X 35413
Ag-Ba-Sb BaAgSb BeZrSi,hP6,194 P63 /mmc 0.4837,0.4837,0.9177,90,90,120 AlB2 family - 6.55 X 23592
Ag-Ba-Se Ba2Ag4Se 5 Ba2Ag4Se5 ,mS26,12 C12/m1 1.6189,0.45528,0.925,90,124.572,90 - - 6.51 X 48492
Ag-Ba-Si Ba4Ag1.9 Si21.1 Na4Si23,cP54,223 Pm-3n 1.0478,1.0478,1.0478,90,90,90 clathrate gray 3.89 X 24843
Ag-Ba-Si Ba8Ag5.5 Si7.5 Ba8Ag5.5 Si7.5 ,oS96,21 C222 0.8612,1.4917,1.9633,90,90,90 - - 5.01 X 31703
Ag-Ba-Sn BaAgSn KHg2,oI12,74 Imma 0.5056,0.8067,0.8653,90,90,90 AlB2 family - 6.85 A 31703
Ag-Ba-Sn BaAg2Sn2 CeAl2Ga2,tI10,139 I4/mmm 0.481,0.481,1.135,90,90,90 - - 7.47 X 7079
Ag-Ba-Sr Ba0.77 Sr0.23 Ag FeB-b,oP8,62 Pnma 0.85542,0.49205,0.65794,90,90,90 CrB(TlI)-FeB gray silver 5.61 X 51523
Ag-Ba-Te BaAg2 Te2 BaCu2S2,oP20,62 Pnma 1.08897,0.46084,1.18134,90,90,90 - - 6.82 X 50918
Ag-Bi-Br Ag3Bi14Br21 Ag3Bi14Br21,mP78,11 P121/m1 1.27778,1.46687,1.34262,90,108.47,90 - black 6.86 X 51541
Ag-Bi-Ca CaAgBi LiGaGe,hP6,186 P63 mc 0.48113,0.48113,0.78273,90,90,120 AlB2 family gray 7.55 X 48587
Ag-Bi-Ce AgCeBi2 CuHfSi2,tP8,129 P4/nmm 0.45417,0.45417,1.0542,90,90,90 - - 10.17 A 32343
Ag-Bi-Cu Ag0.75 Cu0.15 Bi0.10 m Cu,cF4,225 Fm-3m 0.4087,0.4087,0.4087,90,90,90 close-packed structure - 10.83 X 9925
Ag-Bi-Eu AgEuBi BeZrSi,hP6,194 P63 /mmc 0.4877,0.4877,0.8139,90,90,120 AlB2 family blue gray 9.29 X 14785
Ag-Bi-F AgBiF6 *,t**,* - 0.5065,0.5065,0.9548,90,90,90 - - - N 30077
Ag-Bi-F AgBi2F12 AgSb2F12,aP15,2 P-1 0.5218,0.5579,0.8934,76.08,88.93,65.08 - - 5.49 X 30077
Ag-Bi-I AgBi0.33 I2 NaFeO2,hR12,166 R-3m 0.43537,0.43537,2.081,90,90,120 rocksalt family black gray 6.28 X 45747
Ag-Bi-I Ag0.5 Bi0.5 I2 Ti2C,cF48,227 Fd-3m 1.2223,1.2223,1.2223,90,90,90 - black gray 6.00 X 45747
Ag-Bi-K K2AgBi K2AgAs,oS16,20 C222 1 0.838,1.056,0.633,90,90,90 - gray silver 4.68 X 11119
Ag-Bi-La AgLaBi2 CuHfSi2,tP8,129 P4/nmm 0.45715,0.45715,1.0621,90,90,90 - - 9.95 A 32343
Ag-Bi-Li Li2AgBi Li2AgSb,cF16,216 F-43m 0.6736,0.6736,0.6736,90,90,90 b.c.c. family gray 7.19 X 4311
Ag-Bi-O AgBiO3 ht AgSbO3,cI80,204 Im-3 0.97852,0.97852,0.97852,90,90,90 - - 7.76 X 42915
Ag-Bi-O AgBiO3 rt TiFeO3,hR30,148 R-3 0.5641,0.5641,1.6118,90,90,120 - black 8.18 X 36499
Ag-Bi-O Ag18Bi4O12 Ag18Bi4O12 ,oS136,63 Cmcm 1.063,1.4229,2.391,90,90,90 - yellow 5.45 X 18916
Ag-Bi-O Ag2BiO3 ht1 Ag2BiO3,oP24,34 Pnn2 0.5983,0.63239,0.95762,90,90,90 - black 8.67 X 47505
Ag-Bi-O Ag2BiO3 lt Ag2BiO3,mP24,7 P1c1 0.59549,0.631,1.10595,90,120.062,90 - black 8.73 X 47505
Ag-Bi-O Ag25Bi3O18 Ag25Bi3O18 ,hP46,147 P-3 1.15887,1.15887,0.62386,90,90,120 - black 8.27 X 26810
Ag-Bi-O Ag3BiO3 Ag3BiO3,tI112,80 I41 1.41924,1.41924,0.87997,90,90,90 - orange red 8.70 X 28135
Ag-Bi-O Ag4Bi2O5 rt Ag4Bi2O5,oP44,52 Pnna 1.4283,0.5692,0.8777,90,90,90 - yellow 8.65 X 32469
Ag-Bi-O Ag5BiO4 Ag5BiO4,mP40,14 P121/c1 0.5855,0.8984,1.36259,90,113.949,90 - red dark 8.24 X 28135
Ag-Bi-S AgBiS2 rt AgBiSe2,hP12,164 P-3m1 0.40662,0.40662,1.8958,90,90,120 matildite - 6.99 A 24476
Ag-Bi-S AgBi3S5 AgBi3S5,mS36,12 C12/m1 1.3305,0.4042,1.6417,90,94.02,90 pavonite black 6.75 X 10547
Ag-Bi-S Ag0.5 Bi0.5 S ht NaCl,cF8,225 Fm-3m 0.5648,0.5648,0.5648,90,90,90 rocksalt family - 7.02 X 4146
Ag-Bi-S Ag2.5 Bi6.5 S11 Ag2.5 Bi6.5 S11,mS52,12 C12/m1 1.338,0.40492,1.869,90,105.494,90 dantopaite white 6.74 X 53897
Ag-Bi-S Ag3Bi7S12 Ag3Bi7S12 ,mS44,12 C12/m1 1.325,0.405,2.025,90,103.14,90 benjaminite - 6.81 X 14509
Ag-Bi-S Ag3.5 Bi7.5 S13 (Ag0.39 Bi0.61)9Bi2S13,mS48,12 C12/m1 1.33237,0.40455,2.1484,90,92.9,90 - black 6.78 X 44201
Ag-Bi-Se AgBiSe2 ht1 NaFeO2,hR12,166 R-3m 0.41833,0.41833,1.97807,90,90,120 rocksalt family - 7.89 X 1052
Handbook of Inorganic Substances – Edition 2015 : Data 181

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Bi-Se AgBiSe 2 rt AgBiSe 2,hP12,164 P-3m1 0.418,0.418,1.967,90,90,120 bohdanowiczite - 7.95 X 1052


Ag-Bi-Se Ag0.5 Bi0.5 Se ht2 NaCl,cF8,225 Fm-3m 0.5822,0.5822,0.5822,90,90,90 rocksalt family - 7.99 X 54412
Ag-Bi-Sr SrAgBi BeZrSi,hP6,194 P63/mmc 0.4876,0.4876,0.848,90,90,120 AlB2 family - 7.69 X 23592
Ag-Bi-Te AgBiTe 2 vol AgBiSe 2,hP12,164 P-3m1 0.4468,0.4468,2.075,90,90,120 volynskite - 7.94 X 24476
Ag-Bi-Te AgBi0.85 Te2 rhom NaFeO2,hR12,166 R-3m 0.424,0.424,2.067,90,90,120 rocksalt family - 8.37 X 2371
Ag-Bi-Te Ag0.5 Bi0.5 Te ht NaCl,cF8,225 Fm-3m 0.6154,0.6154,0.6154,90,90,90 rocksalt family - 8.15 X 57265
Ag-Bi-Tl Ag0.75 Tl0.15 Bi0.10 m Cu,cF4,225 Fm-3m 0.414,0.414,0.414,90,90,90 close-packed structure - 12.40 X 16186
Ag-Bi-Yb AgYbBi NdPtSb,hP6,186 P63mc 0.48118,0.48118,0.7777,90,90,120 AlB2 family - 10.43 A 36472
Ag-Br-Cl AgBr0.73 Cl0.27 NaCl,cF8,225 Fm-3m 0.5686,0.5686,0.5686,90,90,90 rocksalt family - 6.35 X 44766
Ag-Br-Cs CsAgBr2 ht BaNiS2,tP8,129 P4/nmm 0.53237,0.53237,1.02118,90,90,90 - - 4.60 X 43452
Ag-Br-Cs CsAgBr2 rt CeNiSi2,oS16,63 Cmcm 0.45743,1.98944,0.59471,90,90,90 - colorless 4.92 X 43452
Ag-Br-Cs Cs2AgBr3 K2CuCl3,oP24,62 Pnma 1.37549,0.47192,1.43623,90,90,90 - - 4.37 X 43452
Ag-Br-Cu Ag0.5 Cu0.5 Br NaCl,cF8,225 Fm-3m 0.5874,0.5874,0.5874,90,90,90 rocksalt family - 5.43 X 25155
Ag-Br-Cu Ag0.8 Cu0.2 Br Cu2MnAl,cF16,225 Fm-3m 0.5869,0.5869,0.5869,90,90,90 b.c.c. family - 5.88 X 27619
Ag-Br-Fe AgFeBr4 rt LiAlCl4,mP24,14 P121/c1 0.7538,0.6869,1.3852,90,92.73,90 - red dark 4.48 A 26841
Ag-Br-I AgI0.3 Br0.7 NaCl,cF8,225 Fm-3m 0.5887,0.5887,0.5887,90,90,90 rocksalt family yellow 6.57 X 21880
Ag-Br-I AgI0.706 Br0.294 ZnS,cF8,216 F-43m 0.6433,0.6433,0.6433,90,90,90 adamantane structure - 5.51 X 9
Ag-Br-I AgI0.8 Br0.2 ht AgI,cI38,229 Im-3m 0.5002,0.5002,0.5002,90,90,90 - - 5.98 A 21881
Ag-Br-I AgI0.96 Br0.04 ZnO,hP4,186 P63mc 0.45839,0.45839,0.74942,90,90,120 adamantane structure - 5.67 A 3477
Ag-Br-Li Li0.5 Ag0.5 Br NaCl,cF8,225 Fm-3m 0.5776,0.5776,0.5776,90,90,90 rocksalt family - 4.73 X 5086
Ag-Br-Mo AgMo 6Br13 rt NaMo 6Cl13,aP40,2 P-1 0.9183,0.9392,1.4328,95.85,102.04,114.298 - orange 5.31 X 42285
Ag-Br-O Ag[BrO3] *,tI16,139 I4/mmm 0.859,0.859,0.808,90,90,90 - - 5.25 P 17
Ag-Br-Pb AgPb2Br5 U2FeS5,mS32,15 C12/c1 1.66967,0.70528,0.7981,90,95.95,90 - - 6.55 X 24252
Ag-Br-Rb Rb2AgBr3 K2AgI3,oP24,62 Pnma 0.95772,0.46458,1.86629,90,90,90 - - 4.15 X 43452
Ag-Br-S Ag3SBr lt NaNbO3,oS40,63 Cmcm 0.9423,0.9423,0.9711,90,90,90 - - 6.71 X 13527
Ag-Br-S Ag3SBr rt Ag3SI,cP14,221 Pm-3m 0.4806,0.4806,0.4806,90,90,90 - black 6.52 X 13527
Ag-Br-Te Ag10 Te4Br3 ht1 Ag10 Te4Br3,hP216,194 P63/mmc 1.3748,1.3748,1.5383,90,90,120 - - 7.24 X 48177
Ag-Br-Te Ag10 Te4Br3 ht2 Ag10 Te4Br3,hP61,191 P6/mmm 0.7984,0.7984,0.7688,90,90,120 - - 7.16 X 48177
Ag-Br-Te Ag10 Te4Br3 lt Ag10 Te4Br3,oS136,36 Cmc21 1.54,1.5654,1.3699,90,90,90 - - 7.36 X 48177
Ag-Br-Te Ag10 Te4Br3 rt Ag10 Te4Br3,oS136,63 Cmcm 1.5374,1.5772,1.3715,90,90,90 - gray 7.31 X 48177
Ag-Br-Te Ag19 Te6Br7 mon Ag19 Te6Br7,mS138,12 C12/m1 1.3604,0.7857,1.5395,90,107.13,90 - - 7.13 X 50157
Ag-Br-Te Ag19 Te6Br7 rhom Ag19 Te6Br7,hR195,166 R-3m 0.7855,0.7855,4.4184,90,90,120 - - 7.12 X 50157
Ag-Br-Te Ag23 Te12Br rt Ag23 Te12Br,oP276,58 Pnnm 2.1074,2.1074,0.77319,90,90,90 - black 7.92 X 50413
Ag-Br-Te Ag5 Te2Br Ag5 Te2Cl,mP64,14 P121/c1 1.3856,0.7702,1.95923,90,134.396,90 - - 7.78 A 51628
Ag-Br-Tl AgTl2Br3 AgTl2I3,hR54,148 R-3 0.98929,0.98929,1.91273,90,90,120 - - 6.97 A 4507
Ag-Br-W AgW3Br7 AgW3Br7,mP44,14 P121/c1 0.9384,1.5383,0.9522,90,117.34,90 Chevrel phase green 6.63 X 36617
Ag-Br-W AgW6Br14 HgMo 6Cl14,cP84,201 Pn-3 1.3355,1.3355,1.3355,90,90,90 Chevrel phase black 6.50 X 36617
Ag-C-Cs CsAgC2 tet1 CsAgC2,tP8,131 P42/mmc 0.52467,0.52467,0.8528,90,90,90 - colorless 3.75 X 35416
Ag-C-Cs CsAgC2 tet2 KAgC2,tP4,123 P4/mmm 0.47149,0.47149,0.5259,90,90,90 - colorless 3.76 A 35416
Ag-C-F Ag5CF4 Ag5CF4,tP40,81 P-4 0.7464,0.7464,1.0337,90,90,90 - colorless 7.24 X 34024
Ag-C-K KAgC2 KAgC2,tP4,123 P4/mmm 0.42267,0.42267,0.5287,90,90,90 - colorless 3.01 X 35416
Ag-C-Li LiAgC2 LiAgC2,hP4,187 P-6m2 0.37882,0.37882,0.5328,90,90,120 - colorless 3.48 X 35416
Ag-C-N Ag[CC3N3] AgC[CN]3,oI32,46 Ima2 0.798,1.019,0.621,90,90,90 - - 2.60 X 3057
Ag-C-N Ag[CN] Ag[CN],hR9,166 R-3m 0.60058,0.60058,0.52628,90,90,120 - white 4.06 X 41104
Ag-C-N Ag[C2N5] Ag[C2N5],mP32,14 P121/c1 0.68789,0.76299,0.97934,90,126.461,90 - colorless 3.24 X 57904
Ag-C-N Ag[NC2N2] orth Ag[NC2N2],oP24,62 Pnma 1.6133,0.3612,0.5983,90,90,90 - - 3.31 X 23184
Ag-C-N Ag[NC2N2] trig Ag[NC2N2],hP18,152 P3121 0.3601,0.3601,2.2868,90,90,120 - - 3.37 X 10493
Ag-C-N Ag2[NCN] Ag2[NCN],mP20,14 P121/c1 0.7315,0.601,0.6684,90,102.29,90 - yellow 5.92 X 38340
Ag-C-Na NaAgC2 KAgC2,tP4,123 P4/mmm 0.3747,0.3747,0.532,90,90,90 - colorless 3.44 A 35416
Ag-C-O Ag2[CO3] ht1 Ag2[CO3],hP36,159 P31c 0.91716,0.91716,0.65176,90,90,120 - - 5.79 X 40047
Ag-C-O Ag2[CO3] ht2 Ag2[CO3],hP21,189 P-62m 0.90924,0.90924,0.33249,90,90,120 - - 5.77 X 40047
Ag-C-O Ag2[CO3] rt Ag2[CO3],mP12,11 P121/m1 0.32536,0.95489,0.48521,90,91.971,90 - - 6.08 X 40047
Ag-C-O Ag2[C4O4] mon1 Ag2[C4O4],mS80,15 C12/c1 1.9824,0.70417,0.7511,90,102.116,90 - yellow 4.25 X 20791
Ag-C-O Ag2[C4O4] mon2 Ag2[C4O4],mP20,14 P121/c1 0.3399,0.65186,1.1159,90,99.619,90 - yellow 4.47 X 55395
Ag-C-Rb RbAgC2 KAgC2,tP4,123 P4/mmm 0.4475,0.4475,0.531,90,90,90 - colorless 3.39 A 35416
Ag-Ca-Cd Ca5Ag2Cd Mo5 SiB2,tI32,140 I4/mcm 0.8148,0.8148,1.494,90,90,90 - - 3.54 A 57498
Ag-Ca-Cu CaAg0.05 Cu0.95 CaCu,mP20,11 P121/m1 0.5888,0.4287,1.946,90,94.31,90 CrB(TlI)-FeB - 3.59 A 18083
Ag-Ca-Cu CaAg0.20 Cu0.80 Ca(Ag0.20 Cu0.80),oP40,62 Pnma 3.8754,0.4344,0.5926,90,90,90 CrB(TlI)-FeB - 3.74 X 18083
Ag-Ca-Cu CaAg0.4 Cu0.6 TlI,oS8,63 Cmcm 0.4113,1.1235,0.4428,90,90,90 CrB(TlI)-FeB - 3.94 A 18083
Ag-Ca-Ga CaAg0.5 Ga3.5 CeAl2Ga2,tI10,139 I4/mmm 0.4278,0.4278,1.1025,90,90,90 - - 5.56 X 23588
Ag-Ca-Ge CaAgGe orth1 KHg2,oI12,74 Imma 0.4563,0.718,0.7866,90,90,90 AlB2 family - 5.68 X 31703
Ag-Ca-Ge CaAg0.6 Ge1.4 AlB2 ,hP3,191 P6/mmm 0.435,0.435,0.4141,90,90,120 AlB2 family - 5.05 X 31703
Ag-Ca-Ge CaAg0.98 Ge1.02 orth2 AuYbGe,oP36,62 Pnma 2.15602,0.45625,0.78713,90,90,90 - gray silver 5.66 X 51616
Ag-Ca-Ge CaAg2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.433,0.433,1.093,90,90,90 - - 6.50 X 5607
Ag-Ca-Ge Ca3Ag1.32 Ge2.68 Sc3NiSi3,mS28,12 C12/m1 1.083,0.45399,1.43611,90,110.08,90 - - 4.58 X 59735
Ag-Ca-Hg Ca4Ag4.5 Hg4.5 Au6(Au0.5 In0.5 )6In,cP76,215 P-43m 1.114,1.114,1.114,90,90,90 γ-brass - 7.44 A 13877
Ag-Ca-In CaAg2In4 Ag2 YbIn4,cI248,204 Im-3 1.5454,1.5454,1.5454,90,90,90 - - 7.72 X 34440
Ag-Ca-In Ca26 Ag92In49 Ca26 (Ag0.65 In0.35 )141,hP169,191 P6/mmm 2.066,2.066,0.941,90,90,120 - gray silver 7.92 X 56273
Ag-Ca-Mg CaMgAg orth TiNiSi,oP12,62 Pnma 0.7582,0.4456,0.8932,90,90,90 AlB2 family - 3.79 X 40421
Ag-Ca-Mg Ca0.94 Mg0.46 Ag1.60 hex MgZn2,hP12,194 P63/mmc 0.5755,0.5755,0.9479,90,90,120 Friauf-Laves phase - 5.41 X 40421
Ag-Ca-Mg Ca4MgAg0.948 Gd4RhIn,cF96,216 F-43m 1.48578,1.48578,1.48578,90,90,90 - - 2.32 X 59572
Ag-Ca-N Ca19 Ag8N7 K19Pb8O4[OH]3,cF136,225 Fm-3m 1.47443,1.47443,1.47443,90,90,90 - black 3.57 X 38236
Ag-Ca-N Ca6Ag16N Dy6Fe16O,cI46,229 Im-3m 0.97845,0.97845,0.97845,90,90,90 - golden 7.02 X 28500
Ag-Ca-N Ca7Ag1.36 N4 Ca7Ag1.36 N4,oP34,55 Pbam 1.1448,1.2029,0.3652,90,90,90 - - 3.19 X 45902
Ag-Ca-P CaAgP ZrNiAl,hP9,189 P-62m 0.7045,0.7045,0.4174,90,90,120 Fe2P family gray 4.97 X 12868
Ag-Ca-Pb CaAgPb LiCaSn,hP9,156 P3m1 0.4879,0.4879,1.1121,90,90,120 AlB2 family - 7.72 X 31703
Ag-Ca-Pb Ca5AgPb3 *,hP18,165 P-3c1 0.94317,0.94317,0.7055,90,90,120 - - - N 41564
Ag-Ca-Sb CaAgSb TiNiSi,oP12,62 Pnma 0.7708,0.459,0.8393,90,90,90 AlB2 family - 6.03 X 23592
182 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Ca-Si Ca2AgSi3 Ca2AgSi3,oF48,69 Fmmm 0.8315,0.8646,1.4391,90,90,90 - - 3.50 X 36628


Ag-Ca-Si Ca4Ag1.6Si5.6 Ca4Ag(Ag0.2 Si0.8 )3Si3.2,hP24,187 P-6m2 0.8304,0.8304,0.8643,90,90,120 - - 3.15 X 31703
Ag-Ca-Sn CaAgSn LiCaSn,hP9,156 P3m1 0.48,0.48,1.1039,90,90,120 AlB2 family - 6.03 A 31703
Ag-Ca-Sr Sr0.25 Ca0.75 Ag TlI,oS8,63 Cmcm 0.4134,1.1578,0.4674,90,90,90 CrB(TlI)-FeB gray silver 4.75 X 51523
Ag-Ca-Sr Sr0.52 Ca0.48 Ag (Sr0.52 Ca0.48)Ag,oP48,62 Pnma 4.80005,0.4718,0.62411,90,90,90 - gray silver 4.87 X 51523
Ag-Ca-Sr Sr0.61 Ca0.39 Ag TbNi,oP24,62 Pnma 2.4122,0.47275,0.62617,90,90,90 CrB(TlI)-FeB gray silver 4.94 X 51523
Ag-Ca-Sr Sr0.95 Ca0.05 Ag SrAg,oP16,62 Pnma 1.6431,0.47679,0.63627,90,90,90 CrB(TlI)-FeB gray silver 5.15 X 51523
Ag-Ca-Zn CaAgZn KHg2,oI12,74 Imma 0.4628,0.7397,0.7862,90,90,90 AlB2 family - 5.26 X 49663
Ag-Ca-Zn CaAg0.136 Zn0.864 FeB-b,oP8,62 Pnma 0.80457,0.44305,0.61135,90,90,90 CrB(TlI)-FeB gray silver 3.39 X 53580
Ag-Ca-Zn CaAg0.33 Zn0.67 (Y0.3 Gd0.7)Ni,mP12,11 P121/m1 0.61039,0.44853,1.1957,90,96.829,90 CrB(TlI)-FeB gray silver 3.66 X 53580
Ag-Ca-Zn CaAg0.48 Zn0.52 SrAg,oP16,62 Pnma 1.571,0.4515,0.6094,90,90,90 CrB(TlI)-FeB gray silver 3.87 X 53580
Ag-Ca-Zn CaAg0.52 Zn0.48 TbNi,oP24,62 Pnma 2.34547,0.45437,0.60995,90,90,90 CrB(TlI)-FeB gray silver 3.91 X 53580
Ag-Ca-Zn CaAg0.76 Zn0.24 TlI,oS8,63 Cmcm 0.4086,1.1443,0.4607,90,90,90 CrB(TlI)-FeB gray silver 4.25 X 53580
Ag-Cd-Ce AgCd2Ce Cu2MnAl,cF16,225 Fm-3m 0.6651,0.6651,0.6651,90,90,90 b.c.c. family - 10.67 X 21342
Ag-Cd-Eu AgCdEu KHg2,oI12,74 Imma 0.49041,0.771,0.8344,90,90,90 AlB2 family gray light 7.84 X 39677
Ag-Cd-Eu Ag2CdEu5 Mo5SiB2,tI32,140 I4/mcm 0.8424,0.8424,1.5416,90,90,90 - - 6.61 A 57498
Ag-Cd-I AgCd0.5 I2 m *,h**,* - 0.4483,0.4483,0.7351,90,90,120 - - 5.42 N 40298
Ag-Cd-I Ag2CdI4 ht *,hP*,* - 0.896,0.896,1.462,90,90,120 - - - N 17174
Ag-Cd-I Ag2CdI4 ht3 Cu2HgI4,tI14,121 I-42m 0.63338,0.63338,1.26807,90,90,90 - - 5.46 X 40298
Ag-Cd-In Ag0.70 Cd0.25 In0.05 Cu,cF4,225 Fm-3m 0.41594,0.41594,0.41594,90,90,90 close-packed structure - 10.09 X 16113
Ag-Cd-Mg MgAg2Cd cub1 Cu2MnAl,cF16,225 Fm-3m 0.6639,0.6639,0.6639,90,90,90 b.c.c. family - 8.00 X 11862
Ag-Cd-Mg Mg0.3 AgCd0.7 cub2 CsCl,cP2,221 Pm-3m 0.33248,0.33248,0.33248,90,90,90 b.c.c. family - 8.76 X 11862
Ag-Cd-O Ag0.02 Cd0.98 O NaCl,cF8,225 Fm-3m 0.46939,0.46939,0.46939,90,90,90 rocksalt family - 8.24 X 1293
Ag-Cd-Sb AgCdSb MgAgAs,cF12,216 F-43m 0.631,0.631,0.631,90,90,90 - - 9.04 X 5262
Ag-Cd-Yb AgCdYb MgZn2,hP12,194 P63 /mmc 0.58466,0.58466,0.94683,90,90,120 Friauf-Laves phase gray light 9.32 X 39677
Ag-Cd-Yb Ag2CdYb5 Mo5SiB2,tI32,140 I4/mcm 0.8109,0.8109,1.48,90,90,90 - - 8.15 A 57498
Ag-Cd-Zn AgZn0.4 Cd0.6 CsCl,cP2,221 Pm-3m 0.3267,0.3267,0.3267,90,90,90 b.c.c. family - 9.59 X 11862
Ag-Cd-Zn Ag0.5 Zn0.25 Cd0.25 W,cI2,229 Im-3m 0.321,0.321,0.321,90,90,90 b.c.c. family - 9.88 X 1561
Ag-Cd-Zn Ag0.9 Zn0.08 Cd0.02 Cu,cF4,225 Fm-3m 0.40829,0.40829,0.40829,90,90,90 close-packed structure - 10.20 X 20205
Ag-Ce-Cu Ag0.9 Cu5.1 Ce Cu6Ce,oP28,62 Pnma 0.825,0.508,1.035,90,90,90 - - 8.60 A 26246
Ag-Ce-F Ag7Ce6F31 Na7Zr6F31 ,hR132,148 R-3 1.4698,1.4698,0.9985,90,90,120 - colorless 5.83 A 38141
Ag-Ce-Ga AgCeGa KHg2,oI12,74 Imma 0.46766,0.74136,0.79436,90,90,90 AlB2 family - 7.66 X 56169
Ag-Ce-Ga Ag0.68 CeGa3.32 CeAl2Ga2,tI10,139 I4/mmm 0.4308,0.4308,1.0784,90,90,90 - - 7.38 X 44822
Ag-Ce-Ga Ag0.7 Ce2Ga9.1 (Ag0.35 Ga0.65 )2La2Ga8.1 ,tI42,139 I4/mmm 0.42928,0.42928,2.6124,90,90,90 - - 6.83 X 54940
Ag-Ce-Ga Ag1.25 CeGa4.25 (Ag0.36 Ga0.64 )3.5 CeGa2,tP30,124 P4/mcc 0.42723,0.42723,1.53468,90,90,90 - - 6.77 X 44822
Ag-Ce-Ga Ag12.36 Ce3 Ga20.64 Ca3Ag(Ag0.35 Al0.65)32,cP36,221 Pm-3m 0.87159,0.87159,0.87159,90,90,90 - - 8.01 X 44822
Ag-Ce-Ge AgCeGe CaIn2,hP6,194 P63 /mmc 0.45356,0.45356,0.77464,90,90,120 AlB2 family - 7.71 X 36100
Ag-Ce-Ge AgCe2Ge6 rt CuCe2Ge6 ,oS18,38 Amm2 0.43089,0.4144,2.1674,90,90,90 - - 7.07 A 30286
Ag-Ce-Ge Ag0.12 CeGe1.75 ht GdSi1.4 ,oI12,74 Imma 0.4042,0.42485,1.428,90,90,90 - - 7.59 A 36100
Ag-Ce-Ge Ag0.22 CeGe1.48 ht ThSi2,tI12,141 I41/amd 0.4251,0.4251,1.4715,90,90,90 - - 6.78 A 36100
Ag-Ce-Ge Ag0.67 CeGe1.33 AlB2,hP3,191 P6/mmm 0.43553,0.43553,0.41723,90,90,120 AlB2 family - 7.48 X 36100
Ag-Ce-Ge Ag1.08 Ce5 Ge2.92 Sm5Ge4,oP36,62 Pnma 0.7107,1.528,0.7953,90,90,90 - - 7.91 X 30055
Ag-Ce-Ge Ag2CeGe2 CeAl2Ga2,tI10,139 I4/mmm 0.4279,0.4279,1.0929,90,90,90 - - 8.32 X 26618
Ag-Ce-Ge Ag4Ce3Ge 4 Cu4Gd3Ge4,oI22,71 Immm 0.4445,0.7113,1.4763,90,90,90 - - 8.13 X 46386
Ag-Ce-In Ag2CeIn Cu2MnAl,cF16,225 Fm-3m 0.7108,0.7108,0.7108,90,90,90 b.c.c. family - 8.71 X 17125
Ag-Ce-In Ag6.4 CeIn5.6 ThMn12,tI26,139 I4/mmm 0.9711,0.9711,0.5693,90,90,90 CaCu5-Zr4Al3 - 9.12 A 36205
Ag-Ce-Mg MgAgCe ZrNiAl,hP9,189 P-62m 0.7825,0.7825,0.4328,90,90,120 Fe2P family - 5.91 X 39201
Ag-Ce-Mg MgAg2Ce rt Cu2MnAl,cF16,225 Fm-3m 0.7164,0.7164,0.7164,90,90,90 b.c.c. family - 6.87 X 21342
Ag-Ce-Mg Mg2AgCe rt Cu2MnAl,cF16,225 Fm-3m 0.7294,0.7294,0.7294,90,90,90 b.c.c. family - 5.08 X 21342
Ag-Ce-Nd AgCe0.5 Nd0.5 CsCl,cP2,221 Pm-3m 0.375,0.375,0.375,90,90,90 b.c.c. family - 7.87 X 17286
Ag-Ce-P Ag1.08 CeP1.90 ht Ag1.08 CeP1.90 ,tI52,139 I4/mmm 0.40037,0.40037,2.0435,90,90,90 - - 6.40 X 41015
Ag-Ce-Pb AgCePb CaIn2,hP6,194 P63 /mmc 0.4836,0.4836,0.767,90,90,120 AlB2 family - 9.73 X 16177
Ag-Ce-Pb AgCe5Pb3 Ti5Ga4,hP18,193 P63 /mcm 0.9643,0.9643,0.677,90,90,120 AlB2 family - 8.71 X 4182
Ag-Ce-Pd Ag0.6 CePd2.4 Cu3Au,cP4,221 Pm-3m 0.4167,0.4167,0.4167,90,90,90 close-packed structure - 10.56 X 17533
Ag-Ce-S Ag0.5 Ce2.5 S4 Th3P 4,cI28,220 I-43d 0.8623,0.8623,0.8623,90,90,90 - - 5.52 A 3019
Ag-Ce-Sb AgCeSb2 CuHfSi2,tP8,129 P4/nmm 0.4363,0.4363,1.0699,90,90,90 - - 8.01 X 30559
Ag-Ce-Sb Ag2CeSb2 CaBe2Ge2 ,tP10,129 P4/nmm 0.436,0.436,1.07,90,90,90 - - 9.79 X 40256
Ag-Ce-Se Ag0.131 Ce2.623 Se4 Th3P 4,cI28,220 I-43d 0.8962,0.8962,0.8962,90,90,90 - - 6.44 A 7249
Ag-Ce-Si AgCeSi2 LaMnSi2,oS16,63 Cmcm 0.42531,1.7551,0.42331,90,90,90 - - 6.39 X 54905
Ag-Ce-Si Ag0.58 CeSi1.36 ThSi2,tI12,141 I41/amd 0.42291,0.42291,1.46374,90,90,90 - - 6.11 X 38851
Ag-Ce-Si Ag0.66 CeSi1.34 AlB2,hP3,191 P6/mmm 0.42394,0.42394,0.42348,90,90,120 AlB2 family - 6.27 X 38851
Ag-Ce-Si Ag1.12 CeSi0.88 LaPtSi,tI12,109 I41md 0.42346,0.42346,1.4712,90,90,90 - - 7.19 X 32370
Ag-Ce-Si Ag2CeSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4233,0.4233,1.06342,90,90,90 - - 7.18 X 17385
Ag-Ce-Sn AgCeSn LiGaGe,hP6,186 P63 mc 0.4781,0.4781,0.77327,90,90,120 AlB2 family - 7.96 X 38843
Ag-Ce-Sn AgCe5Sn3 CuHf5Sn3,hP18,193 P63 /mcm 0.96,0.96,0.673,90,90,120 AlB2 family - 7.20 X 4182
Ag-Ce-Sn Ag0.84 CeSn0.16 ht CsCl,cP2,221 Pm-3m 0.376,0.376,0.376,90,90,90 b.c.c. family - 7.80 X 35717
Ag-Ce-Sn Ag4Ce3Sn4 Cu4Gd3Ge4,oI22,71 Immm 0.4677,0.7352,1.5512,90,90,90 - - 8.26 X 46386
Ag-Ce-Zn AgZnCe KHg2,oI12,74 Imma 0.4722,0.7191,0.8034,90,90,90 AlB2 family - 7.63 A 37142
Ag-Ce-Zn Ag2.03 Zn8.97 Ce BaCd11,tI48,141 I41/amd 1.0795,1.0795,0.6945,90,90,90 - - 7.76 X 59536
Ag-Cl-Cs CsAgCl2 ht BaNiS2,tP8,129 P4/nmm 0.51094,0.51094,0.98596,90,90,90 - - 4.02 X 43452
Ag-Cl-Cs CsAgCl2 rt CeNiSi2,oS16,63 Cmcm 0.43764,1.91863,0.56852,90,90,90 - colorless 4.34 X 43452
Ag-Cl-Cs CsAgCl2.11 ht *,o**,* - 0.4376,0.5687,1.9216,90,90,90 - black - N 16643
Ag-Cl-Cs CsAgCl3 m CsAuCl3,tI20,139 I4/mmm 0.72223,0.72223,1.0824,90,90,90 - black 4.08 X 24212
Ag-Cl-Cs Cs2AgCl3 K2CuCl3,oP24,62 Pnma 1.32098,0.45514,1.3758,90,90,90 - colorless 3.85 X 43452
Ag-Cl-Dy Ag3DyCl6 Na3GdCl6 ,hR36,148 R-3 0.6869,0.6869,1.8375,90,90,120 - - 4.64 A 21918
Ag-Cl-Er Ag3ErCl6 Na3GdCl6 ,hR36,148 R-3 0.6863,0.6863,1.8297,90,90,120 - - 4.70 A 21918
Ag-Cl-Ho Ag3HoCl6 Na3GdCl6 ,hR36,148 R-3 0.6864,0.6864,1.8342,90,90,120 - - 4.67 A 21918
Ag-Cl-I AgI0.1 Cl0.9 NaCl,cF8,225 Fm-3m 0.5609,0.5609,0.5609,90,90,90 rocksalt family - 5.74 X 1653
Handbook of Inorganic Substances – Edition 2015 : Data 183

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Cl-In Ag3InCl6 rt *,o**,* - 0.6805,1.1827,1.2006,90,90,90 - - 4.48 N 26818


Ag-Cl-Lu Ag3LuCl6 Na3GdCl6,hR36,148 R-3 0.6848,0.6848,1.8147,90,90,120 - - 4.81 A 21918
Ag-Cl-Mo AgMo 6Cl13 NaMo 6Cl13,aP40,2 P-1 0.883,0.908,1.39,95.75,102.21,114.56 - - 3.93 A 19381
Ag-Cl-Na Na0.7 Ag0.3 Cl NaCl,cF8,225 Fm-3m 0.5626,0.5626,0.5626,90,90,90 rocksalt family - 3.13 X 5084
Ag-Cl-O Ag[ClO2] Ag[ClO2],oP16,54 Pcca 0.60754,0.66796,0.61226,90,90,90 - yellow 4.69 X 23151
Ag-Cl-O Ag[ClO3] ht Na[ClO3]-b,cP20,198 P213 0.68,0.68,0.68,90,90,90 - - 4.04 A 13913
Ag-Cl-O Ag[ClO3] rt Ag[ClO3],tI40,87 I4/m 0.8486,0.8486,0.7894,90,90,90 - - 4.47 X 230
Ag-Cl-O Ag[ClO4] hp Ba[SO4],oP24,62 Pnma 0.8214,0.516,0.6651,90,90,90 - - 4.89 X 57181
Ag-Cl-O Ag[ClO4] ht cub1 K[ClO4],cF24,216 F-43m 0.692,0.692,0.692,90,90,90 - - 4.16 X 33
Ag-Cl-O Ag[ClO4] ht cub2 Na[ClO4],cF104,225 Fm-3m 0.703,0.703,0.703,90,90,90 - - 3.96 X 19743
Ag-Cl-O Ag[ClO4] ht cub3 Na[ClO4],cF264,225 Fm-3m 0.7,0.7,0.7,90,90,90 - - 4.01 X 7881
Ag-Cl-O Ag[ClO4] rt Ag[ClO4],tI12,121 I-42m 0.4976,0.4976,0.6746,90,90,90 - colorless 4.12 X 12838
Ag-Cl-Pd Ag2PdCl4 Ag2PdCl4,oS28,64 Cmce 1.0088,0.8051,0.8078,90,90,90 - brown red 4.70 X 21945
Ag-Cl-Rb Rb2AgCl3 K2AgI3,oP24,62 Pnma 0.9205,0.44822,1.78738,90,90,90 - colorless 3.47 X 35429
Ag-Cl-Re Ag2ReCl6 K2Sn[NH2]6,hR27,148 R-3 0.65733,0.65733,1.6731,90,90,120 - black 4.89 X 46175
Ag-Cl-Sc Ag3ScCl6 Na3GdCl6,hR36,148 R-3 0.6794,0.6794,1.779,90,90,120 - - 4.07 A 21918
Ag-Cl-Te Ag23 Te12Cl rt Ag23 Te12Cl,oP280,58 Pnnm 2.1214,2.1218,0.77086,90,90,90 - black 7.75 X 50413
Ag-Cl-Te Ag5 Te2Cl mon1 Ag5 Te2Cl,mP64,14 P121/c1 1.37641,0.76718,1.94943,90,134.911,90 - black 7.56 X 53980
Ag-Cl-Te Ag5 Te2Cl mon2 Ag5 Te2Cl,mP128,14 P121/c1 1.9359,0.7713,1.9533,90,90.6,90 - gray silver 7.56 X 38253
Ag-Cl-Te Ag5 Te2Cl tet Ag5 Te2Cl,tI92,140 I4/mcm 0.97616,0.97616,0.78341,90,90,90 - black 7.39 X 53980
Ag-Cl-Tl AgTl2Cl3 AgTl2I3,hR54,148 R-3 0.95462,0.95462,1.84569,90,90,120 - colorless 6.39 A 4507
Ag-Cl-Tm Ag3 TmCl6 Na3GdCl6,hR36,148 R-3 0.6855,0.6855,1.8202,90,90,120 - - 4.74 A 21918
Ag-Cl-W AgW3Cl9 *,hP*,* - 0.9104,0.9104,0.8414,90,90,120 - black - N 52278
Ag-Cl-Y Ag3 YCl6 rt Na3GdCl6,hR36,148 R-3 0.68669,0.68669,1.8305,90,90,120 - - 4.17 X 24153
Ag-Cl-Yb Ag3 YbCl6 Na3GdCl6,hR36,148 R-3 0.6852,0.6852,1.8169,90,90,120 - - 4.78 A 21918
Ag-Co-F AgCoF3 CaTiO3,cP5,221 Pm-3m 0.3983,0.3983,0.3983,90,90,90 perovskite family rose 5.88 X 5135
Ag-Co-F Ag1.5 Co0.5 F3 rt CsAuCl3,tI20,139 I4/mmm 0.5797,0.5797,0.8128,90,90,90 - yellow 6.04 A 21878
Ag-Co-O AgCoO2 ht AgFeO2,hP8,194 P63/mmc 0.28709,0.28709,1.22216,90,90,120 - - 7.57 X 50975
Ag-Co-O AgCoO2 rt hex AgCoO2,hP16,194 P63/mmc 0.2871,0.2871,2.4448,90,90,120 - - 7.57 X 56339
Ag-Co-O AgCoO2 rt rhom CuFeO2,hR12,166 R-3m 0.2872,0.2872,1.8337,90,90,120 - black 7.56 A 56339
Ag-Cr-F Ag1.5 Cr0.5 F3 rt CsAuCl3,tI20,139 I4/mmm 0.5804,0.5804,0.8156,90,90,90 - green 5.92 A 21878
Ag-Cr-F Ag3CrF6 ht [NH4]3FeF6,cF40,225 Fm-3m 0.8204,0.8204,0.8204,90,90,90 perovskite family - 5.89 A 21878
Ag-Cr-O AgCrO2 CuFeO2,hR12,166 R-3m 0.2985,0.2985,1.851,90,90,120 - black 6.69 X 9485
Ag-Cr-O Ag2CrO2 lt Ag2CrO2,mS10,12 C12/m1 0.50798,0.2917,0.86616,90,90.072,90 - - 7.76 X 59231
Ag-Cr-O Ag2CrO2 rt Ag2CrO2,hP5,164 P-3m1 0.29246,0.29246,0.8661,90,90,120 - - 7.76 X 59231
Ag-Cr-O Ag2[CrO4] Ag2[MnO4],oP28,62 Pnma 1.0063,0.7029,0.554,90,90,90 - - 5.62 X 6111
Ag-Cr-O Ag2[Cr2O7] Ag2[Cr2O7],aP22,2 P-1 0.6544,0.6968,0.7148,91.05,110.82,96.11 - red 4.74 X 11284
Ag-Cr-S AgCrS2 ht CuCrS2-b,hR12,160 R3m 0.34979,0.34979,2.05369,90,90,120 - - 5.13 X 57163
Ag-Cr-S AgCrS2 lt AgCrS2,mS8,8 C1m1 0.60125,0.35042,0.71132,90,106.464,90 - - 5.18 X 57163
Ag-Cr-S Ag0.37 Cr1.21 S2 Ag0.37 Cr1.21 S2,hR45,166 R-3m 0.34325,0.34325,3.719,90,90,120 - - 4.38 X 14911
Ag-Cr-Se AgCrSe 2 ht AgCrSe 2,hR15,166 R-3m 0.36821,0.36821,2.1231,90,90,120 - - 6.35 X 7573
Ag-Cr-Se AgCrSe 2 rt CuCrSe 2,hR12,160 R3m 0.3691,0.3691,2.122,90,90,120 - - 6.32 X 916
Ag-Cr-Te AgCrTe 2 CuCrS2-b,hR12,160 R3m 0.394,0.394,2.465,90,90,120 - - 6.24 A 14134
Ag-Cr-Te AgCr2 Te4 MgAl2O4,cF56,227 Fd-3m 1.1371,1.1371,1.1371,90,90,90 spinel family - 6.53 X 26134
Ag-Cs-F CsAgF3 KCuF3,tI20,140 I4/mcm 0.6489,0.6489,0.852,90,90,90 - brown 5.51 X 6162
Ag-Cs-F Cs2AgF4 orth [NH4]2CuCl4,oS28,64 Cmce 1.4187,0.64764,0.64807,90,90,90 - lilac 5.02 X 47230
Ag-Cs-F Cs2AgF4 tet K2NiF4,tI14,139 I4/mmm 0.4581,0.4581,1.4192,90,90,90 high-Tc family blue 5.01 X 8621
Ag-Cs-F Cs2AgF6 K2PtCl6,cF36,225 Fm-3m 0.8961,0.8961,0.8961,90,90,90 fluorite family - 4.50 A 21766
Ag-Cs-I CsAg2I3 CsAg2I3,oP24,62 Pnma 1.37432,0.62306,1.10763,90,90,90 - colorless 5.11 X 43452
Ag-Cs-I Cs2AgI3 K2CuCl3,oP24,62 Pnma 1.45875,0.4951,1.52983,90,90,90 - colorless 4.54 X 43452
Ag-Cs-O CsAgO tet1 KAgO,tI24,139 I4/mmm 1.0243,1.0243,0.6168,90,90,90 - yellow 5.27 X 24178
Ag-Cs-O CsAgO tet2 KAgO,tI24,82 I-4 1.02,1.02,0.617,90,90,90 - yellow 5.31 X 4293
Ag-Cs-O CsAgO tet3 LiCuO,tI24,119 I-4m2 1.0243,1.0243,0.6168,90,90,90 - colorless 5.27 X 18617
Ag-Cs-S CsAg3S2 CsAg3S2,mS24,12 C12/m1 1.6175,0.4325,0.898,90,113.,90 - - 5.98 X 11038
Ag-Cs-S CsAg7S4 CsAg7S4,tP48,85 P4/n 1.1093,1.1093,0.8538,90,90,90 - black red 6.42 X 28661
Ag-Cs-Se CsAgSe 4 [NH4]CuS4,oP24,19 P212121 0.5855,0.909,1.3885,90,90,90 - red 5.00 X 34637
Ag-Cs-Se CsAg3Se2 CsAg3S2,mS24,12 C12/m1 1.6742,0.4441,0.9097,90,112.61,90 - black 6.54 X 11629
Ag-Cs-Se CsAg5Se3 Cu5TlSe 3,tP36,136 P42/mnm 1.4083,1.4083,0.441,90,90,90 - black 6.90 X 37441
Ag-Cs-Te CsAg3 Te2 CsAg3S2,mS24,12 C12/m1 1.7662,0.4646,0.9391,90,111.96,90 - - 6.61 A 30165
Ag-Cs-Te CsAg5 Te3 Cu5TlSe 3,tP36,136 P42/mnm 1.4672,1.4672,0.4601,90,90,90 - black 7.08 X 30165
Ag-Cu-Dy AgCu4Dy MgCu4Sn,cF24,216 F-43m 0.7112,0.7112,0.7112,90,90,90 Friauf-Laves phase - 9.69 A 11684
Ag-Cu-Er AgCu4Er MgCu4Sn,cF24,216 F-43m 0.7098,0.7098,0.7098,90,90,90 Friauf-Laves phase - 9.83 A 23934
Ag-Cu-F AgCuF3 mon *,mP5,* - 0.406,0.383,0.406,90,91.2,90 - - - N 5135
Ag-Cu-F AgCuF3 tricl NaCuF3,aP20,2 P-1 0.55802,0.55787,0.81018,89.623,89.072,86.504 perovskite family yellow pale 6.03 X 55387
Ag-Cu-Ga Ag2.6 Cu6.1 Ga4.3 Cu9Al4,cP52,215 P-43m 0.8775,0.8775,0.8775,90,90,90 γ-brass - 9.51 A 22849
Ag-Cu-Gd AgCu4Gd MgCu4Sn,cF24,216 F-43m 0.7163,0.7163,0.7163,90,90,90 Friauf-Laves phase - 9.39 A 11684
Ag-Cu-Ho AgCu4Ho MgCu4Sn,cF24,216 F-43m 0.7101,0.7101,0.7101,90,90,90 Friauf-Laves phase - 9.78 A 11684
Ag-Cu-I Ag0.5 Cu0.5 I ht ZnS,cF8,216 F-43m 0.6275,0.6275,0.6275,90,90,90 miersite - 5.72 X 10930
Ag-Cu-I Ag0.824 Cu0.176 I rt ZnO,hP4,186 P63mc 0.455,0.455,0.741,90,90,120 adamantane structure - 5.67 A 10930
Ag-Cu-In Ag0.005 Cu0.99 In0.005 Cu,cF4,225 Fm-3m 0.3626,0.3626,0.3626,90,90,90 close-packed structure - 8.92 X 52485
Ag-Cu-In Ag0.866 Cu0.033 In0.101 Cu,cF4,225 Fm-3m 0.411,0.411,0.411,90,90,90 close-packed structure - 10.25 X 52485
Ag-Cu-Nd AgCu4Nd MgCu4Sn,cF24,216 F-43m 0.7234,0.7234,0.7234,90,90,90 Friauf-Laves phase - 8.88 A 11684
Ag-Cu-O AgCuO2 NaCuO2,mS8,12 C12/m1 0.60757,0.28088,0.58728,90,107.987,90 - - 7.09 X 40197
Ag-Cu-O Ag2Cu2O3 lt Ag2Cu2O3,mS28,15 C12/c1 0.83065,1.07005,0.58868,90,134.871,90 - - 7.00 X 47157
Ag-Cu-O Ag2Cu2O3 rt Ag2Cu2O3,tI28,141 I41/amd 0.58978,0.58978,1.0714,90,90,90 - green dark 6.97 X 39134
Ag-Cu-Pr AgCu4Pr lt MgCu4Sn,cF24,216 F-43m 0.7226,0.7226,0.7226,90,90,90 Friauf-Laves phase - 8.85 A 55073
Ag-Cu-Pr Ag0.5 Cu0.5 Pr rt CsCl,cP2,221 Pm-3m 0.366,0.366,0.366,90,90,90 b.c.c. family - 7.68 X 16215
Ag-Cu-S AgCuS ht1 Cu2S,hP16,194 P63/mmc 0.41434,0.41434,0.70813,90,90,120 - - 6.42 X 48745
184 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Cu-S AgCuS lt AgCuS,oP12,26 Pmc21 0.4047,0.6592,0.793,90,90,90 - - 6.39 X 24531


Ag-Cu-S AgCuS rt AgCuS,oS12,63 Cmcm 0.406,0.666,0.799,90,90,90 stromeyerite - 6.26 X 724
Ag-Cu-S Ag1.5 Cu0.5 S ht2 Cu2Se,cF44,225 Fm-3m 0.61403,0.61403,0.61403,90,90,90 fluorite family - 6.47 X 50749
Ag-Cu-S Ag1.55 Cu0.45 S Ag2S,cI20,229 Im-3m 0.483,0.483,0.483,90,90,90 - - 6.72 X 3055
Ag-Cu-S Ag3CuS2 rt Ag3CuS2,tI48,141 I41/amd 0.86476,0.86476,1.17883,90,90,90 jalpaite - 6.80 X 50749
Ag-Cu-S Ag5Cu3S4 lt Ag5Cu3S4,oP96,62 Pnma 1.4047,0.7805,1.5691,90,90,90 mckinstryite black 6.63 X 55119
Ag-Cu-Se AgCuSe ht Cu2Se,cF44,225 Fm-3m 0.61002,0.61002,0.61002,90,90,90 fluorite family - 7.33 X 46350
Ag-Cu-Se AgCuSe rt *,oP120,59 Pmmn 0.412,4.07,1.242,90,90,90 eucairite - 7.99 N 46350
Ag-Cu-Se Ag1.6 Cu0.4 Se ht Ag2S,cI20,229 Im-3m 0.494,0.494,0.494,90,90,90 - - 7.63 A 21212
Ag-Cu-Sm AgCu4Sm MgCu4Sn,cF24,216 F-43m 0.7186,0.7186,0.7186,90,90,90 Friauf-Laves phase - 9.17 A 11684
Ag-Cu-Sm Ag0.36 Cu1.64 Sm KHg2,oI12,74 Imma 0.4525,0.7113,0.7681,90,90,90 AlB2 family - 7.88 A 28764
Ag-Cu-Sm Ag2.2 Cu2.8 Sm CaCu5,hP6,191 P6/mmm 0.52,0.52,0.4249,90,90,120 - - 9.44 X 28764
Ag-Cu-Tb AgCu4 Tb MgCu4Sn,cF24,216 F-43m 0.7161,0.7161,0.7161,90,90,90 Friauf-Laves phase - 9.42 A 16206
Ag-Cu-Tb Ag0.5 Cu0.5 Tb CsCl,cP2,221 Pm-3m 0.3533,0.3533,0.3533,90,90,90 b.c.c. family - 9.21 X 11011
Ag-Cu-Te AgCuTe ht CaF2,cF12,225 Fm-3m 0.629,0.629,0.629,90,90,90 fluorite family - 7.98 X 16095
Ag-Cu-Te AgCuTe2 tf AgCuTe2,oP4,25 Pmm2 0.312,0.405,0.6875,90,90,90 - - 8.15 X 6995
Ag-Cu-Te Ag1.2 Cu0.8 Te ht1 Ag2 Te,cF84,225 Fm-3m 0.642,0.642,0.642,90,90,90 - - 7.73 A 23977
Ag-Cu-Te Ag23Cu19.2 Te24 tf Ag23.1 Cu19.3 Te24,hP73,156 P3m1 0.854,0.854,2.17,90,90,120 - - 8.19 X 10181
Ag-Cu-Tm AgCu4 Tm MgCu4Sn,cF24,216 F-43m 0.7083,0.7083,0.7083,90,90,90 Friauf-Laves phase - 9.93 A 11684
Ag-Cu-Y Ag0.1 Cu0.9 Y ht CsCl,cP2,221 Pm-3m 0.351,0.351,0.351,90,90,90 b.c.c. family - 6.02 X 21340
Ag-Cu-Y Ag0.15 Cu0.60 Y0.25 Mn,cP20,213 P4132 0.7127,0.7127,0.7127,90,90,90 - - 7.02 X 27011
Ag-Cu-Yb AgCu4Yb rt MgCu4Sn,cF24,216 F-43m 0.7054,0.7054,0.7054,90,90,90 Friauf-Laves phase - 10.13 A 20325
Ag-Cu-Zn Ag0.1 Cu0.1 Zn0.8 Mg,hP2,194 P63 /mmc 0.2777,0.2777,0.4345,90,90,120 close-packed structure - 7.95 X 240
Ag-Cu-Zr AgCu4Zr *,tI*,* - 0.4921,0.4921,0.6917,90,90,90 - - - N 21324
Ag-Dy-Ga AgDyGa KHg2,oI12,74 Imma 0.4566,0.7061,0.7825,90,90,90 AlB2 family - 8.95 X 31925
Ag-Dy-Ga Ag0.5 DyGa1.5 CaIn2,hP6,194 P63 /mmc 0.4462,0.4462,0.716,90,90,120 AlB2 family - 8.64 A 34623
Ag-Dy-Ga Ag1.08 DyGa1.92 ScRhSi2,oP16,62 Pnma 0.69444,0.43259,1.01864,90,90,90 - - 8.96 A 52436
Ag-Dy-Ga Ag2.8 Dy3Ga8.2 La3Al11,oI28,71 Immm 0.42654,0.9469,1.2805,90,90,90 - - 8.74 A 25426
Ag-Dy-Ge AgDyGe ZrNiAl,hP9,189 P-62m 0.71056,0.71056,0.4196,90,90,120 Fe2P family gray light 9.31 X 31761
Ag-Dy-In Ag0.2 DyIn2.8 Cu3Au,cP4,221 Pm-3m 0.453,0.453,0.453,90,90,90 close-packed structure gray 9.03 X 58948
Ag-Dy-In Ag0.4 DyIn0.6 CsCl,cP2,221 Pm-3m 0.3687,0.3687,0.3687,90,90,90 b.c.c. family - 9.10 X 58948
Ag-Dy-In Ag0.83 DyIn1.17 CaIn2,hP6,194 P63 /mmc 0.47987,0.47987,0.70378,90,90,120 AlB2 family - 9.14 X 58948
Ag-Dy-In Ag2DyIn Cu2MnAl,cF16,225 Fm-3m 0.687,0.687,0.687,90,90,90 b.c.c. family - 10.10 X 26278
Ag-Dy-In Ag3DyIn3 Ag3 TbIn3,cI248,204 Im-3 1.5127,1.5127,1.5127,90,90,90 - - 9.56 A 58948
Ag-Dy-Mg MgAgDy ZrNiAl,hP9,189 P-62m 0.7645,0.7645,0.413,90,90,120 Fe2P family - 7.02 A 28736
Ag-Dy-Pb AgDyPb LiGaGe,hP6,186 P63 mc 0.47422,0.47422,0.74101,90,90,120 AlB2 family - 10.99 X 38785
Ag-Dy-Pb Ag0.9 DyPb2.1 Cu3Au,cP4,221 Pm-3m 0.46514,0.46514,0.46514,90,90,90 close-packed structure - 11.46 X 38837
Ag-Dy-S AgDyS2 rt AgGdS2,mP32,4 P1211 0.7692,0.7667,1.2059,90,90.3,90 - - 6.25 A 26039
Ag-Dy-S Ag0.5 Dy0.5 S ht *,cP*,* - 0.663,0.663,0.663,90,90,90 - - - N 22809
Ag-Dy-S Ag0.5 Dy2.5 S4 Th3P 4,cI28,220 I-43d 0.8315,0.8315,0.8315,90,90,90 - - 6.80 A 3019
Ag-Dy-Sb AgDySb2 CuHfSi2,tP8,129 P4/nmm 0.42656,0.42656,1.04545,90,90,90 - - 8.97 X 40226
Ag-Dy-Sb Ag2.5 Dy3.5 Sb0.5 Cu2.5 Ho2(Ho 0.75 Sb0.25)2,tP14,125 P4/nbm 0.62201,0.62201,0.88134,90,90,90 - - 8.76 X 44845
Ag-Dy-Se AgDySe2 ht1 AgYbS2,tI16,109 I41md 0.56356,0.56356,1.228,90,90,90 - - 7.29 A 7249
Ag-Dy-Se AgDySe2 rt AgErSe2,oP16,19 P212121 0.4204,0.6826,1.3766,90,90,90 - - 7.20 A 53123
Ag-Dy-Se Ag0.5 Dy0.5 Se ht2 NaCl,cF8,225 Fm-3m 0.57737,0.57737,0.57737,90,90,90 rocksalt family - 7.39 X 53123
Ag-Dy-Si AgDySi ZrNiAl,hP9,189 P-62m 0.702,0.702,0.4168,90,90,120 Fe2P family - 8.36 A 18134
Ag-Dy-Si Ag0.67 DySi1.33 AlB2,hP3,191 P6/mmm 0.4133,0.4133,0.4036,90,90,120 AlB2 family - 7.57 X 7618
Ag-Dy-Si Ag2DySi2 CeAl2Ga2,tI10,139 I4/mmm 0.412,0.412,1.0747,90,90,90 - - 7.91 A 31895
Ag-Dy-Sn AgDySn NdPtSb,hP6,186 P63 mc 0.4683,0.4683,0.7344,90,90,120 AlB2 family - 9.26 X 51636
Ag-Dy-Sn AgDySn2 Cu3Au,cP4,221 Pm-3m 0.4531,0.4531,0.4531,90,90,90 close-packed structure - 9.06 X 48634
Ag-Dy-Sn Ag0.97 DySn0.03 CsCl,cP2,221 Pm-3m 0.3608,0.3608,0.3608,90,90,90 b.c.c. family - 9.57 X 48634
Ag-Dy-Sn Ag4Dy3Sn4 Cu4Gd3Ge4,oI22,71 Immm 0.45316,0.72887,1.51225,90,90,90 - - 9.27 X 48686
Ag-Dy-Te AgDyTe2 ht CuScS2,hP4,156 P3m1 0.4319,0.4319,0.701,90,90,120 - - 7.71 A 7304
Ag-Dy-Te AgDyTe2 rt AgErTe2,tP8,113 P-42 1m 0.7126,0.7126,0.45875,90,90,90 - - 7.49 X 50601
Ag-Er-Ga Ag0.5 ErGa1.5 CaIn2,hP6,194 P63 /mmc 0.4438,0.4438,0.707,90,90,120 AlB2 family - 8.97 A 34623
Ag-Er-Ga Ag1.1 ErGa1.9 ScRhSi2,oP16,62 Pnma 0.69145,0.4301,1.01548,90,90,90 - - 9.20 X 52436
Ag-Er-Ga Ag2.8 Er3Ga8.2 La3Al11,oI28,71 Immm 0.4285,0.9506,1.2707,90,90,90 - - 8.83 A 25426
Ag-Er-Ge AgErGe ZrNiAl,hP9,189 P-62m 0.70649,0.70649,0.41665,90,90,120 Fe2P family gray light 9.62 X 31761
Ag-Er-In Ag0.5 ErIn0.5 cub2 CsCl,cP2,221 Pm-3m 0.3651,0.3651,0.3651,90,90,90 b.c.c. family - 9.51 X 14327
Ag-Er-In Ag2ErIn cub1 Cu2MnAl,cF16,225 Fm-3m 0.6882,0.6882,0.6882,90,90,90 b.c.c. family - 10.14 X 17125
Ag-Er-Mg MgAgEr ZrNiAl,hP9,189 P-62m 0.7626,0.7626,0.4074,90,90,120 Fe2P family - 7.27 A 28736
Ag-Er-Pb AgErPb ZrNiAl,hP9,189 P-62m 0.74062,0.74062,0.44596,90,90,120 Fe2P family - 11.34 X 38763
Ag-Er-Pb Ag0.70 ErPb1.30 CaIn2,hP6,194 P63 /mmc 0.4717,0.4717,0.73711,90,90,120 AlB2 family - 11.98 X 38885
Ag-Er-Pb Ag0.72 ErPb2.28 Cu3Au,cP4,221 Pm-3m 0.46244,0.46244,0.46244,90,90,90 close-packed structure - 12.05 X 38837
Ag-Er-S AgErS2 rt AgGdS2,mP32,4 P1211 0.7625,0.7637,1.1913,90,90.16,90 - - 6.50 A 26039
Ag-Er-S Ag0.5 Er0.5 S ht NaCl,cF8,225 Fm-3m 0.5512,0.5512,0.5512,90,90,90 rocksalt family - 6.73 X 3020
Ag-Er-Sb AgErSb2 CuHfSi2,tP8,129 P4/nmm 0.42528,0.42528,1.04288,90,90,90 - - 9.13 A 40226
Ag-Er-Se AgErSe2 rt AgErSe2,oP16,19 P212121 0.418,0.688,1.379,90,90,90 - red brick 7.25 X 10371
Ag-Er-Se Ag0.5 Er0.5 Se ht NaCl,cF8,225 Fm-3m 0.5744,0.5744,0.5744,90,90,90 rocksalt family - 7.59 X 4576
Ag-Er-Si AgErSi ZrNiAl,hP9,189 P-62m 0.6977,0.6977,0.4141,90,90,120 Fe2P family - 8.65 A 18134
Ag-Er-Si Ag0.67 ErSi1.33 AlB2,hP3,191 P6/mmm 0.4196,0.4196,0.4095,90,90,120 AlB2 family - 7.36 X 7618
Ag-Er-Sn AgErSn hp ZrNiAl,hP9,189 P-62m 0.7287,0.7287,0.4456,90,90,120 Fe2P family - 9.57 X 49578
Ag-Er-Sn AgErSn rt LiGaGe,hP6,186 P63 mc 0.4663,0.4663,0.729,90,90,120 AlB2 family - 9.53 X 49578
Ag-Er-Sn AgErSn2 Cu3Au,cP4,221 Pm-3m 0.45344,0.45344,0.45344,90,90,90 close-packed structure - 9.13 X 50613
Ag-Er-Sn Ag48Er14Sn3 Ag51Gd14,hP68,175 P6/m 1.25906,1.25906,0.92222,90,90,120 - - 10.33 A 54573
Ag-Er-Te AgErTe2 ht CuScS2,hP4,156 P3m1 0.4299,0.4299,0.7,90,90,120 - - 7.86 A 7304
Ag-Er-Te AgErTe2 rt AgErTe2,tP8,113 P-42 1m 0.7091,0.7091,0.4565,90,90,90 - - 7.67 X 46690
Ag-Er-Te Ag2Er7Te2 Er7Ni2Te2 ,oI22,44 Imm2 0.3949,1.5676,0.9409,90,90,90 - - 9.36 A 53504
Handbook of Inorganic Substances – Edition 2015 : Data 185

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Er-Zn AgZnEr KHg2,oI12,74 Imma 0.4536,0.6956,0.7713,90,90,90 AlB2 family - 9.29 A 37142


Ag-Eu-Ga AgEuGa KHg2,oI12,74 Imma 0.4702,0.7578,0.7945,90,90,90 AlB2 family - 7.73 A 20153
Ag-Eu-Ge AgEuGe hex AlB2 ,hP3,191 P6/mmm 0.4364,0.4364,0.4373,90,90,120 AlB2 family - 7.65 X 36535
Ag-Eu-Ge AgEuGe orth KHg2,oI12,74 Imma 0.467,0.74,0.7981,90,90,90 AlB2 family gray light 8.01 X 31218
Ag-Eu-Ge Ag1.55 EuGe0.45 KHg2,oI12,74 Imma 0.476,0.747,0.815,90,90,90 AlB2 family - 8.06 A 36535
Ag-Eu-Ge Ag2EuGe2 CeAl2Ga2,tI10,139 I4/mmm 0.4304,0.4304,1.0787,90,90,90 - - 8.52 A 36535
Ag-Eu-In Ag0.5 EuIn0.5 CsCl,cP2,221 Pm-3m 0.3904,0.3904,0.3904,90,90,90 b.c.c. family - 7.35 X 29481
Ag-Eu-In Ag3.1 EuIn3.1 (Ag0.5 In0.5 )6.2Eu,cI232,204 Im-3 1.56222,1.56222,1.56222,90,90,90 - - 8.80 X 52808
Ag-Eu-In Ag39.5 Eu13In39.5 (Ag0.5 In0.5 )79Eu13,cP736,205 Pa-3 2.52823,2.52823,2.52823,90,90,90 - - 8.85 X 52808
Ag-Eu-In Ag4EuIn8 Ag4EuIn8,hP39,191 P6/mmm 0.9925,0.9925,0.9727,90,90,120 CaCu5-Zr4Al3 - 9.02 X 28598
Ag-Eu-Mg MgAgEu TiNiSi,oP12,62 Pnma 0.7774,0.463,0.8988,90,90,90 AlB2 family - 5.83 X 39201
Ag-Eu-P AgEuP BeZrSi,hP6,194 P63/mmc 0.4395,0.4395,0.8057,90,90,120 AlB2 family blue gray 7.17 X 14785
Ag-Eu-Pb AgEuPb KHg2,oI12,74 Imma 0.4951,0.7668,0.8556,90,90,90 AlB2 family - 9.55 A 31703
Ag-Eu-Sb AgEuSb BeZrSi,hP6,194 P63/mmc 0.4749,0.4749,0.8294,90,90,120 AlB2 family gray 7.82 X 57459
Ag-Eu-Sb Ag4EuSb2 CaCu4P 2,hR21,166 R-3m 0.47239,0.47239,2.4689,90,90,120 - - 8.63 X 58944
Ag-Eu-Si AgEu2Si3 orth LiSr2Si3,oF96,70 Fddd 0.842,1.4585,1.7864,90,90,90 - - 6.01 X 36628
Ag-Eu-Si Ag0.5 EuSi1.5 hex AlB2 ,hP3,191 P6/mmm 0.415,0.415,0.4477,90,90,120 AlB2 family - 6.17 X 44879
Ag-Eu-Si Ag1.55 EuSi0.45 KHg2,oI12,74 Imma 0.4706,0.7536,0.8167,90,90,90 AlB2 family - 7.61 A 44879
Ag-Eu-Si Ag2EuSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4315,0.4315,1.0463,90,90,90 - - 7.23 A 44879
Ag-Eu-Sn AgEuSn KHg2,oI12,74 Imma 0.4878,0.763,0.8396,90,90,90 AlB2 family - 8.05 A 30459
Ag-F-Fe Ag3FeF6 ht [NH4]3FeF6,cF40,225 Fm-3m 0.8225,0.8225,0.8225,90,90,90 perovskite family - 5.89 A 21878
Ag-F-Fe Ag3FeF6 rt Rb3TlF6,tI20,139 I4/mmm 0.5841,0.5841,0.8305,90,90,90 - - 5.78 A 5365
Ag-F-Ga Ag3GaF6 ht [NH4]3FeF6,cF40,225 Fm-3m 0.8194,0.8194,0.8194,90,90,90 perovskite family - 6.13 A 21878
Ag-F-Hf Ag3Hf2F14 Ag3Hf2F14,mS38,12 C12/m1 0.9249,0.6686,0.9073,90,90.3,90 - blue violet 5.60 X 20840
Ag-F-Hf Ag7Hf6F31 Na7Zr6F31,hR132,148 R-3 1.3938,1.3938,0.9787,90,90,120 - colorless 7.31 A 38141
Ag-F-I Ag2IF *,mP*,* - 0.472,0.766,0.636,90,93.5,90 - colorless - N 1329
Ag-F-In AgInF4 KTlF4,hP36,144 P31 0.7733,0.7733,0.9616,90,90,120 - - 5.98 A 7712
Ag-F-In Ag3InF6 ht [NH4]3FeF6,cF40,225 Fm-3m 0.8482,0.8482,0.8482,90,90,90 perovskite family - 6.01 A 21878
Ag-F-In Ag3InF6 rt Na3AlF6,mP20,14 P121/c1 0.5934,0.6094,1.02411,90,123.795,90 - - 5.96 A 21878
Ag-F-Ir AgIrF7 AgAsF7,oP36,62 Pnma 0.7628,0.7067,1.0253,90,90,90 - black 5.20 X 30077
Ag-F-K KAgF3 GdFeO3,oP20,62 Pnma 0.62689,0.83015,0.61844,90,90,90 perovskite family brown 4.21 X 52044
Ag-F-K KAgF4 KBrF4-b,tI24,140 I4/mcm 0.5847,0.5847,1.1553,90,90,90 - yellow 3.75 X 24598
Ag-F-K K2AgF4 ht Na2CuF4,mP14,14 P121/c1 0.37174,1.02736,0.63856,90,91.744,90 - - 3.57 X 54142
Ag-F-K K2AgF4 rt CuLa2O4,oS28,64 Cmce 0.6182,1.2632,0.6436,90,90,90 high-Tc family violet 3.46 X 52044
Ag-F-K K3Ag2F7 Rb3Cu2Cl7,oS48,68 Ccce 0.63402,2.08119,0.62134,90,90,90 - brown 3.78 X 52044
Ag-F-Mg MgAgF3 CaTiO3,cP5,221 Pm-3m 0.3918,0.3918,0.3918,90,90,90 perovskite family - 5.22 X 5135
Ag-F-Mn AgMnF3 CaTiO3,cP5,221 Pm-3m 0.403,0.403,0.403,90,90,90 perovskite family - 5.58 X 5135
Ag-F-Na NaAgF4 KBrF4-b,tI24,140 I4/mcm 0.554,0.554,1.056,90,90,90 - - 4.24 X 5597
Ag-F-Nb AgNbF6 AgUF6,tP16,132 P42/mcm 0.4978,0.4978,0.9604,90,90,90 - - 4.39 A 38976
Ag-F-Nb AgNb2F12 *,aP15,2 P-1 0.5207,0.55236,0.9061,75.952,88.39,62.922 - - - N 19954
Ag-F-Ni AgNiF3 cub CaTiO3,cP5,221 Pm-3m 0.3936,0.3936,0.3936,90,90,90 perovskite family - 6.09 X 5135
Ag-F-Ni AgNiF3 tet *,tP20,94 P42212 0.556,0.556,0.786,90,90,90 - yellow - N 8451
Ag-F-P AgPF6 AgPF6,cF80,225 Fm-3m 0.75508,0.75508,0.75508,90,90,90 - colorless 3.90 X 38072
Ag-F-Pb AgPbF6 CuSnF6,aP8,2 P-1 0.5239,0.5216,0.5765,65.01,89.08,61.8 - - 5.82 A 39539
Ag-F-Pd AgPdF6 CuPtF6,aP16,2 P-1 0.5015,0.49841,0.9964,77.257,76.9,61.16 - brown 5.17 X 39539
Ag-F-Pt AgPtF6 CuPtF6,aP16,2 P-1 0.50161,0.504,1.0107,77.08,77.361,60.856 - - 6.42 A 39539
Ag-F-Pt Ag1.5 Pt0.5F6 Ag(Ag0.5 As0.5 )F6,mP18,13 P12/c1 0.569,0.525,0.781,90,97.7,90 - - 5.36 A 35764
Ag-F-Rb RbAgF3 KCuF3,tI20,140 I4/mcm 0.6335,0.6335,0.844,90,90,90 - brown 4.91 X 6162
Ag-F-Rh AgRhF6 CuPtF6,aP16,2 P-1 0.50109,0.5011,0.9976,77.8,77.79,61.458 - - 5.06 A 39539
Ag-F-Ru AgRuF7 PrPtF7,mP36,14 P121/c1 0.83432,0.54933,1.22149,90,112.051,90 - black 4.38 X 30077
Ag-F-Ru Ag1.5 Ru0.5 F6 Ag(Ag0.5 As0.5 )F6,mP18,13 P12/c1 0.567,0.523,0.78,90,97.2,90 - - 4.72 A 35764
Ag-F-Sb AgSbF6 KSbF6,cI64,206 Ia-3 0.97985,0.97985,0.97985,90,90,90 - - 4.85 X 38976
Ag-F-Sb AgSb2F11 [H3O]Sb2F11,oP336,61 Pbca 1.0918,1.24628,3.8802,90,90,90 - colorless 4.23 X 41584
Ag-F-Sb AgSb2F12 AgSb2F12,aP15,2 P-1 0.5224,0.5467,0.8779,75.78,89.02,65.29 - blue 4.38 X 20143
Ag-F-Sb Ag1.5 Sb0.5 F6 Ag(Ag0.5 As0.5 )F6,mP18,13 P12/c1 0.57,0.527,0.783,90,97.2,90 - - 4.79 A 35764
Ag-F-Sn AgSnF6 CuSnF6,aP8,2 P-1 0.52496,0.53215,0.59298,59.776,87.016,58.919 - blue light 4.81 X 39539
Ag-F-Ta AgTaF6 AgUF6,tP16,132 P42/mcm 0.49949,0.49949,0.96051,90,90,90 - - 5.58 X 38976
Ag-F-Ta AgTa2F12 *,aP15,2 P-1 0.5198,0.55085,0.9044,75.896,88.47,62.945 - - - N 19954
Ag-F-Ti AgTiF6 CuSnF6,aP8,2 P-1 0.5313,0.52936,0.57371,60.945,89.856,59.05 - blue dark 3.92 X 39539
Ag-F-Tl AgTlF4 KTlF4,hP36,144 P31 0.7891,0.7891,0.9792,90,90,120 - - 7.33 A 7712
Ag-F-U AgUF6 AgUF6,tP16,132 P42/mcm 0.5423,0.5423,0.795,90,90,90 - - 6.53 X 2567
Ag-F-V Ag1.5 V0.5 F3 rt CsAuCl3,tI20,139 I4/mmm 0.5836,0.5836,0.82,90,90,90 - green 5.81 A 21878
Ag-F-V Ag3 VF6 ht [NH4]3FeF6,cF40,225 Fm-3m 0.8224,0.8224,0.8224,90,90,90 perovskite family - 5.83 A 21878
Ag-F-Xe AgXeF9 AgXeF9,tI44,87 I4/m 0.5593,0.5593,2.0379,90,90,90 - - 4.27 X 22271
Ag-F-Y AgYF4 KTlF4,hP36,144 P31 0.7877,0.7877,0.9774,90,90,120 - - 5.17 A 7712
Ag-F-Zn AgZnF3 CaTiO3,cP5,221 Pm-3m 0.399,0.399,0.399,90,90,90 perovskite family - 6.02 X 11907
Ag-F-Zr Ag3Zr2F14 Ag3Hf2F14,mS38,12 C12/m1 0.92527,0.66909,0.90874,90,91.13,90 - blue violet 4.56 A 20840
Ag-F-Zr Ag7Zr6F31 Na7Zr6F31,hR132,148 R-3 1.39878,1.39878,0.97802,90,90,120 - colorless 5.69 X 38141
Ag-Fe-Nd AgNd6Fe13 Pr6Fe13Ge,tI80,140 I4/mcm 0.81035,0.81035,2.27157,90,90,90 - - 7.57 A 28867
Ag-Fe-O AgFeO2 ht AgFeO2,hP8,194 P63/mmc 0.3039,0.3039,1.2395,90,90,120 - red ruby 6.56 X 6399
Ag-Fe-O AgFeO2 rt CuFeO2,hR12,166 R-3m 0.3041,0.3041,1.855,90,90,120 - red 6.56 A 20313
Ag-Fe-Pr AgPr6Fe13 Pr6Fe13Ge,tI80,140 I4/mcm 0.81188,0.81188,2.2816,90,90,90 - - 7.42 X 34611
Ag-Fe-S AgFeS2 CuFeS2,tI16,122 I-42d 0.54371,0.54371,1.08479,90,90,90 lenaite - 4.72 X 46146
Ag-Fe-S AgFe 2S3 arg AgFe 2S3,mP24,14 P121/c1 0.66902,0.64525,1.32366,90,120.118,90 argentopyrite gray dark 4.24 X 51825
Ag-Fe-S AgFe 2S3 ste AgFe 2S3,oS48,64 Cmce 1.1639,0.6615,1.2693,90,90,90 sternbergite - 4.29 X 20563
Ag-Fe-Se AgFeSe 2 *,t**,* - 0.658,0.658,0.896,90,90,90 - - - N 1010
Ag-Fe-Te AgFeTe 2 tet *,t**,* - 0.714,0.714,0.99,90,90,90 - - - N 1010
Ag-Fe-Te AgFeTe 2 trig AgFeTe 2,hP12,164 P-3m1 0.76,0.76,0.569,90,90,120 - - 7.33 X 2282
186 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Ga-Gd Ag0.20 GdGa1.80 AlB2,hP3,191 P6/mmm 0.4224,0.4224,0.4136,90,90,120 AlB2 family - 7.91 X 34623
Ag-Ga-Gd Ag0.35 GdGa1.65 Cd2Ce,hP3,164 P-3m1 0.4444,0.4444,0.369,90,90,120 AlB2 family - 8.16 A 34623
Ag-Ga-Gd Ag0.5 GdGa0.5 CsCl,cP2,221 Pm-3m 0.36295,0.36295,0.36295,90,90,90 b.c.c. family - 8.55 X 46636
Ag-Ga-Gd Ag0.5 GdGa1.5 CaIn2,hP6,194 P63 /mmc 0.4485,0.4485,0.7277,90,90,120 AlB2 family - 8.27 A 34623
Ag-Ga-Gd Ag0.85 GdGa1.15 KHg2,oI12,74 Imma 0.4546,0.7174,0.7803,90,90,90 AlB2 family - 8.59 A 34623
Ag-Ga-Gd Ag1.07 GdGa1.93 ScRhSi2,oP16,62 Pnma 0.69868,0.43684,1.02339,90,90,90 - - 8.66 A 52436
Ag-Ga-Gd Ag1.8 Gd5Ga15 Rb5Hg19,tI48,87 I4/m 0.94635,0.94635,0.98638,90,90,90 - - 7.62 X 45867
Ag-Ga-Gd Ag2.8 Gd3Ga8.2 La3Al11,oI28,71 Immm 0.43331,0.95169,1.29495,90,90,90 - - 8.37 X 46636
Ag-Ga-Gd Ag36.4 Gd14 Ga14.6 Ag51Gd14,hP68,175 P6/m 1.2566,1.2566,0.9176,90,90,120 - - 9.46 A 46636
Ag-Ga-Hf Ag0.85 HfGa2.15 Cu3Au,cP4,221 Pm-3m 0.40755,0.40755,0.40755,90,90,90 close-packed structure - 10.31 X 41427
Ag-Ga-Ho AgHoGa KHg2,oI12,74 Imma 0.4562,0.7063,0.7852,90,90,90 AlB2 family - 8.99 X 31925
Ag-Ga-Ho Ag0.5 HoGa1.5 CaIn2,hP6,194 P63 /mmc 0.4448,0.4448,0.7116,90,90,120 AlB2 family - 8.81 A 34623
Ag-Ga-Ho Ag0.6 HoGa2.4 Cu3Au,cP4,221 Pm-3m 0.42458,0.42458,0.42458,90,90,90 close-packed structure - 8.61 X 30053
Ag-Ga-Ho Ag1.04 HoGa1.96 ScRhSi2,oP16,62 Pnma 0.69254,0.43115,1.01717,90,90,90 - - 9.05 A 52436
Ag-Ga-Ho Ag2.8 Ho3Ga8.2 La3Al11,oI28,71 Immm 0.4281,0.9475,1.2771,90,90,90 - - 8.77 A 25426
Ag-Ga-In Ag0.6895 Ga0.1482 In0.1623 Mg,hP2,194 P63 /mmc 0.2942,0.2942,0.4725,90,90,120 close-packed structure - 9.69 X 1649
Ag-Ga-La Ag0.18 LaGa1.82 AlB2,hP3,191 P6/mmm 0.43158,0.43158,0.4423,90,90,120 AlB2 family - 6.64 X 53945
Ag-Ga-La Ag0.56 LaGa0.44 CsCl,cP2,221 Pm-3m 0.3792,0.3792,0.3792,90,90,90 b.c.c. family - 7.00 X 53945
Ag-Ga-La Ag0.58 LaGa3.42 CeAl2Ga2,tI10,139 I4/mmm 0.4367,0.4367,1.0718,90,90,90 - - 7.15 A 19064
Ag-Ga-La Ag0.7 La2Ga9.4 (Ag0.35 Ga0.65 )2La2Ga8.1 ,tI42,139 I4/mmm 0.43381,0.43381,2.6163,90,90,90 - - 6.80 X 54940
Ag-Ga-La Ag0.72 LaGa3.28 BaAl4,tI10,139 I4/mmm 0.43824,0.43824,1.06099,90,90,90 - - 7.26 X 53945
Ag-Ga-La Ag0.92 LaGa1.08 KHg2,oI12,74 Imma 0.4723,0.7302,0.8112,90,90,90 AlB2 family - 7.44 A 53945
Ag-Ga-La Ag5.61 LaGa5.39 BaHg11,cP36,221 Pm-3m 0.87649,0.87649,0.87649,90,90,90 - - 8.29 X 53945
Ag-Ga-Li LiAg0.5 Ga0.5 NaTl,cF16,227 Fd-3m 0.6289,0.6289,0.6289,90,90,90 b.c.c. family yellowish 5.11 X 4311
Ag-Ga-Lu Ag0.5 LuGa1.5 CaIn2,hP6,194 P63 /mmc 0.4421,0.4421,0.6977,90,90,120 AlB2 family - 9.38 A 34623
Ag-Ga-Lu Ag1.2 LuGa1.8 ScRhSi2,oP16,62 Pnma 0.68821,0.42695,1.01268,90,90,90 - - 9.60 X 52436
Ag-Ga-Lu Ag3.5 Lu3Ga7.5 La3Al11,oI28,71 Immm 0.4421,0.9549,1.2498,90,90,90 - - 8.97 A 25426
Ag-Ga-Mg Mg0.8 AgGa0.2 CsCl,cP2,221 Pm-3m 0.3289,0.3289,0.3289,90,90,90 b.c.c. family - 6.59 X 6341
Ag-Ga-Mg Mg1.4 Ag2.2 Ga0.4 BiF3,cF16,225 Fm-3m 0.6551,0.6551,0.6551,90,90,90 b.c.c. family - 7.07 X 6341
Ag-Ga-Mg Mg3Ag0.55 Ga0.45 Mg3(Ag0.55 Ga0.45),hR72,148 R-3 0.8248,0.8248,2.5658,90,90,120 - - 3.24 X 45796
Ag-Ga-Mo AgMo8Ga40 V8Ga41,hR147,148 R-3 1.40063,1.40063,1.5128,90,90,120 - gray 7.10 A 16155
Ag-Ga-Na Na15.2 Ag1.3 Ga28.7 Na15.2(Ag0.2 Ga0.8 )6Ga24,hP94,191 P6/mmm 1.5161,1.5161,0.9267,90,90,120 - - 4.48 X 40940
Ag-Ga-Na Na18Ag3.5 Ga36.5 Na17.5(Cd0.75 Ga0.25 )...,cF464,227 Fd-3m 2.0857,2.0857,2.0857,90,90,90 - - 4.88 X 28311
Ag-Ga-Na Na30.5 Ag6.4 Ga53.6 K23Na8Cd12In48,hP91,191 P6/mmm 1.5192,1.5192,0.9299,90,90,120 - - 4.58 X 40940
Ag-Ga-Nd AgNdGa KHg2,oI12,74 Imma 0.4624,0.7323,0.7878,90,90,90 AlB2 family - 8.01 A 38823
Ag-Ga-Nd Ag0.5 NdGa1.5 CaIn2,hP6,194 P63 /mmc 0.4518,0.4518,0.7508,90,90,120 AlB2 family - 7.58 A 34623
Ag-Ga-Nd Ag0.82 NdGa3.18 CeAl2Ga2,tI10,139 I4/mmm 0.4268,0.4268,1.0815,90,90,90 - - 7.66 A 19064
Ag-Ga-O AgGaO2 ht NaFeO2,oP16,33 Pna21 0.5568,0.7162,0.5477,90,90,90 - - 6.37 A 56455
Ag-Ga-O AgGaO2 rt CuFeO2,hR12,166 R-3m 0.3002,0.3002,1.855,90,90,120 - gray 7.21 A 20313
Ag-Ga-O Ag1.78 Ga11 O17.39 ht Ag1.22 Al11 O17.11 ,hP92,194 P63 /mmc 0.534,0.534,2.311,90,90,120 β-alumina - 7.20 A 14196
Ag-Ga-Pr AgPrGa KHg2,oI12,74 Imma 0.4631,0.7408,0.7884,90,90,90 AlB2 family - 7.82 A 38823
Ag-Ga-Pr Ag0.72 PrGa3.28 CeAl2Ga2,tI10,139 I4/mmm 0.4293,0.4293,1.0778,90,90,90 - - 7.48 X 19064
Ag-Ga-Rb RbAg0.36 Ga2.64 RbGa3,tI24,119 I-4m2 0.6314,0.6314,1.505,90,90,90 - - 5.12 A 40190
Ag-Ga-S AgGaS2 hp AgGaS2,mS16,9 C1c1 0.8031,0.8014,0.6221,90,128.42,90 - yellow 5.12 X 37981
Ag-Ga-S AgGaS2 CuFeS2,tI16,122 I-42d 0.57572,0.57572,1.03036,90,90,90 adamantane structure green dark 4.70 X 7505
Ag-Ga-S Ag0.03 Ga0.65 S Ga+ ht ZnS,cF8,216 F-43m 0.52,0.52,0.52,90,90,90 adamantane structure yellow 3.81 X 10058
Ag-Ga-S Ag9GaS6 ht Ag9GaSe6 ,cF220,216 F-43m 1.0798,1.0798,1.0798,90,90,90 - black 6.50 A 10058
Ag-Ga-S Ag9GaS6 rt *,oP32,* - 0.7605,0.7706,1.0777,90,90,90 - black 6.48 N 10058
Ag-Ga-Se AgGaSe2 CuFeS2,tI16,122 I-42d 0.5999,0.5999,1.0856,90,90,90 adamantane structure brown 5.70 X 58621
Ag-Ga-Se Ag0.5 Ga0.5 Se hp ZnS,cF8,216 F-43m 0.567,0.567,0.567,90,90,90 adamantane structure - 6.11 X 10621
Ag-Ga-Se Ag9GaSe6 lt Ag9GaSe6 ,cP64,198 P213 1.1126,1.1126,1.1126,90,90,90 - black 7.30 X 11268
Ag-Ga-Se Ag9GaSe6 rt Ag9GaSe6 ,cF220,216 F-43m 1.1126,1.1126,1.1126,90,90,90 - - 7.30 X 14362
Ag-Ga-Sm AgSmGa KHg2,oI12,74 Imma 0.4581,0.7225,0.7838,90,90,90 AlB2 family - 8.40 A 38823
Ag-Ga-Sm AgSmGa3 CeAl2Ga2,tI10,139 I4/mmm 0.4226,0.4226,1.0859,90,90,90 - - 8.00 A 19064
Ag-Ga-Sm Ag0.5 SmGa1.5 CaIn2,hP6,194 P63 /mmc 0.4496,0.4496,0.7381,90,90,120 AlB2 family - 7.94 A 34623
Ag-Ga-Sm Ag1.2 SmGa1.8 ScRhSi2,oP16,62 Pnma 0.70267,0.44064,1.02731,90,90,90 - - 8.46 X 52436
Ag-Ga-Sr SrAg0.5 Ga3.5 CeAl2Ga2,tI10,139 I4/mmm 0.4405,0.4405,1.0914,90,90,90 - - 6.05 X 23588
Ag-Ga-Tb Ag0.7 TbGa0.3 CsCl,cP2,221 Pm-3m 0.36135,0.36135,0.36135,90,90,90 b.c.c. family - 8.99 X 41656
Ag-Ga-Tb Ag0.7 TbGa1.3 CaIn2,hP6,194 P63 /mmc 0.44935,0.44935,0.71721,90,90,120 AlB2 family - 8.61 X 41656
Ag-Ga-Tb Ag0.9 TbGa1.1 KHg2,oI12,74 Imma 0.45246,0.71119,0.77859,90,90,90 AlB2 family - 8.82 X 41656
Ag-Ga-Tb Ag0.9 Tb4Ga12.1 Y4PdGa12,cI34,229 Im-3m 0.86537,0.86537,0.86537,90,90,90 - - 8.08 X 41656
Ag-Ga-Tb Ag1.2 TbGa1.8 ScRhSi2,oP16,62 Pnma 0.69742,0.43587,1.02098,90,90,90 - - 8.86 X 41656
Ag-Ga-Tb Ag2 Tb5Ga15.6 Rb5Hg19,tI48,87 I4/m 0.94313,0.94313,0.98491,90,90,90 - - 7.95 X 45867
Ag-Ga-Tb Ag2.8 Tb3Ga8.2 La3Al11,oI28,71 Immm 0.43155,0.9517,1.2881,90,90,90 - - 8.48 X 41656
Ag-Ga-Tb Ag42.3 Tb14 Ga7.8 Ag51Gd14,hP68,175 P6/m 1.25515,1.25515,0.91728,90,90,120 - - 9.73 X 41656
Ag-Ga-Te AgGaTe2 hp cub2 *,cP*,* - 1.0185,1.0185,1.0185,90,90,90 - - - N 4920
Ag-Ga-Te AgGaTe2 CuFeS2,tI16,122 I-42d 0.63,0.63,1.194,90,90,90 adamantane structure black 6.07 X 21631
Ag-Ga-Te AgGa3 Te5 hp AgGa3 Te5 ,mS80,5 C121 1.433,1.4308,1.0127,90,90.2,90 - black 6.11 X 18052
Ag-Ga-Te AgGa5 Te8 rt *,oP56,60 Pbcn 0.6,1.202,2.438,90,90,90 - - - N 21631
Ag-Ga-Te Ag0.08 Ga0.64 Te ZnS,cF8,216 F-43m 0.5864,0.5864,0.5864,90,90,90 adamantane structure - 5.96 X 3121
Ag-Ga-Te Ag0.317 Ga0.561 Te ht (Ag0.36 Ga0.64 )0.88 Te,tI4,119 I-4m2 0.4430,0.4430,0.5986,90,90,90 - black 5.68 X 21631
Ag-Ga-Te Ag0.5 Ga0.5 Te hp cub1 ZnS,cF8,216 F-43m 0.5693,0.5693,0.5693,90,90,90 adamantane structure - 7.79 X 16114
Ag-Ga-Te Ag9GaTe6 ht *,hP32,194 P63 /mmc 0.826,0.826,1.3407,90,90,120 - black - N 20766
Ag-Ga-Te Ag9GaTe6 rt *,hP128,182 P6322 1.641,1.641,1.324,90,90,120 - black - N 15980
Ag-Ga-Ti Ag0.12 TiGa2.88 TiAl3,tI8,139 I4/mmm 0.3798,0.3798,0.8755,90,90,90 close-packed structure - 6.88 X 41427
Ag-Ga-Ti Ag0.52 TiGa2.48 Cu3Au,cP4,221 Pm-3m 0.3984,0.3984,0.3984,90,90,90 close-packed structure - 7.27 X 41427
Ag-Ga-Tm AgTmGa KHg2,oI12,74 Imma 0.4483,0.6934,0.7785,90,90,90 AlB2 family - 9.51 A 34623
Ag-Ga-Tm Ag0.5 TmGa1.5 CaIn2,hP6,194 P63 /mmc 0.4433,0.4433,0.7028,90,90,120 AlB2 family - 9.09 A 34623
Handbook of Inorganic Substances – Edition 2015 : Data 187

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Ga-Tm Ag1.1 TmGa1.9 ScRhSi2,oP16,62 Pnma 0.68976,0.42838,1.01424,90,90,90 - - 9.31 A 52436


Ag-Ga-Tm Ag2.8 Tm3Ga8.2 La3Al11,oI28,71 Immm 0.428,0.9551,1.2681,90,90,90 - - 8.84 A 25426
Ag-Ga-Y Ag0.22 YGa1.78 CaIn2,hP6,194 P63/mmc 0.44565,0.44565,0.72032,90,90,120 AlB2 family - 6.35 X 44801
Ag-Ga-Y Ag0.74 YGa1.26 KHg2,oI12,74 Imma 0.45302,0.70805,0.78056,90,90,90 AlB2 family - 6.81 X 44801
Ag-Ga-Y Ag1.1 YGa1.9 ScRhSi2,oP16,62 Pnma 0.69654,0.43391,1.02126,90,90,90 - - 7.32 X 44801
Ag-Ga-Y Ag2.55 Y3Ga8.45 La3Al11,oI28,71 Immm 0.431,0.9552,1.2865,90,90,90 - - 7.09 X 44801
Ag-Ga-Yb AgYbGa2 ht ScRhSi2,oP16,62 Pnma 0.69563,0.43362,1.03386,90,90,90 - - 8.95 X 30201
Ag-Ga-Yb Ag0.1 YbGa1.9 CaIn2,hP6,194 P63/mmc 0.4463,0.4463,0.7234,90,90,120 AlB2 family - 8.42 A 34623
Ag-Ga-Yb Ag0.25 YbGa3.75 CeAl2Ga2,tI10,139 I4/mmm 0.42788,0.42788,1.0848,90,90,90 - - 7.72 X 27415
Ag-Ga-Yb Ag0.5 YbGa1.5 KHg2,oI12,74 Imma 0.4526,0.72,0.779,90,90,90 AlB2 family - 8.68 A 34623
Ag-Ga-Yb Ag3.21 Yb3Ga7.79 La3Al11,oI28,71 Immm 0.43603,0.9642,1.291,90,90,90 - - 8.62 X 27730
Ag-Gd-Ge AgGdGe ZrNiAl,hP9,189 P-62m 0.71654,0.71654,0.42341,90,90,120 Fe2P family gray light 8.94 X 31761
Ag-Gd-Ge AgGdGe 3 *,o**,* - 0.8113,0.8313,3.478,90,90,90 - - - N 25957
Ag-Gd-Ge AgGd2Ge6 CuCe2Ge6,oS18,38 Amm2 0.41946,0.40583,2.1166,90,90,90 - - 7.91 A 30286
Ag-Gd-Ge Ag0.6 GdGe1.4 AlB2 ,hP3,191 P6/mmm 0.41563,0.41563,0.40556,90,90,120 AlB2 family - 8.86 X 30046
Ag-Gd-In Ag0.4 GdIn0.6 CuTi,tP2,123 P4/mmm 0.3742,0.3742,0.3711,90,90,90 b.c.c. family - 8.61 X 15311
Ag-Gd-In Ag0.5 GdIn0.5 CsCl,cP2,221 Pm-3m 0.3718,0.3718,0.3718,90,90,90 b.c.c. family - 8.68 X 15311
Ag-Gd-In Ag2GdIn Cu2MnAl,cF16,225 Fm-3m 0.6965,0.6965,0.6965,90,90,90 b.c.c. family - 9.59 X 17125
Ag-Gd-Mg Mg0.94 Ag1.06 Gd ZrNiAl,hP9,189 P-62m 0.768,0.768,0.41992,90,90,120 Fe2P family gray light 6.84 X 40567
Ag-Gd-Mg Mg2 AgGd Cu2MnAl,cF16,225 Fm-3m 0.7158,0.7158,0.7158,90,90,90 b.c.c. family - 5.68 X 21342
Ag-Gd-Pb AgGdPb CaIn2,hP6,194 P63/mmc 0.4769,0.4769,0.7475,90,90,120 AlB2 family - 10.65 X 16177
Ag-Gd-Pb Ag0.78 GdPb2.22 Cu3Au,cP4,221 Pm-3m 0.46582,0.46582,0.46582,90,90,90 close-packed structure - 11.52 X 38837
Ag-Gd-S AgGdS2 AgGdS2,mP32,4 P1211 0.7718,0.7718,1.2166,90,90.31,90 - - 6.04 X 26039
Ag-Gd-S Ag0.5 Gd2.5 S4 Th3P 4,cI28,220 I-43d 0.8382,0.8382,0.8382,90,90,90 - - 6.49 A 3019
Ag-Gd-Sb AgGdSb2 CuHfSi2,tP8,129 P4/nmm 0.4295,0.4295,1.05114,90,90,90 - - 8.71 A 40226
Ag-Gd-Se AgGdSe 2 AgYbS2,tI16,109 I41md 0.56639,0.56639,1.245,90,90,90 - - 7.04 A 7249
Ag-Gd-Se Ag0.131 Gd2.623 Se4 Th3P 4,cI28,220 I-43d 0.8728,0.8728,0.8728,90,90,90 - - 7.42 A 7249
Ag-Gd-Si AgGdSi ZrNiAl,hP9,189 P-62m 0.708,0.708,0.4215,90,90,120 Fe2P family - 7.98 A 18134
Ag-Gd-Si Ag2GdSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4151,0.4151,1.0709,90,90,90 - - 7.72 X 12456
Ag-Gd-Sn AgGdSn LiGaGe,hP6,186 P63mc 0.4711,0.4711,0.7424,90,90,120 AlB2 family - 8.93 A 59412
Ag-Gd-Sn Ag0.4 GdSn2.6 Cu3Au,cP4,221 Pm-3m 0.4623,0.4623,0.4623,90,90,90 close-packed structure - 8.55 X 59412
Ag-Gd-Sn Ag0.960 Gd0.028 Sn0.012 Cu,cF4,225 Fm-3m 0.40865,0.40865,0.40865,90,90,90 close-packed structure - 10.65 X 52516
Ag-Gd-Sn Ag1.84 GdSn0.16 MoSi2,tI6,139 I4/mmm 0.37356,0.37356,0.92819,90,90,90 b.c.c. family - 9.61 A 52516
Ag-Gd-Sn Ag4Gd3Sn4 Cu4Gd3Ge4,oI22,71 Immm 0.45658,0.73063,1.5221,90,90,90 - - 9.01 X 48686
Ag-Gd-Sn Ag49.20 Gd13.52 Sn2.28 Ag51 Gd14,hP68,175 P6/m 1.26868,1.26868,0.93194,90,90,120 - - 9.85 A 52516
Ag-Gd-Te AgGdTe 2 ht CuScS2,hP4,156 P3m1 0.443,0.443,0.724,90,90,120 - - 7.02 A 7304
Ag-Gd-Te AgGdTe 2 rt *,tP8,113 P-421m 0.7172,0.7172,0.4633,90,90,90 - - - N 7304
Ag-Gd-Tl Ag0.5 Tl0.5 Gd lt CuTi,tP2,123 P4/mmm 0.37,0.37,0.374,90,90,90 b.c.c. family - 10.16 X 16204
Ag-Gd-Tl Ag0.5 Tl0.5 Gd rt CsCl,cP2,221 Pm-3m 0.3724,0.3724,0.3724,90,90,90 b.c.c. family - 10.08 X 16204
Ag-Gd-Zn AgZnGd KHg2,oI12,74 Imma 0.4618,0.7083,0.782,90,90,90 AlB2 family - 8.58 A 37142
Ag-Gd-Zn Ag0.5 Zn0.5 Gd CsCl,cP2,221 Pm-3m 0.3644,0.3644,0.3644,90,90,90 b.c.c. family - 8.37 X 14334
Ag-Ge-Ho AgHoGe ZrNiAl,hP9,189 P-62m 0.7084,0.7084,0.4179,90,90,120 Fe2P family gray light 9.47 X 25474
Ag-Ge-La AgLaGe NdPtSb,hP6,186 P63mc 0.45587,0.45587,0.78969,90,90,120 AlB2 family - 7.46 X 24829
Ag-Ge-La AgLa2Ge6 CuCe2Ge6,oS18,38 Amm2 0.415,0.434,2.1853,90,90,90 - - 6.93 X 36536
Ag-Ge-La Ag0.8 LaGe1.2 AlB2 ,hP3,191 P6/mmm 0.4366,0.4366,0.428,90,90,120 AlB2 family - 7.34 X 36536
Ag-Ge-La Ag1.4 LaGe0.6 ZrNiAl,hP9,189 P-62m 0.7307,0.7307,0.4298,90,90,120 Fe2P family - 8.36 A 38760
Ag-Ge-La Ag2LaGe 2 CeAl2Ga2,tI10,139 I4/mmm 0.4358,0.4358,1.0982,90,90,90 - - 7.96 A 36536
Ag-Ge-La Ag4La3Ge4 Cu4Gd3Ge4,oI22,71 Immm 0.4418,0.7054,1.4891,90,90,90 - - 8.15 A 38760
Ag-Ge-Li LiAg2Ge Cu2MnAl,cF16,225 Fm-3m 0.6326,0.6326,0.6326,90,90,90 b.c.c. family - 7.75 X 27349
Ag-Ge-Li Li1.5 Ag1.5 Ge Cu3Au,cP4,221 Pm-3m 0.4045,0.4045,0.4045,90,90,90 close-packed structure - 6.14 X 33655
Ag-Ge-Li Li3Ag2Ge3 Li3Ag2Si3,tP16,134 P42/nnm 0.6169,0.6169,0.6213,90,90,90 - - 6.38 X 33655
Ag-Ge-Lu AgLuGe ZrNiAl,hP9,189 P-62m 0.70125,0.70125,0.41337,90,90,120 Fe2P family gray light 10.06 A 31761
Ag-Ge-Nd AgNd2Ge6 CuCe2Ge6,oS18,38 Amm2 0.42709,0.41169,2.1517,90,90,90 - - 7.30 A 30286
Ag-Ge-Nd Ag0.7 NdGe1.3 AlB2 ,hP3,191 P6/mmm 0.4324,0.4324,0.4094,90,90,120 AlB2 family - 7.87 X 51967
Ag-Ge-Nd Ag1.4 NdGe0.6 ZrNiAl,hP9,189 P-62m 0.7268,0.7268,0.4305,90,90,120 Fe2P family - 8.57 A 51967
Ag-Ge-Nd Ag2NdGe2 CeAl2Ga2,tI10,139 I4/mmm 0.4256,0.4256,1.0995,90,90,90 - - 8.42 X 46378
Ag-Ge-Nd Ag4Nd3Ge4 Cu4Gd3Ge4,oI22,71 Immm 0.44009,0.70826,1.46256,90,90,90 - - 8.41 X 54228
Ag-Ge-O Ag2GeO3 Ag2SiO3,oP24,19 P212121 0.46309,0.71393,1.04079,90,90,90 - - 6.49 X 55205
Ag-Ge-O Ag2Ge 2O5 Ag2Ge2O5,mP108,14 P121/c1 1.1013,1.0063,1.2219,90,94.6,90 - yellow 6.51 X 17579
Ag-Ge-O Ag4[GeO4] tricl Ag4[GeO4],aP36,2 P-1 0.64099,0.85122,1.00891,106.91,92.19,95.8 - black dark 7.22 X 31189
Ag-Ge-O Ag5[GeO4] rt Ag5[GeO4],mP40,14 P121/c1 0.63766,0.99178,1.10951,90,123.69,90 - yellowish 7.69 X 26850
Ag-Ge-O Ag6[Ge 2O7] rt Ag6[Si2O7],mP60,4 P1211 0.53713,0.99835,1.62249,90,90.904,90 - red dark 6.91 X 32463
Ag-Ge-O Ag8Ge 3O10 Ag8Ge3O10,mP168,7 P1c1 1.21549,1.07375,1.85169,90,92.326,90 - black 6.83 X 32648
Ag-Ge-P Ag3Ge 5P 6 Ag3Ge5P 6,cI56,217 I-43m 1.0322,1.0322,1.0322,90,90,90 - red garnet 5.27 X 10151
Ag-Ge-Pr AgPrGe NdPtSb,hP6,186 P63mc 0.45276,0.45276,0.76357,90,90,120 AlB2 family - 7.87 X 32370
Ag-Ge-Pr AgPr2Ge6 CuCe2Ge6,oS18,38 Amm2 0.42856,0.41263,2.15869,90,90,90 - - 7.18 A 38760
Ag-Ge-Pr Ag0.24 PrGe1.76 ht ThSi2,tI12,141 I41/amd 0.428,0.428,1.408,90,90,90 - - 7.59 A 32370
Ag-Ge-Pr Ag0.8 PrGe1.2 AlB2 ,hP3,191 P6/mmm 0.43408,0.43408,0.41329,90,90,120 AlB2 family - 7.74 X 55404
Ag-Ge-Pr Ag1.4 PrGe0.6 ZrNiAl,hP9,189 P-62m 0.72989,0.72989,0.4334,90,90,120 Fe2P family - 8.36 A 38760
Ag-Ge-Pr Ag2PrGe 2 CeAl2Ga2,tI10,139 I4/mmm 0.42754,0.42754,1.1019,90,90,90 - - 8.27 X 46378
Ag-Ge-Pr Ag4Pr3Ge4 Cu4Gd3Ge4,oI22,71 Immm 0.4436,0.712,1.474,90,90,90 - - 8.17 A 55404
Ag-Ge-S Ag10 Ge3S11 *,mS*,* - 2.5043,0.6481,2.6206,90,109.95,90 - gray 5.48 N 13600
Ag-Ge-S Ag2GeS3 rt Li2SiO3,oS24,36 Cmc21 1.17895,0.70751,0.6342,90,90,90 adamantane structure orange 4.83 X 55175
Ag-Ge-S Ag8GeS6 ht Ag8GeTe 6,cF220,216 F-43m 1.07,1.07,1.07,90,90,90 - - 6.12 A 3916
Ag-Ge-S Ag8GeS6 rt Ag8GeS6,oP60,33 Pna21 1.5149,0.7476,1.0589,90,90,90 argyrodite gray 6.25 X 10854
Ag-Ge-Sc AgScGe ZrNiAl,hP9,189 P-62m 0.6882,0.6882,0.4026,90,90,120 Fe2P family - 6.80 A 21901
Ag-Ge-Se Ag8GeSe 6 ht Ag8GeTe 6,cF220,216 F-43m 1.096,1.096,1.096,90,90,90 - - 7.11 A 39684
Ag-Ge-Se Ag8GeSe 6 rt Ag8GeSe 6,oP30,31 Pmn21 0.7823,0.7712,1.0885,90,90,90 - black 7.13 X 13021
188 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Ge-Sm AgSm2Ge 6 CuCe2Ge6 ,oS18,38 Amm2 0.42394,0.40956,2.1346,90,90,90 - - 7.56 A 30286


Ag-Ge-Sm Ag1.4 SmGe 0.6 ZrNiAl,hP9,189 P-62m 0.7185,0.7185,0.4274,90,90,120 Fe2P family gray light 8.99 A 51967
Ag-Ge-Sm Ag2SmGe 2 CeAl2Ga2,tI10,139 I4/mmm 0.4226,0.4226,1.1045,90,90,90 - - 8.61 X 53137
Ag-Ge-Sm Ag4Sm3Ge 4 Cu4Gd3Ge4,oI22,71 Immm 0.43728,0.70924,1.4566,90,90,90 - - 8.62 A 53948
Ag-Ge-Sr SrAgGe Sr(Ag0.5 Ge0.5)2,mS30,12 C12/m1 1.1064,0.4671,1.4171,90,98.64,90 - - 6.15 X 31703
Ag-Ge-Sr SrAg0.9 Ge 1.1 AlB2,hP3,191 P6/mmm 0.4439,0.4439,0.4443,90,90,120 AlB2 family - 5.79 X 31703
Ag-Ge-Sr SrAg1.1 Ge 0.9 KHg2,oI12,74 Imma 0.4708,0.7568,0.8084,90,90,90 AlB2 family - 6.26 A 31703
Ag-Ge-Sr SrAg2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.445,0.445,1.085,90,90,90 - - 6.93 X 5607
Ag-Ge-Tb AgTbGe ZrNiAl,hP9,189 P-62m 0.71221,0.71221,0.41221,90,90,120 Fe2P family gray light 9.34 X 34632
Ag-Ge-Te Ag8GeTe6 rt Ag8GeTe6 ,cF336,216 F-43m 1.1566,1.1566,1.1566,90,90,90 - - 7.30 X 9666
Ag-Ge-Tm AgTmGe ZrNiAl,hP9,189 P-62m 0.7026,0.7026,0.4143,90,90,120 Fe2P family gray light 9.83 X 52725
Ag-Ge-Y Ag1.4 YGe 0.6 ZrNiAl,hP9,189 P-62m 0.7189,0.7189,0.4162,90,90,120 Fe2P family gray light 7.58 A 38115
Ag-Ge-Y Ag4 Y3Ge4 Cu4Gd3Ge4,oI22,71 Immm 0.431,0.7072,1.44,90,90,90 - - 7.48 A 38115
Ag-Ge-Yb AgYbGe ZrNiAl,hP9,189 P-62m 0.7052,0.7052,0.41387,90,90,120 Fe2P family gray light 9.88 X 33874
Ag-Ge-Yb Ag0.5 Yb2Ge 4 Ag0.5 Yb2Ge4,aP8,1 P1 0.39143,0.40387,0.80246,104.575,90.,90. - - 9.34 X 56431
Ag-H-Pd Ag0.3 Pd0.7 H0.4 ht Cu,cF4,225 Fm-3m 0.4012,0.4012,0.4012,90,90,90 close-packed structure - 11.03 F 1954
Ag-Hf-Pd Ag0.5 Hf2Pd0.5 CuZr2,tI6,139 I4/mmm 0.32,0.32,1.088,90,90,90 b.c.c. family - 13.84 A 2432
Ag-Hf-S Ag2HfS3 rt Ag2HfS3,oS48,64 Cmce 1.14579,0.66275,1.27739,90,90,90 - brown 6.72 X 30194
Ag-Hf-S Ag4Hf3S8 Ag4Hf3S8,cP100,213 P4132 1.09051,1.09051,1.09051,90,90,90 - black gray 6.27 X 30540
Ag-Hf-Sn Ag0.6 Hf5Sn3.4 CuHf5Sn3,hP18,193 P63 /mcm 0.8294,0.8294,0.5665,90,90,120 AlB2 family - 13.39 A 55916
Ag-Hg-I Ag0.5 Hg0.25 I ht1 ZnS,cF8,216 F-43m 0.63384,0.63384,0.63384,90,90,90 adamantane structure red 6.03 X 43476
Ag-Hg-I Ag0.5 Hg0.25 I ht2 YH0.18 ,hP8,194 P63 /mmc 0.44833,0.44833,0.73252,90,90,120 - - 6.02 X 38945
Ag-Hg-I Ag0.5 Hg0.25 I ht3 AgI,cI38,229 Im-3m 0.5016,0.5016,0.5016,90,90,90 - - 6.08 X 38945
Ag-Hg-I Ag2HgI4 rt CdGa2S4,tI14,82 I-4 0.63193,0.63193,1.2605,90,90,90 - golden 6.10 X 43476
Ag-Hg-O Ag2HgO2 Ag2HgO2,tP20,92 P41212 0.6174,0.6174,0.8422,90,90,90 - - 9.28 X 37020
Ag-Hg-Pt Ag0.66 Hg0.67Pt0.67 NiAs,hP4,194 P63 /mmc 0.408,0.408,0.5407,90,90,120 AlB2 family - 14.33 X 6345
Ag-Hg-S Ag2HgS2 Ag2HgS2,mP10,14 P121/c1 0.40394,0.8005,0.65812,90,107.12,90 imiterite gray white 7.85 X 17871
Ag-Hg-Sb Ag0.86 Hg0.002 Sb0.138 Mg,hP2,194 P63 /mmc 0.2952,0.2952,0.4773,90,90,120 allargentum - 10.14 X 5115
Ag-Hg-Sb Ag0.919 Hg0.005 Sb0.076 Cu,cF4,225 Fm-3m 0.412,0.412,0.412,90,90,90 silver - 10.39 X 5115
Ag-Hg-Ti Ag0.5 HgTi0.5 CuAu,tP2,123 P4/mmm 0.29345,0.29345,0.406,90,90,90 close-packed structure - 13.23 X 9102
Ag-Ho-In Ag0.5 HoIn0.5 CsCl,cP2,221 Pm-3m 0.3666,0.3666,0.3666,90,90,90 b.c.c. family - 9.31 X 14327
Ag-Ho-In Ag2HoIn Cu2MnAl,cF16,225 Fm-3m 0.6893,0.6893,0.6893,90,90,90 b.c.c. family - 10.05 X 17125
Ag-Ho-Mg MgAgHo ZrNiAl,hP9,189 P-62m 0.76332,0.76332,0.41162,90,90,120 Fe2P family - 7.13 A 39201
Ag-Ho-Pb AgHoPb LiGaGe,hP6,186 P63 mc 0.47297,0.47297,0.73798,90,90,120 AlB2 family - 11.15 X 38785
Ag-Ho-Pb Ag0.78 HoPb2.22 Cu3Au,cP4,221 Pm-3m 0.46175,0.46175,0.46175,90,90,90 close-packed structure - 11.96 X 38837
Ag-Ho-S AgHoS2 AgGdS2,mP32,4 P1211 0.7633,0.7637,1.1958,90,89.93,90 - - 6.42 X 26039
Ag-Ho-Sb AgHoSb2 CuHfSi2,tP8,129 P4/nmm 0.4267,0.4267,1.04202,90,90,90 - - 9.04 A 40226
Ag-Ho-Se AgHoSe2 ht1 AgYbS2,tI16,109 I41md 0.56074,0.56074,1.226,90,90,90 - - 7.42 A 7249
Ag-Ho-Se AgHoSe2 rt AgErSe2,oP16,19 P212121 0.4212,0.6814,1.3698,90,90,90 - - 7.28 X 49193
Ag-Ho-Se Ag0.5 Ho0.5 Se ht2 NaCl,cF8,225 Fm-3m 0.57623,0.57623,0.57623,90,90,90 rocksalt family - 7.48 X 49193
Ag-Ho-Si AgHoSi ZrNiAl,hP9,189 P-62m 0.6996,0.6996,0.4159,90,90,120 Fe2P family - 8.50 A 57891
Ag-Ho-Sn AgHoSn NdPtSb,hP6,186 P63 mc 0.4672,0.4672,0.7317,90,90,120 AlB2 family - 9.40 X 51636
Ag-Ho-Sn AgHoSn2 Cu3Au,cP4,221 Pm-3m 0.4513,0.4513,0.4513,90,90,90 close-packed structure - 9.22 X 48686
Ag-Ho-Sn Ag4Ho3Sn4 Cu4Gd3Ge4,oI22,71 Immm 0.45195,0.72815,1.50945,90,90,90 - - 9.37 X 48686
Ag-Ho-Te AgHoTe2 ht CuScS2,hP4,156 P3m1 0.4305,0.4305,0.701,90,90,120 - - 7.79 A 7304
Ag-Ho-Te AgHoTe2 rt AgErTe2,tP8,113 P-42 1m 0.71033,0.71033,0.45713,90,90,90 - - 7.60 X 46690
Ag-I-In AgInI2 *,tI16,140 I4/mcm 0.8403,0.8403,0.7575,90,90,90 - brown - N 5882
Ag-I-In AgIn2I3 *,hR54,166 R-3m 1.047,1.047,1.987,90,90,120 - brown - N 5882
Ag-I-K KAg4 I5 rt Ca0.5 Al3Te5,cP72,213 P4132 1.11583,1.11583,1.11583,90,90,90 - - 5.28 X 40490
Ag-I-K K2AgI3 K2AgI3,oP24,62 Pnma 1.001,0.478,1.932,90,90,90 - colorless 4.07 X 8798
Ag-I-O Ag[IO3 ] Ag[IO3 ],oP40,29 Pca21 1.517,0.7265,0.5786,90,90,90 - - 5.89 X 13441
Ag-I-O Ag[IO4 ] Ca[WO4],tI24,88 I41/a 0.5368,0.5368,1.2013,90,90,90 - yellow 5.73 A 53
Ag-I-O Ag5[IO6] rt Ag5[IO6],hR72,167 R-3c 0.59366,0.59366,3.21471,90,90,120 - black 7.74 X 47669
Ag-I-Pb AgPbI3 *,m**,* - 0.6929,0.7492,1.0799,90,108.04,90 - red brick - N 44531
Ag-I-Pb Ag0.50 Pb0.25 I ht BiF3,cF16,225 Fm-3m 0.63519,0.63519,0.63519,90,90,90 b.c.c. family - 6.03 X 40732
Ag-I-Rb RbAg4I5 lt cub RbAg4I5,cP80,213 P4132 1.12393,1.12393,1.12393,90,90,90 - - 5.39 X 40490
Ag-I-Rb RbAg4I5 lt rhom RbAg4I5,hR168,155 R32 1.58105,1.58105,1.93132,90,90,120 - - 5.49 X 10095
Ag-I-Rb RbAg4I5 lt trig RbAg4I5,hP138,152 P3121 1.58004,1.58004,1.93347,90,90,120 - - 5.49 X 46902
Ag-I-Rb Rb2AgI3 K2AgI3,oP24,62 Pnma 1.02376,0.48979,1.99838,90,90,90 - colorless 4.37 X 43452
Ag-I-S Ag1.5 S0.5 I0.5 ht Ag1.5 (S0.5 I0.5 ),cI34,229 Im-3m 0.497,0.497,0.497,90,90,90 - - 6.53 X 19628
Ag-I-S Ag3SI lt Ag3SI,hR15,146 R3 0.69042,0.69042,0.84559,90,90,120 - - 6.89 X 13953
Ag-I-S Ag3SI rt Ag3SI,cP14,221 Pm-3m 0.4892,0.4892,0.4892,90,90,90 - black 6.84 X 19628
Ag-I-Se AgSe3I CuSe3Br,oP20,53 Pmna 1.4935,0.4589,0.8254,90,90,90 - red 5.54 X 42874
Ag-I-Sn AgSn4I9 *,mP*,* - 1.3328,0.4466,1.4293,90,105.48,90 - - - N 20765
Ag-I-Sn Ag0.6 Sn0.2 I ht1 BiF3,cF16,225 Fm-3m 0.63323,0.63323,0.63323,90,90,90 b.c.c. family - 5.63 X 40298
Ag-I-Te AgTeI AgTeI,oF128,70 Fddd 0.4868,2.5,2.573,90,90,90 - black blue 6.15 X 31132
Ag-I-Te AgTe3I CuSe3Br,oP20,53 Pmna 1.623,0.4696,0.8805,90,90,90 - black 6.11 X 42874
Ag-I-Tl AgTlI2 rt TlGaTe2,tI16,140 I4/mcm 0.834,0.834,0.766,90,90,90 - yellow 7.06 X 6553
Ag-I-Tl AgTl2I3 ht AgTl2I3,hR54,148 R-3 1.0443,1.0443,1.9935,90,90,120 - whitish 7.12 X 32446
Ag-I-Tl AgTl3I5 rt Tl3Pb0.5 I5,hP36,190 P-62c 1.048,1.048,1.3415,90,90,120 - gray dark 7.06 X 12032
Ag-I-Zn Ag0.5 Zn0.25 I ht YH0.18 ,hP8,194 P63 /mmc 0.44641,0.44641,0.72691,90,90,120 - - 5.22 X 40298
Ag-I-Zn Ag2ZnI4 rt Ag2ZnI4,oP14,31 Pmn21 0.8799,0.7622,0.72362,90,90,90 - - 5.40 X 40298
Ag-In-K KAg6.5 In6.5 NaZn13,cF112,226 Fm-3c 1.35101,1.35101,1.35101,90,90,90 - - 8.01 X 45228
Ag-In-La Ag0.75 LaIn0.25 lt PuGa,tI16,139 I4/mmm 0.752,0.752,0.781,90,90,90 b.c.c. family - 7.48 X 13900
Ag-In-La Ag0.75 LaIn0.25 rt CsCl,cP2,221 Pm-3m 0.3826,0.3826,0.3826,90,90,90 b.c.c. family - 7.37 X 13900
Ag-In-La Ag2LaIn Cu2MnAl,cF16,225 Fm-3m 0.7156,0.7156,0.7156,90,90,90 b.c.c. family - 8.51 X 17125
Ag-In-La Ag6LaIn6 ThMn12,tI26,139 I4/mmm 0.9676,0.9676,0.5745,90,90,90 CaCu5-Zr4Al3 - 9.11 A 36205
Ag-In-Li LiAg1.68 In1.32 Cu2MnAl,cF16,225 Fm-3m 0.66427,0.66427,0.66427,90,90,90 b.c.c. family - 7.70 X 45218
Handbook of Inorganic Substances – Edition 2015 : Data 189

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-In-Li Li0.10 Ag0.62 In0.28 Mg,hP2,194 P63/mmc 0.30197,0.30197,0.47581,90,90,120 close-packed structure gray dark 8.81 X 59670
Ag-In-Li Li1.95 Ag1.05 In3 Li(Li0.95 Ag0.05 )AgIn3 ,oP12,51 Pmma 0.9325,0.3198,0.8043,90,90,90 - gray dark 6.53 X 59670
Ag-In-Li Li17.375 Ag2.5 In7.125 Li22Pb5,cF432,216 F-43m 2.0089,2.0089,2.0089,90,90,90 b.c.c. family - 3.96 X 48364
Ag-In-Li Li2AgIn Li2AgSb,cF16,216 F-43m 0.6585,0.6585,0.6585,90,90,90 b.c.c. family golden 5.50 X 11386
Ag-In-Mg Mg0.63 AgIn0.12 CsCl,cP2,221 Pm-3m 0.3308,0.3308,0.3308,90,90,90 b.c.c. family - 6.28 X 6341
Ag-In-Mg Mg1.6 Ag2In0.4 Cu2MnAl,cF16,225 Fm-3m 0.6646,0.6646,0.6646,90,90,90 b.c.c. family - 6.80 X 6341
Ag-In-Na Na3AgIn2 Mn3 Ni2Si,cF96,227 Fd-3m 1.3714,1.3714,1.3714,90,90,90 - - 4.19 X 44715
Ag-In-Nd Ag2NdIn Cu2MnAl,cF16,225 Fm-3m 0.7044,0.7044,0.7044,90,90,90 b.c.c. family - 9.02 X 17125
Ag-In-Nd Ag6NdIn6 ThMn12,tI26,139 I4/mmm 0.965,0.965,0.5722,90,90,90 CaCu5-Zr4Al3 - 9.23 A 36205
Ag-In-O AgInO2 CuFeO2,hR12,166 R-3m 0.32768,0.32768,1.8878,90,90,120 - orange 7.23 X 20455
Ag-In-Pr Ag0.5 PrIn0.5 CsCl,cP2,221 Pm-3m 0.3805,0.3805,0.3805,90,90,90 b.c.c. family - 7.60 X 18173
Ag-In-Pr Ag2PrIn Cu2MnAl,cF16,225 Fm-3m 0.7075,0.7075,0.7075,90,90,90 b.c.c. family - 8.84 X 17125
Ag-In-Pr Ag6PrIn6 ThMn12,tI26,139 I4/mmm 0.9669,0.9669,0.5708,90,90,90 CaCu5-Zr4Al3 - 9.19 A 36205
Ag-In-S AgInS2 hp1 NaFeO2,hR12,166 R-3m 0.376,0.376,1.935,90,90,120 rocksalt family - 6.03 X 4919
Ag-In-S AgInS2 ht NaFeO2,oP16,33 Pna21 0.69972,0.82733,0.66939,90,90,90 adamantane structure - 4.92 X 39290
Ag-In-S AgInS2 rt CuFeS2,tI16,122 I-42d 0.5876,0.5876,1.12007,90,90,90 laforetite brown 4.93 X 39290
Ag-In-S Ag0.5 In0.5 S hp2 NaCl,cF8,225 Fm-3m 0.542,0.542,0.542,90,90,90 rocksalt family - 5.98 X 4869
Ag-In-S Ag0.5 In2.5 S4 MgAl2O4,cF56,227 Fd-3m 1.08265,1.08265,1.08265,90,90,90 spinel family gray 4.91 X 39290
Ag-In-Sc Ag2ScIn Cu2MnAl,cF16,225 Fm-3m 0.672,0.672,0.672,90,90,90 b.c.c. family - 8.22 X 20154
Ag-In-Se AgInSe 2 ht-hp mo *,mS*,* - 0.6861,0.39212,0.6986,90,107.33,90 - - - N 15110
Ag-In-Se AgInSe 2 rt CuFeS2,tI16,122 I-42d 0.61038,0.61038,1.17118,90,90,90 adamantane structure brown 5.79 X 13382
Ag-In-Se AgIn5Se8 rt AgIn5Se8,tP14,111 P-42m 0.57934,0.57934,1.16223,90,90,90 - gray 5.59 X 16365
Ag-In-Se Ag0.5 In0.5 Se hp ZnS,cF8,216 F-43m 0.582,0.582,0.582,90,90,90 adamantane structure - 6.41 X 4869
Ag-In-Se Ag0.5 In0.5 Se m NaCl,cF8,225 Fm-3m 0.555,0.555,0.555,90,90,90 rocksalt family - 7.39 X 28717
Ag-In-Se Ag0.9 In1.1 Se2 ht-hp rh NaFeO2,hR12,166 R-3m 0.394,0.394,1.995,90,90,120 rocksalt family - 7.08 A 16378
Ag-In-Sm Ag2SmIn Cu2MnAl,cF16,225 Fm-3m 0.7001,0.7001,0.7001,90,90,90 b.c.c. family - 9.31 X 17125
Ag-In-Sr SrAg0.8 In1.2 KHg2,oI12,74 Imma 0.4977,0.8579,0.7975,90,90,90 AlB2 family - 6.08 X 46425
Ag-In-Tb Ag0.2 TbIn2.8 Cu3Au,cP4,221 Pm-3m 0.4549,0.4549,0.4549,90,90,90 close-packed structure gray 8.86 X 58948
Ag-In-Tb Ag0.4 TbIn0.6 CsCl,cP2,221 Pm-3m 0.3701,0.3701,0.3701,90,90,90 b.c.c. family - 8.88 X 58948
Ag-In-Tb Ag0.95 TbIn1.05 CaIn2,hP6,194 P63/mmc 0.4808,0.4808,0.7034,90,90,120 AlB2 family - 9.01 X 58948
Ag-In-Tb Ag2 TbIn Cu2MnAl,cF16,225 Fm-3m 0.6896,0.6896,0.6896,90,90,90 b.c.c. family - 9.91 X 26278
Ag-In-Tb Ag3 TbIn3 Ag3 TbIn3,cI248,204 Im-3 1.5196,1.5196,1.5196,90,90,90 - - 9.39 X 53394
Ag-In-Te AgInTe 2 rt CuFeS2,tI16,122 I-42d 0.64275,0.64275,1.26089,90,90,90 adamantane structure brown 6.09 X 57781
Ag-In-Te AgIn5 Te8 rt AgIn5Se8,tP14,111 P-42m 0.61952,0.61952,1.2419,90,90,90 - gray 5.93 X 43800
Ag-In-Te Ag0.01 In0.663 Te ht ZnS,cF8,216 F-43m 0.6168,0.6168,0.6168,90,90,90 adamantane structure - 5.80 X 13146
Ag-In-Te Ag0.5 In0.5 Te hp cub NaCl,cF8,225 Fm-3m 0.602,0.602,0.602,90,90,90 rocksalt family - 7.27 X 4869
Ag-In-Te Ag0.5 In0.5 Te hp orth ZnTe,oS8,63 Cmcm 0.58,0.579,0.587,90,90,90 - - 8.05 X 54852
Ag-In-Te Ag0.8 In2.4 Te4 Cu0.72 In2.16 Se3.6,tP16,112 P-42c 0.62443,0.62443,1.25058,90,90,90 - black 5.94 X 57112
Ag-In-Tm Ag0.5 TmIn0.5 CsCl,cP2,221 Pm-3m 0.3629,0.3629,0.3629,90,90,90 b.c.c. family - 9.74 X 14327
Ag-In-Tm Ag2 TmIn Cu2MnAl,cF16,225 Fm-3m 0.6867,0.6867,0.6867,90,90,90 b.c.c. family - 10.25 X 17125
Ag-In-Y Ag2 YIn Cu2MnAl,cF16,225 Fm-3m 0.6914,0.6914,0.6914,90,90,90 b.c.c. family - 8.43 X 17125
Ag-In-Yb Ag2 YbIn4 Ag2 YbIn4,cI248,204 Im-3 1.5362,1.5362,1.5362,90,90,90 - - 9.32 X 34440
Ag-In-Yb Ag34.125 Yb13In34.125 Ag34.125 Yb13In34.125 ,cP760,205 Pa-3 2.48687,2.48687,2.48687,90,90,90 - - 8.51 X 50665
Ag-In-Zr AgZr5In3 CuHf5Sn3,hP18,193 P63/mcm 0.8735,0.8735,0.5948,90,90,120 AlB2 family - 7.68 A 36419
Ag-In-Zr Ag0.4 ZrIn2.6 Cu3Au,cP4,221 Pm-3m 0.43644,0.43644,0.43644,90,90,90 close-packed structure - 8.65 X 35031
Ag-K-O KAgO KAgO,tI24,139 I4/mmm 0.9925,0.9925,0.5458,90,90,90 - colorless 4.03 X 24178
Ag-K-O K3AgO2 Rb3AgO2,oP96,19 P212121 1.23,1.23,1.348,90,90,90 - beige 3.35 X 10960
Ag-K-P K2AgP Na2CuAs,oS16,63 Cmcm 0.9813,0.7694,0.5964,90,90,90 - red 3.20 X 33934
Ag-K-S KAg5S3 KAg5S3,hP54,190 P-62c 1.3196,1.3196,0.7943,90,90,120 - red dark 5.61 X 34048
Ag-K-S K2Ag4S3 K2Ag4S3,mS36,12 C12/m1 1.736,0.4296,1.1603,90,108.32,90 - black 4.90 X 10247
Ag-K-Sb KAg4Sb2 *,hP84,194 P63/mmc 0.8145,0.8145,2.6851,90,90,120 - - - N 19675
Ag-K-Sb K2AgSb K2AgAs,oS16,20 C222 1 0.829,1.044,0.628,90,90,90 - black 3.76 X 11119
Ag-K-Se KAgSe PbClF,tP6,129 P4/nmm 0.452,0.452,0.759,90,90,90 - black 4.84 X 14278
Ag-K-Se KAg3Se2 CsAg3S2,mS24,12 C12/m1 1.661,0.4384,0.8759,90,115.55,90 - black 6.01 X 33945
Ag-K-Se K2Ag12Se7 *,hP*,176 P63/m 1.094,1.094,0.43983,90,90,120 - - - N 36178
Ag-K-Se K2Ag12Se7.11 K2Ag12Se7.11 ,hP66,173 P63 1.8955,1.8955,0.4406,90,90,120 - black 7.03 X 36178
Ag-K-Se K2Ag4Se3 K2Ag4S3,mS36,12 C12/m1 1.777,0.4447,1.1856,90,108.4,90 - black 5.58 X 15239
Ag-K-Te KAg3 Te2 CsAg3S2,mS24,12 C12/m1 1.743,0.4587,0.9044,90,113.33,90 - black 6.18 X 32535
Ag-K-Te KAg6 Te3.5 KAg6 Te3.5 ,hP26,176 P63/m 1.146,1.146,0.466,90,90,120 - - 7.10 X 39271
Ag-La-Mg Mg0.05 Ag1.95 La KHg2,oI12,74 Imma 0.4829,0.7284,0.8199,90,90,90 AlB2 family - 8.07 A 56232
Ag-La-Mg Mg0.47 Ag0.53 La CsCl,cP2,221 Pm-3m 0.38758,0.38758,0.38758,90,90,90 b.c.c. family - 5.92 X 56232
Ag-La-Mg Mg0.9 Ag1.1 La ZrNiAl,hP9,189 P-62m 0.78586,0.78586,0.43694,90,90,120 Fe2P family - 5.96 A 56232
Ag-La-Mg Mg1.1 Ag4.9 La (Mg0.95 Ag0.05)Ag5La,tP14,129 P4/nmm 0.72227,0.72227,0.54433,90,90,90 - - 8.12 X 58103
Ag-La-Mg Mg1.6 Ag4.4 La YbMo 2Al4,tI14,139 I4/mmm 0.71995,0.71995,0.55996,90,90,90 - - 7.47 X 58103
Ag-La-Mg Mg1.75 Ag2.25 La Mg(Mg0.75 Ag0.25 )Ag2La,oS20,63 Cmcm 0.4805,1.7258,0.5527,90,90,90 - - 6.15 X 58103
Ag-La-Mg Mg10.56 Ag1.44 La Mg8 (Mg0.64 Ag0.36)4La,tI208,141 I41/amd 1.01686,1.01686,4.6539,90,90,90 - - 3.04 X 58103
Ag-La-Mg Mg11.5 Ag0.5 La Mg11.82 La1.09 ,oI346,71 Immm 1.0304,1.0309,7.738,90,90,90 - - 2.48 A 56232
Ag-La-Mg Mg12 Ag10.3 La4 Mg9 (Mg0.43 Ag0.57)7Ag6.3 La4,oS116,65 Cmmm 0.9613,2.49663,0.96333,90,90,90 - - 5.63 X 54999
Ag-La-Mg Mg12 Ag4La3 Gd3Ru4Al12,hP38,194 P63/mmc 0.99312,0.99312,1.05459,90,90,120 - - 4.20 X 56232
Ag-La-Mg Mg14.24 Ag3.46 La1.65 Ag0.3 (Ag0.46 Al0.54)17Dy1.7 ,hP42,194 P63/mmc 0.999,0.999,1.006,90,90,120 - - 3.62 X 56232
Ag-La-Mg Mg2 AgLa rt Cu2MnAl,cF16,225 Fm-3m 0.7347,0.7347,0.7347,90,90,90 b.c.c. family - 4.95 X 21342
Ag-La-Mg Mg2.2 Ag48.8 La14 Ag51 Gd14,hP68,175 P6/m 1.2929,1.2929,0.9533,90,90,120 - - 8.74 A 56232
Ag-La-Mg Mg3 Ag10La4 Ca4Au10In3,oS68,64 Cmce 1.4173,1.0266,1.0354,90,90,90 - - 7.53 X 54999
Ag-La-Mn Ag0.8 LaMn0.2 CsCl,cP2,221 Pm-3m 0.37941,0.37941,0.37941,90,90,90 b.c.c. family - 7.18 X 50694
Ag-La-Ni Ag0.05 LaNi4.95 CaCu5,hP6,191 P6/mmm 0.50243,0.50243,0.39832,90,90,120 - - 8.29 X 56225
Ag-La-Ni Ag2.365 La0.525 Ni0.11 MgZn2,hP12,194 P63/mmc 0.5506,0.5506,0.937,90,90,120 Friauf-Laves phase - 9.03 A 56225
Ag-La-O AgLaO3 hp LaAlO3,hR30,167 R-3c 0.5527,0.5527,1.3257,90,90,120 perovskite family - 8.37 A 27649
Ag-La-Pb AgLaPb CaIn2,hP6,194 P63/mmc 0.4782,0.4782,0.785,90,90,120 AlB2 family - 9.70 X 16177
190 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-La-Pb AgLa5Pb3 CuHf5Sn3,hP18,193 P63 /mcm 0.956,0.956,0.7037,90,90,120 AlB2 family - 8.49 A 29066
Ag-La-S Ag0.5 La2.5 S4 Th3P 4,cI28,220 I-43d 0.8699,0.8699,0.8699,90,90,90 - - 5.34 A 3019
Ag-La-Sb AgLaSb2 rt CuHfSi2,tP8,129 P4/nmm 0.4374,0.4374,1.0802,90,90,90 - - 7.88 X 40270
Ag-La-Se Ag0.131 La2.623 Se4 Th3P 4,cI28,220 I-43d 0.9047,0.9047,0.9047,90,90,90 - - 6.23 A 7249
Ag-La-Si AgLaSi2 LaMnSi2,oS16,63 Cmcm 0.4316,1.7533,0.42742,90,90,90 - - 6.22 A 54905
Ag-La-Si Ag0.67 LaSi1.33 AlB2,hP3,191 P6/mmm 0.4306,0.4306,0.4276,90,90,120 AlB2 family - 6.01 X 18134
Ag-La-Si Ag0.72 LaSi1.28 ThSi2,tI12,141 I41/amd 0.427,0.427,1.4784,90,90,90 - - 6.22 A 39414
Ag-La-Si Ag2LaSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4295,0.4295,1.064,90,90,90 - - 6.95 X 7464
Ag-La-Sn AgLaSn LiGaGe,hP6,186 P63 mc 0.47995,0.47995,0.78822,90,90,120 AlB2 family - 7.72 X 38843
Ag-La-Sn AgLa5Sn3 Ti5Ga4,hP18,193 P63 /mcm 0.96827,0.96827,0.68747,90,90,120 AlB2 family - 6.89 A 54524
Ag-La-Sn Ag0.03 La0.14 Sn0.83 Sn,tI4,141 I41/amd 0.583,0.583,0.31806,90,90,90 - - 7.45 X 54524
Ag-La-Sn Ag0.08 LaSn2.92 Cu3Au,cP4,221 Pm-3m 0.47525,0.47525,0.47525,90,90,90 close-packed structure - 7.64 X 54524
Ag-La-Sn Ag0.72 La5Sn2.28 W5Si3,tI32,140 I4/mcm 1.2761,1.2761,0.6347,90,90,90 - - 6.70 A 54524
Ag-La-Sn Ag0.9 LaSn0.1 CsCl,cP2,221 Pm-3m 0.3746,0.3746,0.3746,90,90,90 b.c.c. family - 7.83 X 54524
Ag-La-Sn Ag0.97 La0.01 Sn0.02 Cu,cF4,225 Fm-3m 0.4089,0.4089,0.4089,90,90,90 close-packed structure - 10.53 X 54524
Ag-La-Sn Ag1.91 LaSn0.09 KHg2,oI12,74 Imma 0.48285,0.72919,0.8222,90,90,90 AlB2 family - 8.16 A 54524
Ag-La-Sn Ag4La3Sn4 Cu4Gd3Ge4,oI22,71 Immm 0.47184,0.73892,1.56462,90,90,90 - - 8.05 A 54524
Ag-La-Sn Ag51La10.1 Sn3.9 Ag51Gd14,hP68,175 P6/m 1.29153,1.29153,0.95575,90,90,120 - - 8.86 A 54524
Ag-La-Y AgLa0.5 Y0.5 CsCl,cP2,221 Pm-3m 0.3706,0.3706,0.3706,90,90,90 b.c.c. family - 7.24 X 37436
Ag-La-Y Ag2La0.08 Y0.92 MoSi2,tI6,139 I4/mmm 0.3721,0.3721,0.9296,90,90,90 b.c.c. family - 7.96 A 37436
Ag-La-Zn AgZnLa KHg2,oI12,74 Imma 0.4731,0.7407,0.8003,90,90,90 AlB2 family - 7.39 A 37142
Ag-Li-Mg Li2MgAg Cu2MnAl,cF16,225 Fm-3m 0.6607,0.6607,0.6607,90,90,90 b.c.c. family - 3.36 X 4310
Ag-Li-O LiAgO KAgO,tI24,139 I4/mmm 0.9248,0.9248,0.375,90,90,90 - green olive 5.42 A 15626
Ag-Li-O LiAg3O2 LiAg3O2,oI24,72 Ibam 0.5974,0.9945,0.5694,90,90,90 - red ruby 7.12 X 9489
Ag-Li-Pb LiAg0.5 Pb0.5 cub2 NaTl,cF16,227 Fd-3m 0.6678,0.6678,0.6678,90,90,90 b.c.c. family - 7.34 X 4313
Ag-Li-Pb Li2AgPb cub1 Li2AgSb,cF16,216 F-43m 0.6678,0.6678,0.6678,90,90,90 b.c.c. family violet 7.34 X 4311
Ag-Li-Sb Li2AgSb Li2AgSb,cF16,216 F-43m 0.65915,0.65915,0.65915,90,90,90 b.c.c. family gray 5.65 X 51457
Ag-Li-Sb Li3Ag0.6 Sb0.4 BiF3,cF16,225 Fm-3m 0.7238,0.7238,0.7238,90,90,90 b.c.c. family - 2.35 X 51457
Ag-Li-Si LiAg2Si Cu3Au,cP4,221 Pm-3m 0.4045,0.4045,0.4045,90,90,90 close-packed structure - 6.29 X 33655
Ag-Li-Si Li1.6 Ag0.8 Si1.6 Li2AgSb,cF16,216 F-43m 0.605,0.605,0.605,90,90,90 b.c.c. family - 4.27 X 33655
Ag-Li-Si Li2.17 Ag0.83 Si Li2(Li0.17 Ag0.83 )Si,hR48,166 R-3m 0.43906,0.43906,4.2293,90,90,120 - - 3.74 X 51414
Ag-Li-Si Li3Ag2Si3 Li3Ag2Si3,tP16,134 P42 /nnm 0.6055,0.6055,0.6164,90,90,90 - - 4.71 X 33655
Ag-Li-Sn LiAg2Sn Li2AgSb,cF16,216 F-43m 0.65999,0.65999,0.65999,90,90,90 b.c.c. family blue steel 7.89 X 45557
Ag-Li-Sn Li1.5 Ag1.5 Sn LiMgPdSn,cF16,216 F-43m 0.66016,0.66016,0.66016,90,90,90 b.c.c. family violet 6.72 X 45557
Ag-Li-Sn Li1.7 Ag1.3 Sn Cu2MnAl,cF16,225 Fm-3m 0.6581,0.6581,0.6581,90,90,90 b.c.c. family blue 6.31 X 45557
Ag-Li-Sn Li17Ag3Sn6 Li17Ag3Sn6,hP26,157 P31m 0.8063,0.8063,0.851,90,90,120 - gray dark 4.00 X 43058
Ag-Li-Tl Li2AgTl Li2AgSb,cF16,216 F-43m 0.6671,0.6671,0.6671,90,90,90 b.c.c. family pink violet 7.30 X 4311
Ag-Lu-O AgLuO2 CuFeO2,hR12,166 R-3m 0.34086,0.34086,1.8588,90,90,120 - - 8.39 X 52891
Ag-Lu-Pb AgLuPb ZrNiAl,hP9,189 P-62m 0.73723,0.73723,0.44118,90,90,120 Fe2P family - 11.76 X 38763
Ag-Lu-S Ag0.5 Lu0.5 S ht NaCl,cF8,225 Fm-3m 0.5479,0.5479,0.5479,90,90,90 rocksalt family - 7.01 X 3020
Ag-Lu-Se AgLuSe2 AgErSe2,oP16,19 P212121 0.417,0.674,1.357,90,90,90 - - 7.68 A 7249
Ag-Lu-Si AgLuSi ZrNiAl,hP9,189 P-62m 0.6923,0.6923,0.411,90,90,120 Fe2P family - 9.08 A 18134
Ag-Lu-Sn AgLuSn ht NdPtSb,hP6,186 P63 mc 0.4635,0.4635,0.7232,90,90,120 AlB2 family - 9.91 X 51636
Ag-Lu-Te AgLuTe 2 ht CuScS2,hP4,156 P3m1 0.4279,0.4279,0.699,90,90,120 - - 8.06 A 7304
Ag-Lu-Te AgLu6 Te2 Sc6PdTe2,oP36,62 Pnma 2.1147,0.4002,1.1275,90,90,90 - - 9.84 X 49061
Ag-Mg-Nd MgAgNd ZrNiAl,hP9,189 P-62m 0.7757,0.7757,0.4261,90,90,120 Fe2P family - 6.20 X 39201
Ag-Mg-Nd MgAg2Nd rt Cu2MnAl,cF16,225 Fm-3m 0.7098,0.7098,0.7098,90,90,90 b.c.c. family - 7.14 X 21342
Ag-Mg-Nd Mg2AgNd rt Cu2MnAl,cF16,225 Fm-3m 0.7226,0.7226,0.7226,90,90,90 b.c.c. family - 5.30 X 21342
Ag-Mg-Pd MgAg0.5 Pd0.5 CsCl,cP2,221 Pm-3m 0.3238,0.3238,0.3238,90,90,90 b.c.c. family - 6.43 X 17115
Ag-Mg-Pr MgAgPr ZrNiAl,hP9,189 P-62m 0.7797,0.7797,0.4293,90,90,120 Fe2P family - 6.02 A 28736
Ag-Mg-Pr MgAg2Pr rt Cu2MnAl,cF16,225 Fm-3m 0.7098,0.7098,0.7098,90,90,90 b.c.c. family - 7.08 X 21342
Ag-Mg-Pr Mg2AgPr rt Cu2MnAl,cF16,225 Fm-3m 0.726,0.726,0.726,90,90,90 b.c.c. family - 5.16 X 21342
Ag-Mg-Pt Mg0.5 Ag0.5 Pt NiAs,hP4,194 P63 /mmc 0.4085,0.4085,0.5412,90,90,120 AlB2 family - 11.09 X 6345
Ag-Mg-Sb MgAgSb ht1 MnAlGe,tP6,129 P4/nmm 0.44199,0.44199,0.68896,90,90,90 - - 6.27 X 59230
Ag-Mg-Sb MgAgSb ht2 MgAgAs,cF12,216 F-43m 0.67004,0.67004,0.67004,90,90,90 - - 5.61 X 59230
Ag-Mg-Sb MgAgSb rt MgAgSb,tI48,120 I-4c2 0.91761,0.91761,1.2696,90,90,90 - - 6.31 X 59230
Ag-Mg-Sm MgAgSm ZrNiAl,hP9,189 P-62m 0.773,0.773,0.4224,90,90,120 Fe2P family - 6.44 A 28736
Ag-Mg-Sm MgAg2Sm rt Cu2MnAl,cF16,225 Fm-3m 0.7045,0.7045,0.7045,90,90,90 b.c.c. family - 7.42 X 21342
Ag-Mg-Sm Mg2AgSm rt Cu2MnAl,cF16,225 Fm-3m 0.7194,0.7194,0.7194,90,90,90 b.c.c. family - 5.48 X 21342
Ag-Mg-Sr SrMg2Ag MgCuAl2,oS16,63 Cmcm 0.45215,1.1336,0.8488,90,90,90 - - 3.73 A 59742
Ag-Mg-Tb MgAgTb ZrNiAl,hP9,189 P-62m 0.7639,0.7639,0.4165,90,90,120 Fe2P family - 6.89 A 39201
Ag-Mg-Tb Mg2.5 Ag0.5 Tb BiF3,cF16,225 Fm-3m 0.7162,0.7162,0.7162,90,90,90 b.c.c. family - 4.95 X 21342
Ag-Mg-Tm MgAgTm ZrNiAl,hP9,189 P-62m 0.7599,0.7599,0.4082,90,90,120 Fe2P family - 7.35 A 39201
Ag-Mg-Y MgAgY ZrNiAl,hP9,189 P-62m 0.7661,0.7661,0.4138,90,90,120 Fe2P family - 5.24 X 28736
Ag-Mg-Yb MgAgYb TiNiSi,oP12,62 Pnma 0.7534,0.4463,0.8867,90,90,90 AlB2 family - 6.80 X 40421
Ag-Mg-Yb MgAgYb4 Gd4RhIn,cF96,216 F-43m 1.47081,1.47081,1.47081,90,90,90 - - 6.88 A 59572
Ag-Mg-Zn MgAg0.06 Zn1.94 8H Mg(Ag0.03 Zn0.97 )2,hP48,194 P63 /mmc 0.521,0.521,3.44,90,90,120 Friauf-Laves phase - 5.18 X 12968
Ag-Mg-Zn MgAg0.14 Zn1.86 9R Mg(Cu0.5 Al0.5)2,hR54,166 R-3m 0.521,0.521,3.87,90,90,120 Friauf-Laves phase - 5.29 X 12968
Ag-Mg-Zn MgAg0.2 Zn1.8 21R Mg(Ag0.10 Zn0.90 )2,hR126,166 R-3m 0.521,0.521,9.03,90,90,120 Friauf-Laves phase - 5.37 X 10405
Ag-Mg-Zn MgAg0.20 Zn1.80 10H Mg(Ag0.10 Zn0.90 )2,hP60,194 P63 /mmc 0.522,0.522,4.3,90,90,120 Friauf-Laves phase - 5.35 X 12968
Ag-Mg-Zn MgAg2Zn rt Cu2MnAl,cF16,225 Fm-3m 0.6436,0.6436,0.6436,90,90,90 b.c.c. family - 7.61 X 9193
Ag-Mg-Zn Mg0.045 Ag4.5 Zn4.455 rt (Ag0.56 Zn0.44 )8Zn,hP9,147 P-3 0.76413,0.76413,0.28213,90,90,120 b.c.c. family - 9.05 A 10508
Ag-Mg-Zn Mg0.1 AgZn0.9 CsCl,cP2,221 Pm-3m 0.31681,0.31681,0.31681,90,90,90 b.c.c. family - 8.83 X 10508
Ag-Mg-Zn Mg0.5 AgZn0.5 rt CsCl,cP2,221 Pm-3m 0.3218,0.3218,0.3218,90,90,90 b.c.c. family - 7.61 X 9193
Ag-Mn-N AgMn3N CaTiO3,cP5,221 Pm-3m 0.4019,0.4019,0.4019,90,90,90 perovskite family - 7.33 X 2165
Ag-Mn-O Ag[MnO4 ] Ag[MnO4]-b,mP24,14 P121/c1 0.5623,0.8349,0.88983,90,126.71,90 - - 4.50 X 17690
Ag-Mn-O Ag0.9 Mn4O8 Ag0.9 Mn4O8,tI26,87 I4/m 0.9725,0.9725,0.2885,90,90,90 - - 5.41 X 19560
Ag-Mn-O Ag2MnO2 ht Ag2MnO2,hR15,166 R-3m 0.29699,0.29699,2.614,90,90,120 - - 7.55 X 55233
Handbook of Inorganic Substances – Edition 2015 : Data 191

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Mn-O Ag2MnO2 rt Ag2MnO2,mS10,12 C12/m1 0.52472,0.28823,0.8899,90,102.4,90 - - 7.65 X 55233


Ag-Mn-O Ag2[MnO4] Ag2[MnO4],oP28,62 Pnma 0.9998,0.6989,0.5474,90,90,90 - black 5.81 X 16708
Ag-Mn-O Ag4Mn3O8 ht1 Ag4Mn3O8,hR180,155 R32 1.26814,1.26814,1.53409,90,90,120 - - 6.76 X 45753
Ag-Mn-O Ag4Mn3O8 ht2 Ag4Mn3O8,cP92,213 P4132 0.896,0.896,0.896,90,90,90 - - 6.69 X 45753
Ag-Mn-O Ag4Mn3O8 rt Ag4Mn3O8,hP180,152 P3121 1.25919,1.25919,1.54978,90,90,120 - black 6.78 X 40860
Ag-Mn-Sn Ag0.74 Mn0.1 Sn0.16 Mg,hP2,194 P63/mmc 0.2946,0.2946,0.4782,90,90,120 close-packed structure - 9.64 X 1733
Ag-Mn-Zn Ag0.11 Zn0.74 Mn0.15 Mg,hP2,194 P63/mmc 0.2789,0.2789,0.4434,90,90,120 close-packed structure - 7.62 X 240
Ag-Mo-O Ag0.2 MoO3.1 *,hP18,176 P63/m 1.0596,1.0596,0.3728,90,90,120 - - - N 30629
Ag-Mo-O Ag2Mo 2O7 mon Ag2Mo 2O7,mP44,14 P121/c1 0.61274,1.31836,0.7878,90,110.673,90 - brown dark 5.80 X 45036
Ag-Mo-O Ag2Mo 2O7 tricl Ag2Mo 2O7,aP22,2 P-1 0.6095,0.7501,0.7681,110.4,93.3,113.5 - yellow pale 5.87 X 9888
Ag-Mo-O Ag2[MoO4] ht1 MgAl2O4,cF56,227 Fd-3m 0.9264,0.9264,0.9264,90,90,90 spinel family yellow 6.28 X 58997
Ag-Mo-O Ag2[MoO4] rt *,t**,* - 1.0805,1.0805,0.7691,90,90,90 - - - N 58997
Ag-Mo-O Ag6Mo 10O33 Ag6Mo 10O33,aP49,2 P-1 0.759,0.831,1.142,82.6,77.1,73.6 - yellow 5.28 X 5414
Ag-Mo-S AgMo 6S8 lt BaMo 6S8,aP15,2 P-1 0.64592,0.64469,0.6459,91.77,91.57,91.72 Chevrel phase - 5.81 X 24068
Ag-Mo-S AgMo 6S8 rt Mo6PbS8,hR45,148 R-3 0.93082,0.93082,1.08728,90,90,120 Chevrel phase - 5.74 X 24068
Ag-Mo-S Ag0.8 Mo2S4 Ag0.8 Mo2S4,mP14,4 P1211 0.325,1.3867,0.5706,90,90.23,90 - - 5.25 X 40418
Ag-Mo-S Ag0.8 Mo3.2 S4 Mo3 Ni1.25 S4,hR78,148 R-3 0.931,0.931,1.083,90,90,120 Chevrel phase - 6.39 A 6906
Ag-Mo-Se AgMo 3Se3 TlFe 3Te3,hP14,176 P63/m 0.856,0.856,0.45,90,90,120 Chevrel phase - 7.36 A 18228
Ag-Mo-Se Ag0.6 Mo3Se4 Mo3 Ni1.25 S4,hR78,148 R-3 0.965,0.965,1.13,90,90,120 Chevrel phase black 7.31 A 6589
Ag-Mo-Se Ag3.6 Mo9Se11 Ag3.6 Mo9Se11,oS120,63 Cmcm 1.191,1.3614,1.1679,90,90,90 Chevrel phase - 7.44 X 17197
Ag-Mo-Te AgMo 6Te6 AgMo 6Te6,mS26,12 C12/m1 1.745,0.4585,0.9129,90,118.75,90 Chevrel phase - 7.52 X 20367
Ag-N-O Ag[NO2] Na[NO2],oI8,44 Imm2 0.3528,0.6172,0.5181,90,90,90 - yellow 4.53 X 13995
Ag-N-O Ag[NO3] ht K[NO3],hR15,160 R3m 0.5196,0.5196,0.849,90,90,120 - - 4.26 X 14941
Ag-N-O Ag[NO3] m Ag[NO3],hR30,161 R3c 0.516,0.516,1.658,90,90,120 - - 4.43 X 9521
Ag-N-O Ag[NO3] rt orth1 Ag[NO3],oP40,19 P212121 0.6992,0.7335,1.0125,90,90,90 - - 4.35 X 11195
Ag-N-O Ag[NO3] rt orth2 Ag[NO3],oP40,61 Pbca 0.6995,0.7328,1.0118,90,90,90 - - 4.35 X 6048
Ag-N-O Ag[N3O4] Ag[N3O4],oP64,61 Pbca 0.5804,0.97496,1.39105,90,90,90 - colorless 3.61 X 50268
Ag-N-O Ag3[NO3]2[N3] Ag3[NO3]2[N3],oS56,36 Cmc21 1.3351,0.5871,0.9397,90,90,90 - colorless 4.42 X 34018
Ag-N-O Ag7[NO3]O8 cub1 Ag7[NO3]O8,cF160,225 Fm-3m 0.989,0.989,0.989,90,90,90 - black 6.49 X 2479
Ag-N-O Ag7[NO3]O8 cub2 Ag7[NO3]O8,cF184,225 Fm-3m 0.98893,0.98893,0.98893,90,90,90 - - 6.49 X 6780
Ag-Na-O NaAgO KAgO,tI24,139 I4/mmm 0.952,0.952,0.4617,90,90,90 - yellowish 4.66 X 24178
Ag-Na-O NaAg3O2 LiAg3O2,oI24,72 Ibam 0.6159,1.0439,0.5972,90,90,90 - red 6.55 X 10298
Ag-Na-O Na3AgO2 Na3AgO2,oI24,72 Ibam 0.5463,1.0926,0.5926,90,90,90 - colorless 3.92 X 15629
Ag-Na-S NaAg3S2 NaAg3S2,cF96,227 Fd-3m 1.2358,1.2358,1.2358,90,90,90 - red dark 5.78 X 28199
Ag-Na-S Na3AgS2 rt Na3AgO2,oI24,72 Ibam 0.638,1.2581,0.6896,90,90,90 - yellow pale 2.89 X 18059
Ag-Na-Sb Na2AgSb Na2CuAs,oS16,63 Cmcm 0.9292,0.7903,0.5773,90,90,90 - gray silver 4.32 X 12885
Ag-Nb-O AgNbO3 ht1 *,m*80,* - 0.7888,0.7888,1.566,90,90.57,90 perovskite family - - N 931
Ag-Nb-O AgNbO3 ht2 NaNbO3,oS40,63 Cmcm 0.7883,0.789,0.7906,90,90,90 - - 6.72 X 43232
Ag-Nb-O AgNbO3 ht3 AgNbO3,tP14,127 P4/mbm 0.55815,0.55815,0.39595,90,90,90 - - 6.70 X 43232
Ag-Nb-O AgNbO3 ht4 CaTiO3,cP5,221 Pm-3m 0.39598,0.39598,0.39598,90,90,90 perovskite family - 6.65 X 43232
Ag-Nb-O AgNbO3 rt AgNbO3,oP40,26 Pmc21 1.56477,0.5552,0.56091,90,90,90 perovskite family yellow 6.78 X 55945
Ag-Nb-O AgNb13O33 NaNb13O33,mS94,12 C12/m1 2.2378,0.3833,1.5394,90,91.74,90 - - 4.64 A 50934
Ag-Nb-O AgNb3O8 ht NaNb3O8,oI48,72 Ibam 0.7343,1.0415,0.7007,90,90,90 - - 6.38 X 23092
Ag-Nb-O AgNb3O8 rt AgNb3O8,oP58,55 Pbam 1.2416,1.2453,0.397,90,90,90 - - 5.57 X 50934
Ag-Nb-O AgNb7O18 NaNb7O18,oI102,71 Immm 0.384,1.4315,2.6171,90,90,90 - - 4.83 A 50934
Ag-Nb-O Ag2Nb4O11 ht Na2Ta4O11,hR102,167 R-3c 0.62301,0.62301,3.70163,90,90,120 - - 6.11 X 56706
Ag-Nb-O Ag2Nb4O11 lt Ag2Nb4O11,hR102,161 R3c 0.6208,0.6208,3.70135,90,90,120 - - 6.16 X 56706
Ag-Nb-O Ag2Nb4O11 rt Na2Nb4O11,mS68,9 C1c1 1.07642,0.6201,1.28581,90,106.183,90 - - 6.15 X 54755
Ag-Nb-O Ag2.25 Nb5O15 K2.4 W5O15,tP46,127 P4/mbm 1.235,1.235,0.3946,90,90,90 tetragonal bronze - 5.23 A 17015
Ag-Nb-S AgNb3S4 Tl0.39 V3S4,hP16,176 P63/m 0.9574,0.9574,0.3378,90,90,120 - - 6.38 A 20550
Ag-Nb-S Ag0.25 NbS2 6R Ag0.25 NbS2,hR24,166 R-3m 0.33423,0.33423,3.935,90,90,120 - - 4.82 X 18572
Ag-Nb-S Ag0.44 Nb2S4 4H Ag0.43 Nb2S4,hP14,186 P63mc 0.3334,0.3334,2.609,90,90,120 - - 4.78 X 21716
Ag-Nb-S Ag0.6 NbS2 2H Cu0.65 NbS2,hP10,194 P63/mmc 0.3354,0.3354,1.4431,90,90,120 - black 5.24 X 23222
Ag-Nb-S Ag0.6 NbS2 lt Ag0.6 NbS2,hP10,186 P63mc 0.3355,0.3355,1.431,90,90,120 - - 5.28 X 25280
Ag-Nb-S Ag7NbS6 lt Ag7NbS6,mP28,7 P1c1 0.7368,0.7385,1.2768,90,124.28,90 - - 6.02 X 33007
Ag-Nb-S Ag7NbS6 rt Ag7 TaS6,cF220,216 F-43m 1.05001,1.05001,1.05001,90,90,90 - black 5.97 X 26034
Ag-Nb-Se Ag0.5 Nb3Se4 lt Tl0.39 V3S4,hP16,176 P63/m 0.9998,0.9998,0.34644,90,90,120 - - 7.18 A 20541
Ag-Nb-Te AgNb3Te4 Tl0.39 V3S4,hP16,176 P63/m 1.0652,1.0652,0.3639,90,90,120 - - 8.33 A 20550
Ag-Nd-Pb AgNdPb CaIn2,hP6,194 P63/mmc 0.48161,0.48161,0.7611,90,90,120 AlB2 family - 9.98 X 16177
Ag-Nd-S Ag0.5 Nd2.5 S4 Th3P 4,cI28,220 I-43d 0.852,0.852,0.852,90,90,90 - - 5.83 A 3019
Ag-Nd-Sb AgNdSb2 CuHfSi2,tP8,129 P4/nmm 0.43339,0.43339,1.0631,90,90,90 - - 8.24 A 40226
Ag-Nd-Se Ag0.5 Nd2.5 Se4 Th3P 4,cI28,220 I-43d 0.8858,0.8858,0.8858,90,90,90 - - 6.98 A 7249
Ag-Nd-Si AgNdSi AlB2 ,hP3,191 P6/mmm 0.4244,0.4244,0.4138,90,90,120 AlB2 family - 7.21 X 7591
Ag-Nd-Si AgNdSi2 LaMnSi2,oS16,63 Cmcm 0.41991,1.7498,0.42015,90,90,90 - - 6.63 A 54905
Ag-Nd-Si Ag0.5 Nd5Si3.5 Sm5 Ge4,oP36,62 Pnma 0.7645,1.504,0.7881,90,90,90 - - 6.40 X 30211
Ag-Nd-Si Ag0.75 NdSi1.25 ThSi2,tI12,141 I41/amd 0.4223,0.4223,1.4508,90,90,90 - - 6.68 A 31707
Ag-Nd-Si Ag2NdSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4171,0.4171,1.0636,90,90,90 - - 7.47 A 31707
Ag-Nd-Sn AgNdSn CaIn2,hP6,194 P63/mmc 0.4754,0.4754,0.7593,90,90,120 AlB2 family - 8.29 X 43214
Ag-Nd-Sn Ag4Nd3Sn4 Cu4Gd3Ge4,oI22,71 Immm 0.46321,0.73378,1.54051,90,90,90 - - 8.49 X 32238
Ag-Nd-Zn AgZnNd KHg2,oI12,74 Imma 0.468,0.7155,0.7919,90,90,90 AlB2 family - 7.95 A 37142
Ag-Ni-O AgNiO2 hex2 AgNiO2,hP24,182 P6322 0.50908,0.50908,1.22498,90,90,120 - - 7.20 X 51237
Ag-Ni-O AgNiO2 rhom AgNiO2,mS24,12 C12/m1 0.50697,0.87953,0.63524,90,105.732,90 - - 7.26 X 51300
Ag-Ni-O AgNiO2 rt hex AgFeO2,hP8,194 P63/mmc 0.29365,0.29365,1.22369,90,90,120 - - 7.22 X 45713
Ag-Ni-O AgNiO2 rt rhom CuFeO2,hR12,166 R-3m 0.29381,0.29381,1.83724,90,90,120 - black gray 7.20 X 50776
Ag-Ni-O Ag2NiO2 lt mon Ag2NiO2,mS10,12 C12/m1 0.50488,0.29149,0.8205,90,101.836,90 - - 8.61 X 47527
Ag-Ni-O Ag2NiO2 lt rhom Ta2CS2,hR15,166 R-3m 0.29193,0.29193,2.4031,90,90,120 - black 8.61 X 39719
Ag-Ni-O Ag3Ni2O4 Ag3Ni2O4,hP18,194 P63/mmc 0.29331,0.29331,2.8313,90,90,120 - - 7.95 X 49107
Ag-Ni-Se AgNiSe 2 CuFeO2,hR12,166 R-3m 0.372,0.372,2.133,90,90,120 - gray 6.32 A 12359
192 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Ni-Te AgNiTe2 CuCrS2-b,hR12,160 R3m 0.398,0.398,2.474,90,90,120 - gray 6.19 A 14134


Ag-O-Os Ag0.5 OsO3 Tl0.5 Nb(O0.83 F0.17)3,cF96,227 Fd-3m 1.022,1.022,1.022,90,90,90 pyrochlore family - 7.27 X 58637
Ag-O-Os Ag13OsO6 Ag13OsO6 ,cF160,226 Fm-3c 1.31712,1.31712,1.31712,90,90,90 - green olive 9.82 X 41130
Ag-O-P AgPO3 AgPO3,mP40,14 P121/c1 0.73278,0.60667,1.36182,90,118.995,90 - colorless 4.69 X 55683
Ag-O-P Ag3[PO4] ht Ag3[PO4],cF300,225 Fm-3m 0.7722,0.7722,0.7722,90,90,90 - - 6.04 X 13753
Ag-O-P Ag3[PO4] rt Ag3[PO4],cP16,218 P-43n 0.6026,0.6026,0.6026,90,90,90 - colorless 6.35 X 10285
Ag-O-P Ag4[P 2O7] hp *,oS208,20 C222 1 1.088,1.839,1.396,90,90,90 - white 5.76 N 19403
Ag-O-P Ag4[P 2O7] rt *,hP234,* - 0.9538,0.9538,4.083,90,90,120 - - 5.63 N 16192
Ag-O-Pb Ag2PbO2 Ag2PbO2,mS20,15 C12/c1 0.86575,0.8704,0.60775,90,130.934,90 - brown 8.73 X 23022
Ag-O-Pb Ag5Pb2O6 Ag5Pb2O6 ,hP13,162 P-31m 0.59405,0.59405,0.6435,90,90,120 - - 8.86 X 49084
Ag-O-Pd Ag2PdO2 Li2CuO2,oI10,71 Immm 0.3008,0.45552,0.98977,90,90,90 - - 8.67 X 39365
Ag-O-Rb RbAgO KAgO,tI24,139 I4/mmm 1.0025,1.0025,0.567,90,90,90 - yellowish 4.88 X 24178
Ag-O-Rb Rb3AgO2 Rb3AgO2,oP96,19 P212121 1.28,1.2848,1.4329,90,90,90 - colorless 4.47 X 40920
Ag-O-Re Ag[ReO4] Ca[WO4],tI24,88 I41/a 0.53724,0.53724,1.17932,90,90,90 - colorless 6.99 X 35498
Ag-O-Rh AgRhO2 CuFeO2,hR12,166 R-3m 0.30688,0.30688,1.85907,90,90,120 - black 7.98 X 56826
Ag-O-Ru Ag3RuO4 Ag3RuO4,tP32,91 P4122 0.70082,0.70082,0.86518,90,90,90 - black 7.64 X 44183
Ag-O-S Ag[SO4] Ag[SO4],aP12,2 P-1 0.46923,0.47535,0.80125,76.597,76.478,61.922 - black 4.46 X 53620
Ag-O-S Ag2[SO3] Ag2[SO3],mP24,14 P121/c1 0.46507,0.7891,1.02585,90,110.527,90 - - 5.57 X 4460
Ag-O-S Ag2[SO4] ht K2[SO4],oP28,62 Pnma 0.734,0.553,0.958,90,90,90 - - 5.33 A 10434
Ag-O-S Ag2[SO4] rt Na2[SO4],oF56,70 Fddd 0.5799,1.0233,1.2689,90,90,90 - - 5.50 X 11793
Ag-O-S Ag6S2[SO4] *,mP104,* - 1.3432,0.6982,1.7782,90,105.6,90 - brown 6.68 N 30236
Ag-O-Sb AgSbO3 cub2 AgSbO3,cI80,204 Im-3 0.9404,0.9404,0.9404,90,90,90 - - 6.65 X 8394
Ag-O-Sb AgSbO3 rt TiFeO3,hR30,148 R-3 0.53286,0.53286,1.67008,90,90,120 - yellow 6.74 X 47498
Ag-O-Sb Ag0.88 Sb1.04 O3 cub1 AgSbO3,cF80,227 Fd-3m 1.0282,1.0282,1.0282,90,90,90 - - 6.59 X 35632
Ag-O-Sb Ag1.69 Sb2.27 O6.25 Ca2Nb2O7 ,cF88,227 Fd-3m 1.02892,1.02892,1.02892,90,90,90 pyrochlore family - 6.81 X 35632
Ag-O-Sb Ag3SbO4 Ag3RuO4,tP32,91 P4122 0.70436,0.70436,0.88665,90,90,90 - black 7.69 X 55449
Ag-O-Sc AgScO2 rt CuFeO2,hR12,166 R-3m 0.32109,0.32109,1.85398,90,90,120 - white 5.56 X 57507
Ag-O-Se Ag2[SeO3 ] Na2[TeO3],mP24,14 P121/c1 0.4854,1.0332,0.6956,90,91.13,90 - colorless 6.53 X 28390
Ag-O-Se Ag2[SeO4 ] Na2[SO4],oF56,70 Fddd 0.60531,1.03898,1.30001,90,90,90 - yellow 5.83 X 42493
Ag-O-Si Ag10Si4O13 Ag10Si4O13 ,aP54,2 P-1 0.8038,0.9131,1.1356,112.83,98.62,100.32 - red 6.34 X 12248
Ag-O-Si Ag18Si4[SiO4]2O13 rt Ag18Si4[SiO4]2O13,mS90,12 C12/m1 1.2735,0.9704,1.0713,90,106.83,90 - - 6.41 X 25525
Ag-O-Si Ag2SiO3 Ag2SiO3,oP24,19 P212121 0.4527,0.7108,0.9959,90,90,90 - yellow 6.05 X 25547
Ag-O-Si Ag2Si2O5 Na2Si2O5,oP36,60 Pbcn 0.653,0.497,1.568,90,90,90 - - 4.59 A 1380
Ag-O-Si Ag4[SiO4] lt *,aP*,* - 0.582,0.674,0.87854,71.676,81.862,84.9 - red - N 1772
Ag-O-Si Ag4[SiO4] rt Ag4[SiO4],tP18,86 P42 /n 0.73169,0.73169,0.49595,90,90,90 - - 6.55 X 51475
Ag-O-Si Ag5[SiO4] Ag5[SiO4],oP40,58 Pnnm 0.9108,0.9856,0.6271,90,90,90 - - 7.45 X 28672
Ag-O-Si Ag6[Si2O7 ] rt Ag6[Si2O7 ],mP60,4 P1211 0.53043,0.97533,1.59283,90,91.165,90 - red 6.57 X 32463
Ag-O-Sn Ag2SnO3 Ag2SnO3,hP28,182 P6322 0.5623,0.5623,1.26694,90,90,120 - red 7.32 X 33755
Ag-O-Sr SrAg6O4 SrAg6O4,oP44,52 Pnna 0.6518,1.2416,0.8909,90,90,90 - red ruby 7.36 X 7065
Ag-O-Ta AgTaO3 LiNbO3,hR30,161 R3c 0.55281,0.55281,1.37159,90,90,120 - white 9.24 X 19768
Ag-O-Ta Ag2 Ta4O11 Na2Ta4O11 ,hR102,167 R-3c 0.62075,0.62075,3.68605,90,90,120 - - 9.04 X 56706
Ag-O-Tc AgTcO4 Ca[WO4],tI24,88 I41/a 0.53026,0.53026,1.181,90,90,90 - yellow pale 5.40 X 41164
Ag-O-Te AgTeO3 mon1 AgTeO3-a,mP40,14 P121/c1 0.59099,1.16831,0.90687,90,119.437,90 - - 6.91 X 45711
Ag-O-Te AgTeO3 mon2 AgTeO3,mP20,11 P121/m1 0.54562,0.74009,0.69122,90,101.237,90 - - 6.88 X 45711
Ag-O-Te AgTeO3 mon3 AgTeO3-b,mP40,14 P121/c1 0.64255,0.69852,1.3204,90,90.09,90 - colorless 6.35 X 49558
Ag-O-Te Ag2 TeO4 rt Ag2 TeO4,mS84,15 C12/c1 0.90588,0.92456,1.3623,90,91.758,90 - - 7.12 X 45749
Ag-O-Te Ag2 Te2O7 Ca2Sb2O7,oI44,74 Imma 0.7266,1.0143,0.76021,90,90,90 - - 6.91 X 47589
Ag-O-Te Ag2 Te4O11 Ag2 Te4O11 ,aP34,2 P-1 0.7287,0.7388,0.9686,95.67,94.1,119.4 - - 6.69 X 45711
Ag-O-Te Ag2[TeO3 ] ht *,oP*,* - 0.53,0.76,0.777,90,90,90 - yellow - N 22578
Ag-O-Te Ag2[TeO3 ] rt Na2[TeO3],mP24,14 P121/c1 0.4917,1.0547,0.7004,90,91.44,90 - yellow 7.16 X 13574
Ag-O-Te Ag4 TeO5 Ag4 TeO5,mS80,15 C12/c1 1.6271,0.60874,1.14373,90,106.73,90 - brown dark 7.83 X 49558
Ag-O-Ti Ag2 TiO3 Ag2 TiO3,mS48,15 C12/c1 1.6813,0.76116,0.50545,90,101.95,90 - yellow 6.54 X 33522
Ag-O-Ti Ag2 Ti4O9 Tl2 Ti4O9,mS60,12 C12/m1 1.734,0.3794,1.204,90,107.4,90 - - 4.85 A 11659
Ag-O-Tl AgTlO2 rt CuFeO2,hR12,166 R-3m 0.3568,0.3568,1.8818,90,90,120 - black 8.27 A 5946
Ag-O-Tm AgTmO2 CuFeO2,hR12,166 R-3m 0.3467,0.3467,1.8588,90,90,120 - - 7.95 A 52891
Ag-O-V AgVO3 m CoGeO3,mS40,15 C12/c1 1.0437,0.9897,0.5532,90,99.69,90 - yellow pale 4.88 X 36132
Ag-O-V AgVO3 rt AgVO3,mS40,8 C1m1 1.8106,0.35787,0.8043,90,104.44,90 - red 5.44 X 32015
Ag-O-V AgV6O15 NaV6O15,mS46,12 C12/m1 1.5385,0.3615,1.0069,90,109.72,90 - black 4.12 X 28169
Ag-O-V Ag0.68 V2O5 lt Na0.56 V2O5,mS32,12 C12/m1 1.1742,0.3667,0.8738,90,89.52,90 - black blue 4.51 X 2510
Ag-O-V Ag0.68 V2O5 Ag0.84 V2O5,mS36,12 C12/m1 1.169,0.3661,0.878,90,90.36,90 - - 4.51 X 38928
Ag-O-V Ag1.2 V3O8 Ag1.2 V3O8 ,mP28,11 P121/m1 0.7382,0.36029,1.2193,90,107.39,90 - blue dark 4.40 X 33532
Ag-O-V Ag1.43 V4O10 Ag1.43 V4O10,mS32,8 C1m1 1.193,0.369,0.881,90,90.4,90 - black 4.44 X 7356
Ag-O-V Ag2 V4O11 mon1 Ag2 V4O11 ,mS34,12 C12/m1 1.548,0.3582,0.9537,90,128.741,90 - - 4.79 X 38950
Ag-O-V Ag2 V4O11 mon2 *,mS*,* - 0.76,0.36,1.53,90,102.,90 - - - N 29076
Ag-O-V Ag3[VO4] ht1 Cu3SbS4,tI16,121 I-42m 0.49795,0.49795,0.97271,90,90,90 adamantane structure red 6.04 X 57937
Ag-O-V Ag3[VO4] ht2 Li6Br3N,cF112,225 Fm-3m 0.78386,0.78386,0.78386,90,90,90 - - 6.05 X 49675
Ag-O-V Ag3[VO4] rt Ag3[VO4],mS32,15 C12/c1 1.01885,0.49751,1.02014,90,115.754,90 - red 6.25 X 48395
Ag-O-V Ag4[V2O7 ] Ag4[V2O7],oP208,61 Pbca 1.089,1.3925,1.882,90,90,90 - orange 6.01 X 15840
Ag-O-W Ag2WO4 Ag2WO4,oP56,34 Pnn2 0.592,1.089,1.203,90,90,90 - brown 7.94 X 9239
Ag-O-W Ag2W2O7 Ag2W2O7,aP22,2 P-1 0.6033,0.7051,0.7735,73.8,87.8,75.3 - yellow pale 7.56 X 9888
Ag-O-Yb AgYbO2 CuFeO2,hR12,166 R-3m 0.33717,0.33717,1.8214,90,90,120 - - 8.69 X 50766
Ag-P-Pd Ag0.25 Pd0.5 P0.25 Mn,cP20,213 P4132 0.7189,0.7189,0.7189,90,90,90 - - 7.86 A 6345
Ag-P-Pd Ag1.1 Pd5P0.9 TlPd5As,tP7,123 P4/mmm 0.3917,0.3917,0.6895,90,90,90 - - 10.65 A 5603
Ag-P-Pt AgPt5P TlPd5As,tP7,123 P4/mmm 0.3926,0.3926,0.7014,90,90,90 - - 17.12 A 5603
Ag-P-Pt Ag0.25 Pt0.5P0.25 Mn,cP20,213 P4132 0.721,0.721,0.721,90,90,90 - - 11.72 A 6345
Ag-P-S AgPS2 *,oP56,55 Pbam 1.121,1.393,0.634,90,90,90 - - - N 9028
Ag-P-S AgPS3 AgPS3,mS20,12 C12/m1 1.121,0.6998,0.6731,90,126.84,90 - orange 3.69 X 11300
Ag-P-S Ag2PS3 mon Ag2PS3,mP72,14 P121/c1 0.6522,1.1797,1.9616,90,93.58,90 - yellowish 4.54 X 14996
Handbook of Inorganic Substances – Edition 2015 : Data 193

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-P-S Ag2PS3 orth Ag2PSe 3,oP48,19 P212121 0.6303,1.1073,1.3901,90,90,90 - - 4.70 X 15822


Ag-P-S Ag3PS4 Cu3AsS4,oP16,31 Pmn21 0.7647,0.6858,0.6506,90,90,90 adamantane structure - 4.70 X 49487
Ag-P-S Ag4P 2S7 ht *,mS*,* - 0.6368,1.1022,0.8073,90,105.22,90 - - - N 26166
Ag-P-S Ag4P 2S7 rt Ag4P 2S7,mS52,15 C12/c1 1.0778,0.6534,1.6211,90,106.8,90 - yellow 4.36 X 10370
Ag-P-S Ag7PS6 ht *,cF*,216 F-43m 1.0502,1.0502,1.0502,90,90,90 - - - N 26166
Ag-P-S Ag7PS6 rt Ag7 AsS6,cP56,198 P213 1.03944,1.03944,1.03944,90,90,90 - - 5.79 A 26166
Ag-P-S Ag7P 3S11 lt2 Ag7P 3S11,mS168,15 C12/c1 2.409,0.634,2.4581,90,110.87,90 - - 4.55 X 43840
Ag-P-S Ag7P 3S11 rt Ag7P 3S11,mS184,15 C12/c1 2.3999,0.63621,2.4909,90,110.926,90 - yellow 4.49 X 43840
Ag-P-Sb AgSbP 14 (Au0.64 Sn0.36 )SnP14,oP68,62 Pnma 1.2816,0.9771,1.0806,90,90,90 - - 3.26 A 47605
Ag-P-Se AgPSe 3 *,oP*,* - 0.6659,1.163,1.415,90,90,90 - - - N 17994
Ag-P-Se Ag2PSe 3 Ag2PSe 3,oP48,19 P212121 0.6585,1.1598,1.4169,90,90,90 - - 5.94 X 11203
Ag-P-Se Ag3PSe 4 Cu3AsS4,oP16,31 Pmn21 0.7689,0.666,0.6379,90,90,90 adamantane structure black 6.82 X 41786
Ag-P-Se Ag7PSe 6 ht Ag7PSe 6,cF152,216 F-43m 1.0838,1.0838,1.0838,90,90,90 - - 6.57 X 34145
Ag-P-Se Ag7PSe 6 rt Ag7 AsS6,cP56,198 P213 1.0772,1.0772,1.0772,90,90,90 - - 6.69 X 34145
Ag-P-Si Ag2SiP 2 Ag2SiP 2,tI20,122 I-42d 0.6522,0.6522,0.8545,90,90,90 - black 5.59 X 33975
Ag-P-Sn Ag3SnP 7 Au3SnP 7,mP22,11 P121/m1 0.636,1.1071,0.6518,90,108.17,90 - black 5.02 X 36805
Ag-P-Sr SrAgP BeZrSi,hP6,194 P63/mmc 0.4409,0.4409,0.823,90,90,120 AlB2 family red ruby 5.43 X 12038
Ag-P-Zn Ag1.865 Zn1.135P 8 Cu2(Cu0.75 In0.25)2P 8,mS44,15 C12/c1 1.1492,0.99604,0.77106,90,109.585,90 - black 4.18 X 57660
Ag-Pb-Pd Ag2Pd12Pb8 Ni13 Ga3Ge6,hP66,152 P3121 0.89713,0.89713,1.729,90,90,120 AlB2 family - 13.02 A 14778
Ag-Pb-Pr AgPrPb LiGaGe,hP6,186 P63mc 0.48267,0.48267,0.76745,90,90,120 AlB2 family - 9.78 X 38785
Ag-Pb-Se Ag0.1 Pb0.9 Se2 SrS2 ,tI12,140 I4/mcm 0.64246,0.64246,0.76989,90,90,90 - gray 7.42 X 57337
Ag-Pb-Sm AgSmPb CaIn2,hP6,194 P63/mmc 0.4782,0.4782,0.7557,90,90,120 AlB2 family - 10.33 X 16177
Ag-Pb-Sm Ag0.87 SmPb2.13 Cu3Au,cP4,221 Pm-3m 0.47066,0.47066,0.47066,90,90,90 close-packed structure - 10.92 X 38837
Ag-Pb-Sr SrAgPb KHg2,oI12,74 Imma 0.498,0.784,0.8592,90,90,90 AlB2 family - 7.97 A 31703
Ag-Pb-Tb AgTbPb LiGaGe,hP6,186 P63mc 0.47524,0.47524,0.74322,90,90,120 AlB2 family - 10.83 X 38785
Ag-Pb-Tb Ag0.69 TbPb2.31 Cu3Au,cP4,221 Pm-3m 0.46396,0.46396,0.46396,90,90,90 close-packed structure - 11.84 X 38837
Ag-Pb-Te Ag0.0041Pb0.9959 Te NaCl,cF8,225 Fm-3m 0.64592,0.64592,0.64592,90,90,90 rocksalt family - 8.24 X 53293
Ag-Pb-Tm AgTmPb ZrNiAl,hP9,189 P-62m 0.73714,0.73714,0.44569,90,90,120 Fe2P family - 11.50 X 38763
Ag-Pb-Tm Ag0.62 TmPb1.38 CaIn2,hP6,194 P63/mmc 0.47035,0.47035,0.73564,90,90,120 AlB2 family - 12.29 X 38885
Ag-Pb-Tm Ag0.66 TmPb2.34 Cu3Au,cP4,221 Pm-3m 0.46056,0.46056,0.46056,90,90,90 close-packed structure - 12.32 X 38837
Ag-Pb-Y AgYPb ZrNiAl,hP9,189 P-62m 0.74826,0.74826,0.44247,90,90,120 Fe2P family - 9.38 X 38763
Ag-Pb-Y Ag0.69 YPb2.31 Cu3Au,cP4,221 Pm-3m 0.46571,0.46571,0.46571,90,90,90 close-packed structure - 10.55 X 38837
Ag-Pb-Y Ag0.78 YPb1.22 CaIn2,hP6,194 P63/mmc 0.47414,0.47414,0.74346,90,90,120 AlB2 family - 9.77 X 38885
Ag-Pb-Yb AgYbPb AgYbPb,hP9,187 P-6m2 0.4873,0.4873,1.1017,90,90,120 - - 10.73 X 31703
Ag-Pd-Pt Ag0.125 Pt0.125 Pd0.75 Cu,cF4,225 Fm-3m 0.3913,0.3913,0.3913,90,90,90 close-packed structure - 13.05 X 56724
Ag-Pd-S Ag0.25 Pd0.5 S0.25 Mn,cP20,213 P4132 0.7235,0.7235,0.7235,90,90,90 - - 7.73 A 6345
Ag-Pd-Se AgPd3Se NaAu3Si,cP40,205 Pa-3 0.86289,0.86289,0.86289,90,90,90 - - 10.46 X 56902
Ag-Pd-Sr SrAg3Pd2 CaCu5,hP6,191 P6/mmm 0.554,0.554,0.452,90,90,120 - - 8.63 X 6163
Ag-Pd-Tb Ag0.5 TbPd0.5 CsCl,cP2,221 Pm-3m 0.354,0.354,0.354,90,90,90 b.c.c. family - 9.96 X 2659
Ag-Pd-Te Ag0.8 Pd1.2 Te PbClF,tP6,129 P4/nmm 0.624,0.624,1.153,90,90,90 - - 2.53 A 4236
Ag-Pd-Th Ag0.5 Th2Pd0.5 CuAl2,tI12,140 I4/mcm 0.743,0.743,0.593,90,90,90 - - 11.59 A 6743
Ag-Pd-Y Ag1.11 YPd1.89 TiNi3,hP16,194 P63/mmc 0.57995,0.57995,0.9568,90,90,120 close-packed structure - 9.77 A 20672
Ag-Pd-Y Ag2.1 YPd0.9 Mg3 Cd,hP8,194 P63/mmc 0.5937,0.5937,0.4936,90,90,120 close-packed structure - 9.06 A 20672
Ag-Pd-Zr Ag0.76 Zr2Pd0.24 CuZr2,tI6,139 I4/mmm 0.325,0.325,1.176,90,90,90 close-packed structure - 7.75 A 2432
Ag-Pr-S Ag0.5 Pr2.5S4 Th3P 4,cI28,220 I-43d 0.8567,0.8567,0.8567,90,90,90 - - 5.65 A 3019
Ag-Pr-Sb AgPrSb2 CuHfSi2,tP8,129 P4/nmm 0.43473,0.43473,1.06711,90,90,90 - - 8.11 X 46532
Ag-Pr-Se Ag0.131 Pr2.623 Se4 Th3P 4,cI28,220 I-43d 0.8897,0.8897,0.8897,90,90,90 - - 6.60 A 7249
Ag-Pr-Si AgPrSi ht LiBaSi,hP3,187 P-6m2 0.42302,0.42302,0.41911,90,90,120 AlB2 family - 7.08 X 57891
Ag-Pr-Si AgPrSi rt LaPtSi,tI12,109 I41md 0.42087,0.42087,1.46432,90,90,90 - - 7.09 X 57891
Ag-Pr-Si AgPrSi2 LaMnSi2,oS16,63 Cmcm 0.42244,1.7522,0.42164,90,90,90 - - 6.49 A 54905
Ag-Pr-Si Ag0.06 PrSi0.94 FeB-b,oP8,62 Pnma 0.8264,0.3954,0.5926,90,90,90 CrB(TlI)-FeB - 5.96 A 57891
Ag-Pr-Si Ag0.25 Pr3Si1.75 U3Si2,tP10,127 P4/mbm 0.7786,0.7786,0.4339,90,90,90 - - 6.30 A 57891
Ag-Pr-Si Ag0.27 Pr5Si3.73 Zr5Si4,tP36,92 P41212 0.793,0.793,1.4967,90,90,90 - - 5.92 A 57891
Ag-Pr-Si Ag0.32 Pr5Si2.68 Cr5B3,tI32,140 I4/mcm 0.782,0.782,1.383,90,90,90 - - 6.40 A 57891
Ag-Pr-Si Ag0.68 PrSi1.32 ThSi2,tI12,141 I41/amd 0.42,0.42,1.4522,90,90,90 - - 6.52 A 30050
Ag-Pr-Si Ag1.2 PrSi0.8 AlB2 ,hP3,191 P6/mmm 0.426,0.426,0.4152,90,90,120 AlB2 family - 7.45 X 57891
Ag-Pr-Si Ag2PrSi2 ht CeAl2Ga2,tI10,139 I4/mmm 0.42084,0.42084,1.06735,90,90,90 - - 7.25 X 57891
Ag-Pr-Si Ag2PrSi2 rt Ce(Ni0.59 Sb0.41 )4,oI10,71 Immm 0.42287,0.42088,1.06695,90,90,90 - - 7.22 X 57891
Ag-Pr-Sn AgPrSn LiGaGe,hP6,186 P63mc 0.47706,0.47706,0.76524,90,90,120 AlB2 family - 8.09 X 38843
Ag-Pr-Sn AgPr5Sn3 CuHf5Sn3,hP18,193 P63/mcm 0.9511,0.9511,0.6721,90,90,120 AlB2 family - 7.37 A 40026
Ag-Pr-Sn Ag0.24 PrSn2.76 Cu3Au,cP4,221 Pm-3m 0.4691,0.4691,0.4691,90,90,90 close-packed structure - 7.95 X 40026
Ag-Pr-Sn Ag0.44 Pr3Sn4.56 rt Pu3Pd5,oS32,63 Cmcm 1.0185,0.8212,1.0477,90,90,90 - - 7.67 A 40026
Ag-Pr-Sn Ag0.86 PrSn0.14 rt CsCl,cP2,221 Pm-3m 0.3749,0.3749,0.3749,90,90,90 b.c.c. family - 7.89 X 40026
Ag-Pr-Sn Ag4Pr3Sn4 Cu4Gd3Ge4,oI22,71 Immm 0.4657,0.735,1.5453,90,90,90 - - 8.34 X 43250
Ag-Pr-Sn Ag47.8 Pr14Sn3.2 Ag51 Gd14,hP68,175 P6/m 1.2839,1.2839,0.9449,90,90,120 - - 9.24 A 40026
Ag-Pr-Zn AgZnPr KHg2,oI12,74 Imma 0.4692,0.7177,0.7966,90,90,90 AlB2 family - 7.78 A 37142
Ag-Pt-Si AgPt5Si TlPd5As,tP7,123 P4/mmm 0.3961,0.3961,0.6993,90,90,90 - - 16.82 A 5603
Ag-Pt-Tl Ag0.5 Tl0.5 Pt NiAs,hP4,194 P63/mmc 0.4102,0.4102,0.5476,90,90,120 AlB2 family - 14.62 X 6345
Ag-Rb-S RbAg3S2 CsAg3S2,mS24,12 C12/m1 1.613,0.4306,0.877,90,114.6,90 - - 5.68 X 11038
Ag-Rb-S RbAg5S3 RbAg5S3,hP54,174 P-6 1.3389,1.3389,0.804,90,90,120 - black red 5.76 X 28661
Ag-Rb-S RbAg7S4 CsAg7S4,tP48,85 P4/n 1.1001,1.1001,0.8511,90,90,90 - black 6.25 X 26097
Ag-Rb-S Rb2Ag4S3 K2Ag4S3,mS36,12 C12/m1 1.7808,0.431,1.1799,90,108.55,90 - black 5.40 X 42478
Ag-Rb-Se RbAgSe4 [NH4]CuS4,oP24,19 P212121 0.5809,0.8927,1.3435,90,90,90 - black 4.85 X 34637
Ag-Rb-Se RbAg3Se2 CsAg3S2,mS24,12 C12/m1 1.6654,0.4407,0.8854,90,113.92,90 - black 6.34 X 11629
Ag-Rb-Se RbAg5Se3 RbAg5Se3,tP18,125 P4/nbm 0.60814,0.60814,1.1112,90,90,90 - black 6.96 X 36178
Ag-Rb-Te RbAg3 Te2 CsAg3S2,mS24,12 C12/m1 1.7546,0.4617,0.9165,90,113.04,90 - black 6.46 X 37441
Ag-S-Sb AgSbS2 rt AgSbS2,mS32,5 C121 1.2824,0.4406,1.3193,90,98.567,90 miargyrite - 5.29 X 33572
Ag-S-Sb Ag0.5 Sb0.5 S ht NaCl,cF8,225 Fm-3m 0.566,0.566,0.566,90,90,90 cuboargyrite - 5.38 X 9026
194 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-S-Sb Ag3SbS3 mon Ag3SbS3,mP28,14 P121/c1 0.68389,1.584,0.624,90,117.132,90 pyrostilpnite - 5.98 X 4214


Ag-S-Sb Ag3SbS3 rhom Ag3 AsS3,hR42,161 R3c 1.104,1.104,0.872,90,90,120 pyrargyrite - 5.86 X 3216
Ag-S-Sb Ag5SbS4 Ag5SbS4,oS40,36 Cmc21 0.78329,1.2458,0.85272,90,90,90 stephanite gray 6.30 X 53046
Ag-S-Sb Ag7SbS6 ht *,cF*,216 F-43m 1.0669,1.0669,1.0669,90,90,90 - - - N 13865
Ag-S-Sb Ag7SbS6 rt *,cP*,198 P213 1.0598,1.0598,1.0598,90,90,90 - - - N 13865
Ag-S-Se Ag2Se0.05 S0.95 rt Ag2S-a,mP12,14 P121/c1 0.42,0.691,0.82621,90,110.063,90 acanthite - 7.38 A 8093
Ag-S-Se Ag2Se0.89 S0.11 rt Ag2Se,oP12,19 P212121 0.431,0.702,0.771,90,90,90 naumannite - 8.24 A 8093
Ag-S-Se Ag4Se0.94 S1.06 rt *,oP*,* - 0.433,0.709,0.776,90,90,90 aguilarite - - N 8093
Ag-S-Si Ag10Si3S11 Ag10Si3S11 ,aP50,2 P-1 0.6459,1.2414,1.3476,68.71,78.92,77.61 - orange red 5.16 X 10226
Ag-S-Si Ag2SiS3 Ag2SiS3,mP24,14 P121/c1 0.66709,0.66567,1.31748,90,118.658,90 - - 4.40 X 56508
Ag-S-Si Ag8SiS6 ht Ag8GeTe6 ,cF220,216 F-43m 1.063,1.063,1.063,90,90,90 - - 5.99 A 3916
Ag-S-Si Ag8SiS6 rt Ag8GeS6,oP60,33 Pna21 1.5043,0.7452,1.0565,90,90,90 - - 6.08 A 12606
Ag-S-Sm AgSmS2 AgGdS2,mP32,4 P1211 0.7784,0.7775,1.2328,90,91.09,90 - - 5.74 A 26039
Ag-S-Sm Ag0.5 Sm2.5 S4 Th3P 4,cI28,220 I-43d 0.8444,0.8444,0.8444,90,90,90 - - 6.16 A 3019
Ag-S-Sn Ag0.5 Sn0.5 S NaCl,cF8,225 Fm-3m 0.5506,0.5506,0.5506,90,90,90 rocksalt family - 5.78 X 10073
Ag-S-Sn Ag2SnS3 ht1 Ag2SnS3,mS52,15 C12/c1 0.66323,1.14626,1.32381,90,98.008,90 - - 5.74 X 59048
Ag-S-Sn Ag2SnS3 rt *,hR*,* - 1.136,1.136,1.369,90,90,120 - - - N 9819
Ag-S-Sn Ag4Sn3S8 ht Ag4Sn3S8,cP60,213 P4132 1.0809,1.0809,1.0809,90,90,90 - black gray 5.49 X 44988
Ag-S-Sn Ag8SnS6 ht Ag8GeTe6 ,cF220,216 F-43m 1.0773,1.0773,1.0773,90,90,90 - - 6.24 A 54416
Ag-S-Sn Ag8SnS6 rt Ag8GeS6,oP60,33 Pna21 1.53111,0.7553,1.07041,90,90,90 canfieldite gray light 6.30 A 54416
Ag-S-Ta AgTaS3 UFeS3,oS20,63 Cmcm 0.3378,1.407,0.7756,90,90,90 - black 6.94 X 33491
Ag-S-Ta Ag0.23 TaS2 lt sta2 Ag0.25 NbS2,hR24,166 R-3m 0.3324,0.3324,3.948,90,90,120 - - 7.12 X 21717
Ag-S-Ta Ag0.6 TaS2 ht Cu0.65 NbS2,hP10,194 P63 /mmc 0.3333,0.3333,1.444,90,90,120 - black 7.41 A 21717
Ag-S-Ta Ag7 TaS6 lt1 Ag7 TaS6,mP28,7 P1c1 0.7453,0.74026,1.29016,90,125.218,90 - - 6.44 X 32352
Ag-S-Ta Ag7 TaS6 rt Ag7 TaS6,cF220,216 F-43m 1.05139,1.05139,1.05139,90,90,90 - black 6.45 X 24903
Ag-S-Tb AgTbS2 AgGdS2,mP32,4 P1211 0.77,0.77,1.212,90,90.72,90 - - 6.12 A 3020
Ag-S-Tb Ag0.5 Tb2.5 S4 Th3P 4,cI28,220 I-43d 0.835,0.835,0.835,90,90,90 - - 6.61 A 3019
Ag-S-Te Ag12 Te6S rt Ag12 Te6S,hP64,174 P-6 1.3413,1.3413,0.8452,90,90,120 - gray 7.91 X 45655
Ag-S-Te Ag2 TeS3 Ag2 TeS3,mS24,9 C1c1 0.6783,1.1567,0.7693,90,114.44,90 - red dark 5.31 X 33575
Ag-S-Ti Ag0.33 Ti2S4 rt Ag0.33 Ti2S4,hP7,164 P-3m1 0.3416,0.3416,1.21,90,90,120 - - 3.53 X 23701
Ag-S-Ti Ag0.35 TiS2 rt TiNi0.40 S2 ,hP24,163 P-31c 0.59424,0.59424,1.2791,90,90,120 - - 3.81 X 20362
Ag-S-Ti Ag0.35 TiS2 rt TlCdS2,hP4,164 P-3m1 0.34275,0.34275,0.63977,90,90,120 AlB2 family - 3.82 X 17551
Ag-S-Ti Ag0.35 TiS2 Ag0.35 TiS2 ,hP22,163 P-31c 0.59288,0.59288,1.2744,90,90,120 - - 3.85 X 20362
Ag-S-Ti Ag8 TiS6 ht Ag8 TiS6,cF700,216 F-43m 1.0628,1.0628,1.0628,90,90,90 - - 6.10 X 32351
Ag-S-Ti Ag8 TiS6 lt1 *,cI*,* - 2.12,2.12,2.12,90,90,90 - - - N 32351
Ag-S-Ti Ag8 TiS6 lt2 Ag8GeS6,oP60,33 Pna21 1.5095,0.7462,1.0641,90,90,90 - - 6.11 X 40741
Ag-S-Ti Ag8 TiS6 tricl *,aP*,* - 1.805,1.82257,1.825,110.439,108.8,108.855 - - - N 40741
Ag-S-Tl AgTlS AgTlTe,oP12,62 Pnma 0.8323,0.4464,0.7238,90,90,90 - - 8.50 A 13471
Ag-S-Tl Ag3 TlS2 rt Ag3 TlS2,oP24,60 Pbcn 0.8154,0.8792,0.7029,90,90,90 - gray silver 7.80 X 18061
Ag-S-Tl Ag5.4 TlS3.5 *,hP20,176 P63 /m 1.0614,1.0614,0.4246,90,90,120 - - 7.21 N 16711
Ag-S-Tm AgTmS2 rt AgGdS2,mP32,4 P1211 0.76,0.76,1.186,90,90.13,90 - - 6.61 A 3020
Ag-S-Tm Ag0.5 Tm0.5 S ht NaCl,cF8,225 Fm-3m 0.5501,0.5501,0.5501,90,90,90 rocksalt family - 6.80 X 3020
Ag-S-V Ag0.13 V3S4 K0.3 Ti3S4,hP18,176 P63 /m 0.9217,0.9217,0.3304,90,90,120 - black 4.03 X 31139
Ag-S-Y AgYS2 AgGdS2,mP32,4 P1211 0.766,0.766,1.202,90,90.5,90 - - 4.91 A 3020
Ag-S-Yb AgYbS2 rt AgYbS2,tI16,109 I41md 0.5356,0.5356,1.1803,90,90,90 - - 6.77 X 3020
Ag-S-Yb Ag0.5 Yb0.5 S ht NaCl,cF8,225 Fm-3m 0.55063,0.55063,0.55063,90,90,90 rocksalt family - 6.86 X 26039
Ag-S-Zr Ag4Zr3S8 Ag4Hf3S8,cP100,213 P4132 1.09427,1.09427,1.09427,90,90,90 - black gray 4.87 X 30611
Ag-Sb-Se Ag0.5 Sb0.5 Se NaCl,cF8,225 Fm-3m 0.57573,0.57573,0.57573,90,90,90 rocksalt family - 6.74 X 54718
Ag-Sb-Sm AgSmSb2 CuHfSi2,tP8,129 P4/nmm 0.4312,0.4312,1.0555,90,90,90 - - 8.49 A 30559
Ag-Sb-Sn Ag3Sn0.5 Sb0.5 Cu3Ti,oP8,59 Pmmn 0.4837,0.6016,0.5213,90,90,90 close-packed structure - 9.72 A 1166
Ag-Sb-Sr SrAgSb BeZrSi,hP6,194 P63 /mmc 0.4762,0.4762,0.8532,90,90,120 AlB2 family - 6.29 X 23592
Ag-Sb-Sr SrAg4Sb2 CaCu4P 2,hR21,166 R-3m 0.47404,0.47404,2.5029,90,90,120 - - 7.80 X 58944
Ag-Sb-Tb AgTbSb2 CuHfSi2,tP8,129 P4/nmm 0.42774,0.42774,1.0477,90,90,90 - - 8.84 A 30571
Ag-Sb-Te AgSbTe 2 rhom NaFeO2,hR12,166 R-3m 0.42898,0.42898,2.1016,90,90,120 rocksalt family - 7.21 X 44792
Ag-Sb-Te AgSbTe 2 tet LiFeO2,tP4,123 P4/mmm 0.42898,0.42898,0.60667,90,90,90 rocksalt family - 7.21 X 44792
Ag-Sb-Te Ag0.05 Sb1.95 Te3 Bi2Te3,hR15,166 R-3m 0.42623,0.42623,3.0446,90,90,120 - - 6.51 A 34856
Ag-Sb-Te Ag0.24 Sb10.76 Te4 (Ag0.22 Sb0.78 )2Sb9Te4,hP15,164 P-3m1 0.4282,0.4282,2.8636,90,90,120 - - 6.74 X 52094
Ag-Sb-Te Ag0.5 Sb0.5 Te hp1 (Ag0.5 Sb0.5 )Te,oS12,63 Cmcm 0.37974,0.4238,0.56358,90,90,90 - - 17.75 X 45480
Ag-Sb-Te Ag0.5 Sb0.5 Te hp2 CsCl,cP2,221 Pm-3m 0.345,0.345,0.345,90,90,90 b.c.c. family - 9.80 X 45480
Ag-Sb-Te Ag0.5 Sb0.5 Te rt NaCl,cF8,225 Fm-3m 0.6082,0.6082,0.6082,90,90,90 rocksalt family - 7.16 X 53209
Ag-Sb-Te Ag2Sb2Te 4 cub (Ag0.87 Sb0.13 )(Ag0.1 ...,cP8,221 Pm-3m 0.60667,0.60667,0.60667,90,90,90 - - 7.21 X 44792
Ag-Sb-Tm AgTmSb2 CuHfSi2,tP8,129 P4/nmm 0.42529,0.42529,1.039,90,90,90 - - 9.20 A 30559
Ag-Sb-U AgUSb2 CuHfSi2,tP8,129 P4/nmm 0.4322,0.4322,1.0281,90,90,90 - - 10.19 A 35063
Ag-Sb-Y AgYSb2 CuHfSi2,tP8,129 P4/nmm 0.42711,0.42711,1.04968,90,90,90 - - 7.64 X 42128
Ag-Sb-Yb AgYbSb TiNiSi,oP12,62 Pnma 0.76693,0.4591,0.83755,90,90,90 AlB2 family - 9.07 X 33197
Ag-Sb-Zr AgZr5Sb3 CuHf5Sn3,hP18,193 P63 /mcm 0.86235,0.86235,0.58808,90,90,120 AlB2 family - 8.15 A 23372
Ag-Sc-Se AgScSe2 lt AgErSe2,oP16,19 P212121 0.425,0.673,1.352,90,90,90 - - 5.34 A 7249
Ag-Sc-Se AgScSe2 rt TlCdS2,hP4,164 P-3m1 0.38779,0.38779,0.66501,90,90,120 AlB2 family - 5.96 X 46707
Ag-Sc-Sn AgScSn hex ZrNiAl,hP9,189 P-62m 0.7082,0.7082,0.4339,90,90,120 Fe2P family - 7.18 X 48471
Ag-Sc-Sn AgScSn orth TiFeSi,oI36,46 Ima2 0.8699,1.2252,0.7081,90,90,90 - - 7.17 X 48471
Ag-Sc-Te AgSc6Te2 Sc6PdTe2,oP36,62 Pnma 2.0094,0.3913,1.0688,90,90,90 - black 5.00 X 40036
Ag-Se-Si Ag8SiSe6 ht Ag8GeTe6 ,cF220,216 F-43m 1.097,1.097,1.097,90,90,90 - - 6.87 A 3916
Ag-Se-Si Ag8SiSe6 lt *,tI*,119 I-4m2 0.7706,0.7706,1.1014,90,90,90 - - - N 12036
Ag-Se-Si Ag8SiSe8 rt *,cP*,208 P4232 1.087,1.087,1.087,90,90,90 - - - N 3916
Ag-Se-Sm Ag0.5 Sm2.5 Se4 Th3P 4,cI28,220 I-43d 0.8788,0.8788,0.8788,90,90,90 - - 7.30 A 7249
Ag-Se-Sn Ag0.5 Sn0.5 Se NaCl,cF8,225 Fm-3m 0.5627,0.5627,0.5627,90,90,90 rocksalt family - 7.17 X 10073
Ag-Se-Sn Ag8SnSe6 ht Ag8GeTe6 ,cF220,216 F-43m 1.105,1.105,1.105,90,90,90 - - 7.17 A 37561
Ag-Se-Sn Ag8SnSe6 rt Ag8GeSe6 ,oP30,31 Pmn21 0.79168,0.78219,1.10453,90,90,90 - - 7.07 X 40199
Handbook of Inorganic Substances – Edition 2015 : Data 195

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ag-Se-Ta Ag7 TaSe6 ht Ag7 TaS6,cF220,216 F-43m 1.08277,1.08277,1.08277,90,90,90 - - 7.38 A 26034


Ag-Se-Tb AgTbSe 2 AgYbS2,tI16,109 I41md 0.56427,0.56427,1.235,90,90,90 - - 7.17 A 7249
Ag-Se-Te Ag2 Te0.7 Se0.3 β Ag2Se,oP12,19 P212121 0.4424,0.734,0.8108,90,90,90 - - 8.29 A 10674
Ag-Se-Tl AgTlSe AgTlTe,oP12,62 Pnma 0.869,0.46375,0.74756,90,90,90 - - 8.63 X 13543
Ag-Se-Tl AgTlSe 2 tf1 AgTlSe 2,hP24,162 P-31m 0.97,0.97,0.825,90,90,120 - - 6.97 X 2789
Ag-Se-Tl AgTlSe 2 tf2 *,hP48,* - 0.971,0.971,1.658,90,90,120 - - - N 2789
Ag-Se-Tl Ag5.4 TlSe3.5 *,hP20,176 P63/m 1.0951,1.0951,0.4384,90,90,120 - - 7.76 N 16711
Ag-Se-Tl Ag9.71 Tl3Se6.49 Ag9.7 Tl3Se6.5 ,hP40,176 P63/m 1.5116,1.5116,0.4406,90,90,120 - - 8.28 X 20163
Ag-Se-Tm AgTmSe 2 rt AgErSe 2,oP16,19 P212121 0.419,0.685,1.368,90,90,90 - - 7.35 A 7249
Ag-Se-Tm Ag0.25 Tm0.583 Se NaCl,cF8,225 Fm-3m 0.5512,0.5512,0.5512,90,90,90 rocksalt family - 8.11 X 7249
Ag-Se-Y AgYSe2 rt AgErSe 2,oP16,19 P212121 0.423,0.695,1.384,90,90,90 - - 5.79 A 7249
Ag-Se-Y Ag0.5 Y0.5Se ht NaCl,cF8,225 Fm-3m 0.578,0.578,0.578,90,90,90 rocksalt family - 6.10 X 4576
Ag-Se-Yb AgYbSe 2 AgErSe 2,oP16,19 P212121 0.416,0.677,1.354,90,90,90 - - 7.64 A 7249
Ag-Se-Yb Ag0.25 Yb0.583 Se NaCl,cF8,225 Fm-3m 0.5525,0.5525,0.5525,90,90,90 rocksalt family - 8.15 X 7249
Ag-Se-Yb Ag0.5 Yb2.75 Se4 Yb2FeS4,cF72,227 Fd-3m 1.153,1.153,1.153,90,90,90 - - 7.33 X 48551
Ag-Si-Sm AgSmSi ZrNiAl,hP9,189 P-62m 0.7136,0.7136,0.4239,90,90,120 Fe2P family - 7.63 A 18134
Ag-Si-Sm Ag2SmSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4169,0.4169,1.069,90,90,90 - - 7.55 A 7464
Ag-Si-Sr SrAg2Si2 CeAl2Ga2,tI10,139 I4/mmm 0.438,0.438,1.048,90,90,90 - - 5.94 X 7079
Ag-Si-Sr Sr8Ag5Si9 Sr8Ag5Si9,oS92,21 C222 0.848,1.469,1.84,90,90,90 AlB2 family - 4.33 X 14264
Ag-Si-Tb AgTbSi ZrNiAl,hP9,189 P-62m 0.7047,0.7047,0.4191,90,90,120 Fe2P family - 8.15 A 57891
Ag-Si-Tb Ag0.3 TbSi1.7 ThSi2,tI12,141 I41/amd 0.4056,0.4056,1.3821,90,90,90 - - 6.98 A 57891
Ag-Si-Tb Ag0.7 TbSi1.3 AlB2 ,hP3,191 P6/mmm 0.4133,0.4133,0.4036,90,90,120 AlB2 family - 7.54 X 57891
Ag-Si-Tb Ag2 TbSi2 CeAl2Ga2,tI10,139 I4/mmm 0.41002,0.41002,1.06868,90,90,90 - - 7.96 X 41821
Ag-Si-Te Ag8SiTe 6 rt Ag8GeTe 6,cF220,216 F-43m 1.15225,1.15225,1.15225,90,90,90 - - 7.19 X 26332
Ag-Si-Tm AgTmSi ZrNiAl,hP9,189 P-62m 0.6945,0.6945,0.4131,90,90,120 Fe2P family - 8.80 X 56731
Ag-Si-Y AgYSi ZrNiAl,hP9,189 P-62m 0.70181,0.70181,0.41662,90,90,120 Fe2P family - 6.30 A 57891
Ag-Si-Y Ag0.2 YSi1.8 ThSi2,tI12,141 I41/amd 0.4032,0.4032,1.378,90,90,90 - - 4.77 A 57891
Ag-Si-Y Ag0.7 YSi1.3 AlB2 ,hP3,191 P6/mmm 0.4122,0.4122,0.4019,90,90,120 AlB2 family - 5.64 X 57891
Ag-Si-Y Ag1.4 YSi0.6 Fe2P,hP9,189 P-62m 0.7137,0.7137,0.4152,90,90,120 Fe2P family - 6.98 A 57891
Ag-Si-Y Ag2 YSi2 CeAl2Ga2,tI10,139 I4/mmm 0.41214,0.41214,1.0749,90,90,90 - - 6.56 A 57891
Ag-Si-Yb AgYbSi ZrNiAl,hP9,189 P-62m 0.6932,0.6932,0.4118,90,90,120 Fe2P family - 8.98 X 18134
Ag-Si-Yb Ag0.28 YbSi1.72 ThSi2,tI12,141 I41/amd 0.40757,0.40757,1.41965,90,90,90 - gray silver 7.09 X 44319
Ag-Si-Yb Ag0.374 YbSi1.626 GdSi1.4 ,oI12,74 Imma 0.40831,0.40911,1.43072,90,90,90 - - 7.20 X 54578
Ag-Si-Yb Ag2 YbSi2 CeAl2Ga2,tI10,139 I4/mmm 0.419,0.419,1.0622,90,90,90 - - 7.92 X 54578
Ag-Sm-Sn AgSmSn CaIn2,hP6,194 P63/mmc 0.4732,0.4732,0.7495,90,90,120 AlB2 family - 8.61 X 14277
Ag-Sm-Sn Ag4Sm3Sn4 Cu4Gd3Ge4,oI22,71 Immm 0.4597,0.7324,1.53,90,90,90 - - 8.75 X 48772
Ag-Sm-Zn AgZnSm KHg2,oI12,74 Imma 0.4646,0.71,0.7884,90,90,90 AlB2 family - 8.27 A 37142
Ag-Sn-Sr SrAgSn KHg2,oI12,74 Imma 0.4902,0.7813,0.8415,90,90,90 AlB2 family - 6.48 A 31703
Ag-Sn-Sr SrAg2Sn2 CeAl2Ga2,tI10,139 I4/mmm 0.467,0.467,1.173,90,90,90 - - 7.02 X 10313
Ag-Sn-Tb AgTbSn CaIn2,hP6,194 P63/mmc 0.4688,0.4688,0.7368,90,90,120 AlB2 family - 9.13 X 26300
Ag-Sn-Tb AgTbSn2 Cu3Au,cP4,221 Pm-3m 0.45653,0.45653,0.45653,90,90,90 close-packed structure - 8.80 X 50613
Ag-Sn-Tb Ag4 Tb3Sn4 lt Cu4Gd3Ge4,oI22,71 Immm 0.5012,0.6887,1.4575,90,90,90 - - 9.13 A 48686
Ag-Sn-Te Ag0.365 Sn0.635 Te rt NaCl,cF8,225 Fm-3m 0.61,0.61,0.61,90,90,90 rocksalt family - 7.09 X 3955
Ag-Sn-Te Ag0.5 Sn0.5 Te NaCl,cF8,225 Fm-3m 0.604,0.604,0.604,90,90,90 rocksalt family - 7.26 X 2325
Ag-Sn-Ti AgTi5Sn3 CuHf5Sn3,hP18,193 P63/mcm 0.8223,0.8223,0.5651,90,90,120 AlB2 family - 7.06 A 37362
Ag-Sn-Tm AgTmSn ht LiGaGe,hP6,186 P63mc 0.4654,0.4654,0.7266,90,90,120 AlB2 family - 9.64 X 49578
Ag-Sn-U Ag0.6 USn2.4 Cu3Au,cP4,221 Pm-3m 0.45597,0.45597,0.45597,90,90,90 close-packed structure - 10.29 X 35814
Ag-Sn-Y AgYSn2 Cu3Au,cP4,221 Pm-3m 0.45636,0.45636,0.45636,90,90,90 close-packed structure - 7.59 X 50613
Ag-Sn-Y Ag4 Y3Sn4 Cu4Gd3Ge4,oI22,71 Immm 0.4983,0.6863,1.461,90,90,90 - - 7.80 A 48686
Ag-Sn-Yb AgYbSn AgYbPb,hP9,187 P-6m2 0.4792,0.4792,1.0873,90,90,120 - gray dark 9.21 X 36225
Ag-Sn-Zr Ag0.6 Zr5Sn3.4 CuHf5Sn3,hP18,193 P63/mcm 0.8448,0.8448,0.5775,90,90,120 AlB2 family - 8.60 A 55916
Ag-Sr-Zn SrAg0.4 Zn0.6 FeB-b,oP8,62 Pnma 0.8539,0.4662,0.6445,90,90,90 CrB(TlI)-FeB - 4.40 A 19110
Ag-Sr-Zn SrAg0.9 Zn0.1 Sr(Ag0.9 Zn0.1 ),oP24,31 Pmn21 0.4758,2.486,0.6397,90,90,90 CrB(TlI)-FeB - 5.04 X 19110
Ag-Tb-Te AgTbTe 2 AgErTe 2,tP8,113 P-421m 0.714,0.714,0.46093,90,90,90 - - 7.38 X 50601
Ag-Tb-Zn Ag0.5 Zn0.5 Tb CsCl,cP2,221 Pm-3m 0.3595,0.3595,0.3595,90,90,90 b.c.c. family - 8.78 X 10890
Ag-Te-Ti Ag0.55 TiTe2 *,mP*,10 P12/m1 0.3816,0.6513,0.6446,90,90.,90 - - - N 33193
Ag-Te-Ti Ag0.66 TiTe2 *,hP*,164 P-3m1 0.7604,0.7604,0.6408,90,90,120 - - - N 33074
Ag-Te-Ti Ag0.96 TiTe2 *,hP*,164 P-3m1 0.3808,0.3808,0.6399,90,90,120 - - - N 33074
Ag-Te-Tl AgTlTe rt AgTlTe,oP12,62 Pnma 0.8775,0.4867,0.7763,90,90,90 - - 8.81 X 13471
Ag-Te-Tl AgTlTe 2 orth *,oS16,* - 0.412,0.985,1.694,90,90,90 - - - N 18511
Ag-Te-Tl AgTlTe 2 tet AgTlTe 2,tI8,119 I-4m2 0.392,0.392,1.522,90,90,90 - - 8.06 X 2804
Ag-Te-Tl AgTl3 Te2 AgTl3 Te2,mP24,14 P121/c1 1.102,0.7427,0.9888,90,116.62,90 - black 8.96 X 19796
Ag-Te-Tl Ag0.01 Tl1.99 Te *,aP120,2 P-1 0.9018,1.5572,3.0965,99.13,90.88,90.35 - - - N 24133
Ag-Te-Tl Ag16 Tl2Te11 Ag16 Tl2Te11,hR216,167 R-3c 1.1442,1.1442,4.197,90,90,120 - - 7.41 X 26119
Ag-Te-Tl Ag18 Tl4Te11 Ag18 Tl4Te11,cF284,216 F-43m 1.8717,1.8717,1.8717,90,90,90 - - 8.43 X 26040
Ag-Te-Tl Ag22 Tl4Te14.9 Ag22 Tl4Te14.9 ,hP46,174 P-6 1.1418,1.1418,0.922,90,90,120 - - 8.12 X 26144
Ag-Te-Tl Ag3 TlTe2 Ag3 TlTe 2,oS12,65 Cmmm 0.46,1.545,0.476,90,90,90 - - 7.69 X 6997
Ag-Te-Tl Ag9 TlTe5 *,h**,* - 3.052,3.052,1.746,90,90,120 - - - N 24133
Ag-Te-Tm AgTmTe 2 ht TlCdS2,hP4,164 P-3m1 0.4292,0.4292,0.7003,90,90,120 AlB2 family - 7.91 X 48598
Ag-Te-Tm AgTmTe 2 rt *,tP8,113 P-421m 0.708,0.708,0.4532,90,90,90 - - - N 7304
Ag-Te-Y AgYTe 2 ht CuScS2,hP4,156 P3m1 0.4323,0.4323,0.702,90,90,120 - - 6.61 A 7304
Ag-Te-Y AgYTe 2 rt AgErTe 2,tP8,113 P-421m 0.71398,0.71398,0.45947,90,90,90 - - 6.41 X 46690
Ag-Te-Y AgY6 Te2 Sc6PdTe 2,oP36,62 Pnma 2.1865,0.40733,1.1506,90,90,90 - - 5.81 X 49061
Ag-Y-Zn AgZnY KHg2,oI12,74 Imma 0.4579,0.7054,0.7754,90,90,90 AlB2 family - 6.95 A 37142
Ag-Yb-Zn AgZnYb KHg2,oI12,74 Imma 0.4618,0.7286,0.7854,90,90,90 AlB2 family - 8.70 A 37142
Ag-Zn-Zr Ag0.5 Zn0.5 Zr2 Ti2Ni,cF96,227 Fd-3m 1.215,1.215,1.215,90,90,90 - - 7.97 A 2740
Al-Am-O AmAlO3 NdAlO3,hR30,166 R-3m 0.5336,0.5336,1.291,90,90,120 - - 9.95 A 2689
Al-Am-Pd AmPd5Al2 ZrNi2Al5,tI16,139 I4/mmm 0.41298,0.41298,1.4792,90,90,90 - - 10.91 X 59222
196 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-As-Ba Ba3Al2As4 Tl3Fe2S4,oP36,62 Pnma 0.7425,1.1784,1.1842,90,90,90 - black 4.91 X 58898


Al-As-Ca Ca3AlAs3 Ca3AlAs3,oP28,62 Pnma 1.2212,0.4201,1.3434,90,90,90 - red dark 3.59 X 15776
Al-As-Ca Ca3Al2As4 Ca3Al2As4 ,mS36,15 C12/c1 1.286,1.005,0.657,90,90.7,90 - - 3.71 X 14591
Al-As-Cs Cs3AlAs2 Cs3AlAs2,mP48,14 P121/c1 1.1458,0.8831,1.9453,90,99.68,90 - black 3.94 X 24270
Al-As-Eu Eu3Al2As4 Ca3Al2As4 ,mS36,15 C12/c1 1.3404,1.03935,0.67502,90,89.977,90 - black 5.72 X 58898
Al-As-Ga Al0.37 Ga0.63 As cubic ZnS,cF8,216 F-43m 0.5659,0.5659,0.5659,90,90,90 adamantane structure - 4.72 X 35861
Al-As-K K3AlAs2 K3AlAs2,aP48,2 P-1 0.9062,1.2164,1.55652,96.833,106.892,108.37 - black 2.58 X 24286
Al-As-K K3Al2As3 K3Al2As3,mP16,11 P121/m1 0.7534,0.5991,1.0494,90,110.5,90 - red dark 2.96 X 18500
Al-As-Li Li3AlAs2 *,oI48,73 Ibca 1.1865,1.1981,1.2114,90,90,90 - brown red - P 463
Al-As-Mn Mn0.06 Al0.94 As ZnS,cF8,216 F-43m 0.56735,0.56735,0.56735,90,90,90 adamantane structure - 3.77 X 51280
Al-As-Na Na2Al2As3 Na2Al2Sb3 ,mP56,14 P121/c1 1.3114,0.671,1.4448,90,90,90 - - 3.39 X 25671
Al-As-Na Na3AlAs2 Na3AlAs2,oI24,72 Ibam 0.6895,1.3604,0.6227,90,90,90 - red light 2.80 X 22021
Al-As-Ni NiAl0.2 As0.8 rt NiAs,hP4,194 P63 /mmc 0.3627,0.3627,0.503,90,90,120 AlB2 family - 7.19 X 30155
Al-As-Ni Ni1.5 Al0.2 As0.8 Co1.75 Ge,hP6,194 P63 /mmc 0.3836,0.3836,0.5115,90,90,120 AlB2 family - 7.82 X 30155
Al-As-Ni Ni1.75 Al0.5 As0.5 Co1.75 Ge,hP6,194 P63 /mmc 0.3959,0.3959,0.5064,90,90,120 AlB2 family - 7.43 X 30155
Al-As-Ni Ni3Al0.5 As1.5 *,h**,* - 0.6661,0.6661,1.5321,90,90,120 - - - N 30155
Al-As-O Al[AsO4] orth *,oP24,* - 0.822,0.896,1.09,90,90,90 - - - N 1076
Al-As-O Al[AsO4] tet Al[PO4],tI12,82 I-4 0.49,0.49,0.664,90,90,90 - - 3.46 X 72
Al-As-O Al[AsO4] trig Al[AsO4],hP18,152 P3121 0.5028,0.5028,1.1228,90,90,120 alarsite - 3.36 X 25584
Al-As-Pd Pd2Al0.33 As0.67 ht Fe2P,hP9,189 P-62m 0.67,0.67,0.332,90,90,120 Fe2P family - 10.49 A 5603
Al-As-Pt Pt5AlAs TlPd5As,tP7,123 P4/mmm 0.3895,0.3895,0.6934,90,90,90 - - 17.01 A 5603
Al-As-Sr Sr3Al2As4 Ca3Al2As4 ,mS36,15 C12/c1 1.35017,1.04565,0.68109,90,89.543,90 - red 4.26 X 58898
Al-As-V V3 Al0.45 As0.55 Cr3Si,cP8,223 Pm-3n 0.4783,0.4783,0.4783,90,90,90 Frank-Kasper phase - 6.26 X 5616
Al-Au-Ca CaAuAl TiNiSi,oP12,62 Pnma 0.728,0.45,0.779,90,90,90 AlB2 family gray silver 6.87 X 26921
Al-Au-Ca CaAu0.9 Al3.1 CeAl2Ga2,tI10,139 I4/mmm 0.42,0.42,1.145,90,90,90 - gray silver 4.95 X 26922
Al-Au-Ca CaAu3Al7 ScRh3Si7,hR66,167 R-3c 0.8047,0.8047,2.1247,90,90,120 - - 6.86 A 52258
Al-Au-Ce AuCeAl TiNiSi,oP12,62 Pnma 0.7562,0.4589,0.7727,90,90,90 AlB2 family - 9.02 A 30889
Al-Au-Ce Au3CeAl7 ScRh3Si7,hR66,167 R-3c 0.8105,0.8105,2.11,90,90,120 - gray silver 7.64 X 41868
Al-Au-Cu Cu0.625 Au0.875 Al0.5 ht CsCl,cP2,221 Pm-3m 0.3132,0.3132,0.3132,90,90,90 b.c.c. family - 12.19 X 56500
Al-Au-Cu Cu1.25 Au1.75 Al rt Cu2MnAl,cF16,225 Fm-3m 0.6199,0.6199,0.6199,90,90,90 b.c.c. family - 12.58 X 56500
Al-Au-Dy Au2Dy3 Al9 Au2Dy3 Al9,oI36,71 Immm 0.4262,0.9941,1.2552,90,90,90 - - 7.02 X 32744
Al-Au-Dy Au3DyAl7 ScRh3Si7,hR66,167 R-3c 0.80314,0.80314,2.0952,90,90,120 - gray silver 8.02 X 41868
Al-Au-Er Au2.43 Er3Al8.57 La3Al11,oI28,71 Immm 0.42477,0.99529,1.24725,90,90,90 - - 7.63 X 57898
Al-Au-Er Au3ErAl7 ScRh3Si7,hR66,167 R-3c 0.80058,0.80058,2.092,90,90,120 - gray silver 8.13 X 41868
Al-Au-Ga Au0.92 Al0.04 Ga0.04 Cu,cF4,225 Fm-3m 0.40705,0.40705,0.40705,90,90,90 close-packed structure - 18.23 X 11635
Al-Au-Gd Au1.02 GdAl2.98 BaNiSn3,tI10,107 I4mm 0.42166,0.42166,1.0976,90,90,90 - - 7.46 X 57898
Al-Au-Gd Au2.26 Gd3 Al8.74 La3Al11,oI28,71 Immm 0.42947,0.99991,1.26565,90,90,90 - - 7.04 X 57898
Al-Au-Gd Au3GdAl7 ScRh3Si7,hR66,167 R-3c 0.80384,0.80384,2.0947,90,90,120 - gray silver 7.96 X 41868
Al-Au-Hf Au0.35 HfAl1.65 MgCu2,cF24,227 Fd-3m 0.74478,0.74478,0.74478,90,90,90 Friauf-Laves phase - 9.39 X 48632
Al-Au-Hf Au0.47 HfAl2.53 Cu3Au,cP4,221 Pm-3m 0.40719,0.40719,0.40719,90,90,90 close-packed structure - 8.35 X 48632
Al-Au-Hf Au0.5 Hf2Al0.5 Ti2Ni,cF96,227 Fd-3m 1.21,1.21,1.21,90,90,90 - - 14.07 A 2740
Al-Au-Hf Au0.61 HfAl1.39 MgNi2,hP24,194 P63 /mmc 0.52762,0.52762,1.71204,90,90,120 Friauf-Laves phase - 10.82 X 57901
Al-Au-Hf Au0.84 HfAl1.16 MgZn2,hP12,194 P63 /mmc 0.52992,0.52992,0.85003,90,90,120 Friauf-Laves phase - 12.06 X 57901
Al-Au-Hf Au1.18 HfAl0.82 Fe2P,hP9,189 P-62m 0.67671,0.67671,0.40881,90,90,120 Fe2P family - 13.31 X 57901
Al-Au-Hf Au2HfAl Cu2MnAl,cF16,225 Fm-3m 0.6555,0.6555,0.6555,90,90,90 b.c.c. family - 14.14 X 9083
Al-Au-Ho Au2.63 Ho3 Al8.37 La3Al11,oI28,71 Immm 0.42576,0.99646,1.25123,90,90,90 - - 7.75 X 57898
Al-Au-Ho Au3HoAl7 ScRh3Si7,hR66,167 R-3c 0.80056,0.80056,2.0909,90,90,120 - gray silver 8.11 X 41868
Al-Au-In Au0.92 Al0.04 In0.04 Cu,cF4,225 Fm-3m 0.40837,0.40837,0.40837,90,90,90 close-packed structure - 18.23 X 11635
Al-Au-La AuLaAl TiNiSi,oP12,62 Pnma 0.7658,0.462,0.7825,90,90,90 AlB2 family - 8.71 A 30889
Al-Au-Li LiAuAl BeZrSi,hP6,194 P63 /mmc 0.4598,0.4598,1.2764,90,90,120 AlB2 family violet 3.28 X 23551
Al-Au-Lu Au3LuAl7 ScRh3Si7,hR66,167 R-3c 0.79906,0.79906,2.0913,90,90,120 - gray silver 8.23 X 41868
Al-Au-Mn Au2MnAl Cu2MnAl,cF16,225 Fm-3m 0.6357,0.6357,0.6357,90,90,90 b.c.c. family - 12.30 X 20294
Al-Au-Nd AuNdAl TiNiSi,oP12,62 Pnma 0.7432,0.4535,0.776,90,90,90 AlB2 family - 9.35 A 30889
Al-Au-Nd Au3NdAl7 ScRh3Si7,hR66,167 R-3c 0.80892,0.80892,2.1044,90,90,120 - gray silver 7.72 X 41868
Al-Au-Pr Au3PrAl7 ScRh3Si7,hR66,167 R-3c 0.80922,0.80922,2.1066,90,90,120 - gray silver 7.68 X 41868
Al-Au-Sc Au2ScAl Cu2MnAl,cF16,225 Fm-3m 0.6535,0.6535,0.6535,90,90,90 b.c.c. family - 11.09 X 20154
Al-Au-Sm Au3SmAl7 ScRh3Si7,hR66,167 R-3c 0.8056,0.8056,2.0974,90,90,120 - gray silver 7.86 X 41868
Al-Au-Tb Au2 Tb3 Al9 Au2Dy3 Al9,oI36,71 Immm 0.4276,0.997,1.2583,90,90,90 - - 6.89 A 32744
Al-Au-Tb Au3 TbAl7 ScRh3Si7,hR66,167 R-3c 0.80333,0.80333,2.09645,90,90,120 - gray silver 7.98 X 41868
Al-Au-Ti AuTiAl BeZrSi,hP6,194 P63 /mmc 0.44075,0.44075,0.5829,90,90,120 AlB2 family - 9.21 X 20230
Al-Au-Ti AuTi0.5 Al0.5 CsCl,cP2,221 Pm-3m 0.3198,0.3198,0.3198,90,90,90 b.c.c. family - 11.90 X 20230
Al-Au-Ti Au0.36 TiAl2.64 Cu3Au,cP4,221 Pm-3m 0.3975,0.3975,0.3975,90,90,90 close-packed structure - 5.02 X 27284
Al-Au-Ti Au2 TiAl Cu2MnAl,cF16,225 Fm-3m 0.64,0.64,0.64,90,90,90 b.c.c. family - 11.88 X 9083
Al-Au-Tm Au2.07 Tm3 Al8.93 La3Al11,oI28,71 Immm 0.42387,0.99539,1.24101,90,90,90 - - 7.33 X 57898
Al-Au-Tm Au3 TmAl7 ScRh3Si7,hR66,167 R-3c 0.79982,0.79982,2.0922,90,90,120 - gray silver 8.16 X 41868
Al-Au-U Au2UAl YPd2Si,oP16,62 Pnma 0.7239,0.7683,0.573,90,90,90 - - 13.73 A 26473
Al-Au-V Au0.65 V3Al0.35 Cr3Si,cP8,223 Pm-3n 0.48615,0.48615,0.48615,90,90,90 Frank-Kasper phase - 8.39 X 5616
Al-Au-Y Au2.27 Y3Al8.73 La3Al11,oI28,71 Immm 0.42702,0.99883,1.25674,90,90,90 - - 5.88 X 57898
Al-Au-Y Au3.06 YAl6.94 ScRh3Si7,hR66,167 R-3c 0.80224,0.80224,2.09708,90,90,120 - - 7.49 X 57898
Al-Au-Yb AuYbAl TiNiSi,oP12,62 Pnma 0.721,0.4488,0.7732,90,90,90 AlB2 family - 10.54 X 28218
Al-Au-Yb Au0.8 YbAl3.2 CeAl2Ga2,tI10,139 I4/mmm 0.4173,0.4173,1.1426,90,90,90 - gray silver 6.96 X 28217
Al-Au-Yb Au0.95 YbAl3.05 BaAl4,tI10,139 I4/mmm 0.41823,0.41823,1.13927,90,90,90 - - 7.37 X 57898
Al-Au-Yb Au21.9 Yb6 Al15.0 Au21.9 Yb6 Al15.0 ,cI216,204 Im-3 1.45,1.45,1.45,90,90,90 - - 12.54 X 57100
Al-Au-Yb Au3 YbAl7 ScRh3Si7,hR66,167 R-3c 0.80272,0.80272,2.1111,90,90,120 - gray silver 8.06 X 41868
Al-Au-Zr AuZr0.5 Al0.5 CsCl,cP2,221 Pm-3m 0.3281,0.3281,0.3281,90,90,90 b.c.c. family - 12.04 X 7096
Al-Au-Zr AuZr1.5 Al0.5 Ti2Ni,cF96,227 Fd-3m 1.227,1.227,1.227,90,90,90 - - 9.99 A 2740
Al-Au-Zr Au0.154 ZrAl1.846 MgCu2,cF24,227 Fd-3m 0.75036,0.75036,0.75036,90,90,90 Friauf-Laves phase - 5.39 X 48559
Al-Au-Zr Au0.505 ZrAl2.495 Cu3Au,cP4,221 Pm-3m 0.40982,0.40982,0.40982,90,90,90 close-packed structure - 6.22 X 48559
Handbook of Inorganic Substances – Edition 2015 : Data 197

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Au-Zr Au0.85 ZrAl1.15 MgZn2,hP12,194 P63/mmc 0.53443,0.53443,0.85578,90,90,120 Friauf-Laves phase - 9.09 X 49532
Al-Au-Zr Au2ZrAl Cu2MnAl,cF16,225 Fm-3m 0.6563,0.6563,0.6563,90,90,90 b.c.c. family - 12.03 X 7096
Al-B-Be BeAlB MgAgAs,cF12,216 F-43m 0.4952,0.4952,0.4952,90,90,90 - - 2.56 X 1776
Al-B-Be Be0.8 Al0.9 B24.2 (Be0.03 B0.97 )24Al0.9 B,tP54,134 P42/nnm 0.882,0.882,0.508,90,90,90 - - 2.46 X 7057
Al-B-Be Be0.8 Al1.1 B22 Be0.8 Al1.1 B22,tP236,92 P41212 1.0168,1.0168,1.4262,90,90,90 - red dark 2.48 X 13442
Al-B-Be Be1.11 Al0.07 B3.38 Be1.11 Al0.07 B3.38 ,hP117,191 P6/mmm 0.98,0.98,0.9532,90,90,120 - - 2.43 X 9414
Al-B-Be Be2Al2B44 Be1.3 Al2B44,tP212,92 P41212 1.0171,1.0171,1.4233,90,90,90 - - 2.47 A 24501
Al-B-C AlB24C4 AlB24 C4,oS80,63 Cmcm 0.569,0.888,0.91,90,90,90 - black 2.42 X 4366
Al-B-C Al0.3 B13.3 C1.3 Al0.33 B12.67 (B0.33 C0.67)2,hR63,166 R-3m 0.5642,0.5642,1.2367,90,90,120 - - 2.45 X 5007
Al-B-C Al3BC Al3BC,hP12,194 P63/mmc 0.3484,0.3484,1.15202,90,90,120 - black blue 2.85 X 33146
Al-B-C Al3BC3 rt Al3BC3,hP44,165 P-3c1 0.59,0.59,1.59,90,90,120 - yellow 2.66 X 31301
Al-B-C Al3B48C2 orth *,oI*,46 Ima2 1.239,1.0136,1.2637,90,90,90 - - - N 37726
Al-B-C Al3B48C2 tet *,tP53,* - 0.882,0.882,0.509,90,90,90 - amber 2.62 N 2214
Al-B-C Al4B0.6 C2.4 Al4C3,hR21,166 R-3m 0.3337,0.3337,2.499,90,90,120 - - 2.96 A 33889
Al-B-C Al4B1.3 C4 *,hP*,* - 0.59,0.59,1.59,90,90,120 - yellow - N 2214
Al-B-Ca CaAl1.8 B0.2 MgCu2,cF24,227 Fd-3m 0.80349,0.80349,0.80349,90,90,90 Friauf-Laves phase - 2.33 X 30315
Al-B-Co Co20.9 Al2.1 B6 Mg3 Ni20B6,cF116,225 Fm-3m 1.04817,1.04817,1.04817,90,90,90 - - 7.81 X 52971
Al-B-Cr Cr0.95 Al0.05 B2 AlB2 ,hP3,191 P6/mmm 0.2992,0.2992,0.3106,90,90,120 AlB2 family - 4.99 X 7404
Al-B-Cr Cr2AlB2 Mn2 AlB2,oS10,65 Cmmm 0.2937,1.107,0.2971,90,90,90 - - 5.25 X 7404
Al-B-Cr Cr3AlB4 Cr3AlB4,oP8,47 Pmmm 0.2952,0.2989,0.8091,90,90,90 - - 5.26 X 6639
Al-B-Cu Cu0.788 AlB25 Cu0.79 AlB25,tP58,118 P-4n2 0.9002,0.9002,0.5069,90,90,90 - - 2.81 X 18074
Al-B-Cu Cu2Al2.7 B104 Cu2Al2.7 B104 ,hR339,166 R-3m 1.099,1.099,2.398,90,90,120 β-boron family blue gray 2.63 X 5314
Al-B-Dy DyAl3B0.5 *,hR*,166 R-3m 0.6149,0.6149,2.109,90,90,120 - - 5.39 N 24044
Al-B-Dy Dy0.5 Al0.5 B7 MgB7,oI64,74 Imma 0.5846,1.042,0.8198,90,90,90 - red dark 4.53 A 22767
Al-B-Dy Dy0.63 Al0.74 B14 LiAlB14,oI64,74 Imma 0.5846,1.042,0.8198,90,90,90 - gray 3.64 A 21201
Al-B-Er ErAlB4 ht ThMoB4,oS24,65 Cmmm 0.73163,0.9334,0.35301,90,90,90 - - 6.54 A 50682
Al-B-Er ErAlB4 rt YCrB4,oP24,55 Pbam 0.59955,1.1487,0.35284,90,90,90 - - 6.49 A 29326
Al-B-Er Er0.62 Al0.73 B14 MgAlB14,oI68,74 Imma 0.582,1.0395,0.81825,90,90,90 - red dark 3.69 X 26156
Al-B-Fe Fe2AlB2 Mn2 AlB2,oS10,65 Cmmm 0.29233,1.10337,0.28703,90,90,90 - - 5.75 X 4378
Al-B-Fe Fe3AlB CaTiO3,cP5,221 Pm-3m 0.384,0.384,0.384,90,90,90 perovskite family - 6.02 X 51313
Al-B-H Al[BH4]3 lt Al[BH4]3,mS64,15 C12/c1 2.2834,0.6176,2.2423,90,111.67,90 - - 0.65 X 48693
Al-B-H Al[BH4]3 rt Al[BH4]3,oP16,33 Pna21 1.8649,0.6488,0.6389,90,90,90 - - 0.61 X 48693
Al-B-Hf Hf6Al7B0.7 W6Fe7,hR39,166 R-3m 0.53686,0.53686,2.91592,90,90,120 Frank-Kasper phase - 8.67 F 2303
Al-B-Ho HoAlB4 YCrB4,oP24,55 Pbam 0.59283,1.1553,0.35306,90,90,90 - - 6.46 A 29326
Al-B-Ho HoAl3B0.5 *,hR36,166 R-3m 0.6132,0.6132,2.0986,90,90,120 - - 5.50 P 24044
Al-B-Ho Ho0.63 Al0.74 B14 LiAlB14,oI64,74 Imma 0.5816,1.0399,0.8182,90,90,90 - red dark 3.69 X 21201
Al-B-Li LiAlB14 LiAlB14,oI64,74 Imma 0.58469,1.03542,0.81429,90,90,90 - - 2.50 X 14297
Al-B-Lu LuAlB4 orth1 YCrB4,oP24,55 Pbam 0.5905,1.1444,0.351,90,90,90 - - 6.87 X 48184
Al-B-Lu LuAlB4 orth2 ThMoB4,oS24,65 Cmmm 0.7289,0.9286,0.3504,90,90,90 - - 6.87 X 48184
Al-B-Lu Lu0.63 Al0.74 B14 LiAlB14,oI64,74 Imma 0.5867,1.0364,0.8157,90,90,90 - red dark 3.77 A 21201
Al-B-Mg MgAlB4 rt MgAlB4,hP6,191 P6/mmm 0.30444,0.30444,0.67125,90,90,120 AlB2 family - 2.91 X 40707
Al-B-Mg Mg0.79 Al0.80 B14 rt MgAlB14,oI68,74 Imma 0.5848,1.0312,0.8112,90,90,90 - black 2.61 X 16159
Al-B-Mg Mg0.956 Al0.044 B2 AlB2 ,hP3,191 P6/mmm 0.3082,0.3082,0.3494,90,90,120 AlB2 family - 2.66 X 45466
Al-B-Mn Mn2 AlB2 Mn2 AlB2,oS10,65 Cmmm 0.292,1.108,0.289,90,90,90 - gray silver 5.63 X 3274
Al-B-Mn Mn5 AlB11 *,mP*,11 P121/m1 0.295,0.4,2.88358,90,90.298,90 - - - N 7404
Al-B-Mo MoAlB MoAlB,oS12,63 Cmcm 0.3212,1.3985,0.3102,90,90,90 - black gray 6.37 X 3197
Al-B-Mo Mo0.9 Al0.1 B TlI,oS8,63 Cmcm 0.3163,0.8475,0.3082,90,90,90 CrB(TlI)-FeB - 8.03 A 2745
Al-B-N Al0.93 B1.44 N0.56 AlB2 ,hP3,191 P6/mmm 0.3011,0.3011,0.327,90,90,120 AlB2 family - 3.14 X 48278
Al-B-Na NaAlB14 LiAlB14,oI64,74 Imma 0.5844,1.0465,0.8231,90,90,90 - black 2.66 X 44873
Al-B-Nb Nb0.67 Al0.33 B2 AlB2 ,hP3,191 P6/mmm 0.3065,0.3065,0.3336,90,90,120 AlB2 family - 5.68 X 2745
Al-B-Ni Ni12 AlB8 Ni12 AlB8,oS252,64 Cmce 1.0527,1.4527,1.4554,90,90,90 - black 7.32 X 54934
Al-B-Ni Ni20.51 Al2.49 B6 Mg3 Ni20B6,cF116,225 Fm-3m 1.04859,1.04859,1.04859,90,90,90 - - 7.70 X 34027
Al-B-Ni Ni3.0304 Al0.96 B0.0096 Cu3Au,cP4,221 Pm-3m 0.3578,0.3578,0.3578,90,90,90 close-packed structure - 7.39 X 48369
Al-B-Ni Ni3.0304 Al0.96 B0.0096 TiAl3,tI8,139 I4/mmm 0.3567,0.3567,0.7188,90,90,90 close-packed structure - 7.40 X 48369
Al-B-Ni Ni8AlB11 *,m**,* - 1.63,1.093,3.33187,90,94.974,90 - - - N 7406
Al-B-O Al[BO3] hp Ca[CO3],hR30,167 R-3c 0.44638,0.44638,1.3745,90,90,120 - colorless 3.60 X 10463
Al-B-O Al0.92 B1.94 O0.06 AlB2 ,hP3,191 P6/mmm 0.30098,0.30098,0.32753,90,90,120 AlB2 family - 3.02 X 48278
Al-B-O Al2.5 B0.5 O4.5 rt Al(Al0.7 Si0.3)2O4.8 ,oP24,55 Pbam 0.7621,0.7621,0.2838,90,90,90 - - 2.92 X 26023
Al-B-O Al4B1.5 [BO3]0.5 O7.5 Al4B1.5 [BO3]0.5 O7.5 ,mS124,12 C12/m1 1.48056,0.55413,1.50531,90,90.913,90 - colorless 2.94 X 49981
Al-B-O Al4B6O15 rt Al4B6O15,hR75,146 R3 1.1434,1.1434,0.64831,90,90,120 - white 2.80 X 42772
Al-B-O Al4.973 B1.027 O9 rt Al5BO9,oS60,36 Cmc21 0.56686,1.5006,0.76892,90,90,90 - whitish 2.94 X 56937
Al-B-Re Re3Al2B Mn3 Ni2Si,cF96,227 Fd-3m 1.0835,1.0835,1.0835,90,90,90 - - 13.02 X 6704
Al-B-Ru Ru3Al2B2 Ru3Al2B2,oS14,65 Cmmm 0.2967,1.7036,0.2965,90,90,90 - - 8.39 X 19729
Al-B-Ru Ru4Al3B2 Ru4Al3B2,tP18,123 P4/mmm 0.8504,0.8504,0.2939,90,90,90 - - 7.92 X 19729
Al-B-Sc Sc2Al0.9 B6 Y2ReB6,oP36,55 Pbam 0.8937,1.1226,0.34333,90,90,90 - gray silver 3.45 X 37711
Al-B-Si Al1.5 Si0.5 B24 B25C,tP68,134 P42/nnm 0.891,0.891,0.505,90,90,90 - - 2.60 A 4650
Al-B-Ta Ta0.75 Al0.25 B2 AlB2 ,hP3,191 P6/mmm 0.3059,0.3059,0.3295,90,90,120 AlB2 family - 10.20 X 2745
Al-B-Ta Ta5Al3B0.5 CuHf5Sn3,hP18,193 P63/mcm 0.7789,0.7789,0.5305,90,90,120 AlB2 family - 11.81 A 2314
Al-B-Tb TbAlB14 LiAlB14,oI64,74 Imma 0.5836,1.0419,0.8189,90,90,90 - red dark 4.50 A 22767
Al-B-Tm TmAlB4 ht ThMoB4,oS24,65 Cmmm 0.73057,0.93163,0.35214,90,90,90 - - 6.63 A 50682
Al-B-Tm TmAlB4 rt TmAlB4,oP32,55 Pbam 0.59225,1.14784,0.35224,90,90,90 - - 6.63 X 49361
Al-B-Tm Tm0.52 Al0.58 B14 MgAlB14,oI68,74 Imma 0.58212,1.03837,0.81762,90,90,90 - - 3.43 X 27374
Al-B-Y Y0.62 Al0.71 B14 MgAlB14,oI68,74 Imma 0.58212,1.0413,0.81947,90,90,90 - - 3.02 X 26156
Al-B-Yb YbAlB4 orth1 YCrB4,oP24,55 Pbam 0.5922,1.1473,0.3506,90,90,90 - - 6.78 X 48184
Al-B-Yb YbAlB4 orth2 ThMoB4,oS24,65 Cmmm 0.7308,0.9315,0.3498,90,90,90 - - 6.79 X 48184
Al-B-Yb Yb0.63 Al0.74 B14 LiAlB14,oI64,74 Imma 0.586,1.0439,0.8222,90,90,90 - red dark 3.70 A 21201
Al-B-Yb Yb2 AlB6 Y2ReB6,oP36,55 Pbam 0.9127,1.146,0.3584,90,90,90 - - 7.76 X 13253
Al-Ba-Ca Ba19.1 Ca1.9 Al40 Ba21 Al40,hP61,157 P31m 1.0485,1.0485,1.7183,90,90,120 - gray silver 3.84 X 53499
198 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ba-Ca Ba2.4 Ca2.6 Al9 Sr5Al9,hR42,166 R-3m 0.5822,0.5822,3.5702,90,90,120 - gray silver 3.22 X 53499
Al-Ba-Co BaCo2Al9 BaFe2Al9,hP12,191 P6/mmm 0.791,0.791,0.394,90,90,120 - gray 3.87 A 9094
Al-Ba-Cu BaCu0.2 Al3.8 CeAl2Ga2,tI10,139 I4/mmm 0.4511,0.4511,1.1357,90,90,90 - - 3.63 X 23588
Al-Ba-Cu BaCu0.38 Al0.62 Ba(Cu0.38 Al0.62 ),hR30,160 R3m 0.614,0.614,3.7281,90,90,120 - - 3.65 X 24862
Al-Ba-Cu BaCu5.1 Al7.9 NaZn13,cF112,226 Fm-3c 1.2205,1.2205,1.2205,90,90,90 - - 4.93 X 35768
Al-Ba-Cu Ba6Cu6.8 Al7.2 Sr6Cu5(Cu0.4 Al0.6)4Al5,tI80,140 I4/mcm 0.8533,0.8533,2.7249,90,90,90 - - 4.86 X 20954
Al-Ba-D BaAlD5 BaAlH5,oP28,33 Pna21 0.9194,0.70403,0.51061,90,90,90 - gray dark 3.50 X 40081
Al-Ba-D Ba2AlD7 Ba2AlH7,mS80,15 C12/c1 1.42336,1.0237,0.8509,90,114.601,90 - - 3.72 X 41731
Al-Ba-F BaAlF5 ht1 BaAlF5,mP56,14 P121/c1 0.51517,1.95666,0.89637,90,122.619,90 - - 4.53 X 23795
Al-Ba-F BaAlF5 ht2 BaAlF5,mP28,4 P1211 0.52584,0.97298,0.73701,90,90.875,90 - - 4.57 X 23795
Al-Ba-F BaAlF5 rt BaGaF5,oP28,19 P212121 0.493,0.5604,1.371,90,90,90 - colorless 4.55 X 15696
Al-Ba-F BaAlF5 tricl BaAlF5,aP44,2 P-1 0.52146,0.73933,1.4946,79.365,88.525,88.183 - colorless 4.57 X 39376
Al-Ba-F Ba3AlF9 orth1 Ba3AlF9,oP104,62 Pnma 1.9706,0.5599,1.5173,90,90,90 - colorless 4.84 X 23333
Al-Ba-F Ba3AlF9 orth2 Ba3AlF9,oP52,62 Pnma 1.0063,0.5567,1.488,90,90,90 - - 4.86 X 24601
Al-Ba-F Ba3AlF9 orth3 Ba3AlF9,oP104,30 Pnc2 0.75318,1.48674,1.45732,90,90,90 - - 4.97 X 27666
Al-Ba-F Ba3AlF9 tet *,tI*,* - 2.1812,2.1812,1.7539,90,90,90 - - - N 26822
Al-Ba-F Ba3Al2F12 Ba3Al2F12 ,oP68,58 Pnnm 0.9885,1.0203,0.9522,90,90,90 - colorless 4.80 X 44031
Al-Ba-F Ba5AlF13 rt *,cF304,227 Fd-3m 1.7258,1.7258,1.7258,90,90,90 - - 4.97 N 26822
Al-Ba-F Ba5Al3F19 ht *,tP216,* - 2.0427,2.0427,0.7492,90,90,90 - - 4.80 N 26822
Al-Ba-F Ba5Al3F19 rt Al3Pb5F19 ,tI108,87 I4/m 1.4576,1.4576,0.746,90,90,90 - - 4.73 X 56317
Al-Ba-Fe BaFe2Al9 BaFe2Al9,hP12,191 P6/mmm 0.804,0.804,0.389,90,90,120 - gray 3.75 X 9094
Al-Ba-Ga BaAl0.24 Ga1.76 AlB2,hP3,191 P6/mmm 0.4438,0.4438,0.5085,90,90,120 AlB2 family gray silver 5.10 X 49752
Al-Ba-Ga BaAl0.5 Ga1.5 KHg2,oI12,74 Imma 0.4885,0.82,0.7759,90,90,90 AlB2 family gray silver 5.46 X 49752
Al-Ba-Ga BaAl2Ga2 CeAl2Ga2,tI10,139 I4/mmm 0.455,0.455,1.0965,90,90,90 - - 4.84 A 4888
Al-Ba-Ga Ba3Al3Ga2 Ba3Al3Ga2 ,hP16,194 P63 /mmc 0.5989,0.5989,1.456,90,90,120 - gray silver 4.64 X 47577
Al-Ba-Ga Ba5Al4.5 Ga4.8 Ba5Al4.5 Ga4.8 ,hR48,166 R-3m 0.6077,0.6077,3.6659,90,90,120 - gray 4.86 X 25776
Al-Ba-Ga Ba5Al6.67 Ga2.66 *,hP*,157 P31m 1.05,1.05,3.6545,90,90,120 - - - N 47636
Al-Ba-Ge BaAlGe LiBaSi,hP3,187 P-6m2 0.4349,0.4349,0.5136,90,90,120 AlB2 family gray silver 4.68 X 49726
Al-Ba-Ge BaAl2Ge2 ht CeAl2Ga2,tI10,139 I4/mmm 0.4185,0.4185,1.34531,90,90,90 - gray 4.74 X 42255
Al-Ba-Ge BaAl2Ge2 rt BaCu2S2,oP20,62 Pnma 1.02105,0.42755,1.0987,90,90,90 - gray 4.66 X 42255
Al-Ba-Ge BaAl3.75 Ge 0.25 BaAl4,tI10,139 I4/mmm 0.4588,0.4588,1.1268,90,90,90 - - 3.59 A 20675
Al-Ba-Ge Ba10Al3Ge 7 Ba10Al3Ge7,hP40,193 P63 /mcm 0.9749,0.9749,1.647,90,90,120 - gray silver 4.81 X 11116
Al-Ba-Ge Ba21Al39.2 Ge0.8 Ba21Al40,hP61,157 P31m 1.0531,1.0531,1.7184,90,90,120 - gray silver 4.02 X 53499
Al-Ba-Ge Ba3Al2Ge 2 Ba3Al2Ge2 ,oI14,71 Immm 0.434,0.509,1.982,90,90,90 - white silver4.64 X 10301
Al-Ba-Ge Ba4Al8Ge 15 Ba4Al3(Al0.25 Ge0.75)20,cP54,223 Pm-3n 1.08489,1.08489,1.08489,90,90,90 - - 4.82 X 48223
Al-Ba-Ge Ba5Al2Ge 7 Ba5Al2Ge7 ,mS56,12 C12/m1 0.8598,1.0315,1.8478,90,103.23,90 - gray silver 5.20 X 49726
Al-Ba-Ge Ba6Al3Ge 22 K6Sn25,cP124,213 P4132 1.45597,1.45597,1.45597,90,90,90 clathrate - 5.38 X 48714
Al-Ba-Ge Ba7Al4Ge 9 Ba7Al4Ge9 ,oF80,42 Fmm2 1.0327,2.559,0.8621,90,90,90 - gray silver 5.02 X 49726
Al-Ba-H BaAlH5 BaAlH5,oP28,33 Pna21 0.9187,0.7047,0.51238,90,90,90 - - 3.39 A 41731
Al-Ba-In BaAl0.5 In1.5 KHg2,oI12,74 Imma 0.5153,0.8465,0.838,90,90,90 AlB2 family gray silver 5.87 X 49752
Al-Ba-In Ba21Al35.3 In4.7 Ba21Al40,hP61,157 P31m 1.0611,1.0611,1.7381,90,90,120 - gray silver 4.29 X 53499
Al-Ba-In Ba3Al4.7 In0.3 Ba3Al5,hP16,194 P63 /mmc 0.6073,0.6073,1.4676,90,90,120 - - 4.06 A 51659
Al-Ba-In Ba5Al5.1 In0.9 Ba5Al5Sn,hP11,187 P-6m2 0.6086,0.6086,1.1168,90,90,120 - gray silver 4.30 X 51659
Al-Ba-In Ba7Al10.04 In2.29 *,hP*,143 P3 1.0611,1.0611,1.7381,90,90,120 - - - N 47636
Al-Ba-Li Li4.21 Ba2Al4.79 Li3(Li0.40 Al0.60 )3Ba2Al3,hR99,166 R-3m 0.9946,0.9946,2.6992,90,90,120 - gray 2.80 X 31681
Al-Ba-Mg BaMg0.85 Al1.15 MgNi2,hP24,194 P63 /mmc 0.62889,0.62889,2.0605,90,90,120 Friauf-Laves phase gray silver 3.56 X 42995
Al-Ba-N Ba3Al2N4 Sr3Al2N4,oP36,52 Pnna 0.6179,1.0052,1.023,90,90,90 - colorless 5.46 X 36787
Al-Ba-Nd Ba0.15 Nd0.85 Al2 MgCu2,cF24,227 Fd-3m 0.798,0.798,0.798,90,90,90 Friauf-Laves phase - 5.15 X 9810
Al-Ba-Ni BaNi2Al9 BaFe2Al9,hP12,191 P6/mmm 0.793,0.793,0.396,90,90,120 - gray 3.83 X 9094
Al-Ba-O BaAl2O4 ht BaAl2O4,hP14,182 P6322 0.5227,0.5227,0.8802,90,90,120 - - 4.07 X 2560
Al-Ba-O BaAl2O4 rt BaAl2O4,hP56,173 P63 1.04508,1.04508,0.87907,90,90,120 - - 4.08 X 47113
Al-Ba-O BaAl4O7 ht BaAl4O7,oP48,31 Pmn21 1.27735,0.55485,0.9193,90,90,90 - - 3.64 X 57694
Al-Ba-O BaAl4O7 rt BaAl4O7,oP48,26 Pmc21 1.28821,0.49075,1.02357,90,90,90 - - 3.67 X 57694
Al-Ba-O Ba0.79 Al10.9 O17.14 Ba0.79 Al10.9 O17.14 ,hP86,194 P63 /mmc 0.5588,0.5588,2.2769,90,90,120 magnetoplumbite family white 3.65 X 17230
Al-Ba-O Ba17Al3O7 Ba17Al3O7 ,tP108,138 P42 /ncm 1.4808,1.4808,1.8862,90,90,90 - - 4.06 X 29869
Al-Ba-O Ba2.33 Al21.33 O34.33 Ba2.33 Al21.33 O34.33 ,hP113,187 P-6m2 0.57062,0.57062,2.29701,90,90,120 - - 3.70 X 31979
Al-Ba-O Ba3Al2O6 Ba3Al2O6,cP264,198 P213 1.64984,1.64984,1.64984,90,90,90 - - 4.99 X 53377
Al-Ba-O Ba4Al2O7 *,oS208,* - 1.1327,1.1683,2.706,90,90,90 - - - N 20646
Al-Ba-O Ba7Al2O10 *,oP19,62 Pnma 1.0102,0.7746,0.5788,90,90,90 - - - N 20646
Al-Ba-P Ba3Al2P 4 Tl3Fe2S4,oP36,62 Pnma 0.7254,1.15416,1.1577,90,90,90 - red 4.04 X 58898
Al-Ba-Pb Ba5Al5Pb Ba5Al5Sn,hP11,187 P-6m2 0.6069,0.6069,1.112,90,90,120 - - 4.82 X 47801
Al-Ba-S BaAl2S4 CaB2O4,cP84,205 Pa-3 1.265,1.265,1.265,90,90,90 - white 3.15 X 15431
Al-Ba-S BaAl4S7 BaAl4S7,oP24,31 Pmn21 1.4814,0.6218,0.5891,90,90,90 - - 2.87 X 16537
Al-Ba-Sb Ba14Al0.96 Sb11.04 Ca14AlSb11 ,tI208,142 I41/acd 1.8293,1.8293,2.4222,90,90,90 - black 5.40 X 27799
Al-Ba-Sb Ba3AlSb3 Ba3AlSb3,oS56,64 Cmce 2.1133,0.7194,1.4069,90,90,90 - - 5.00 X 15776
Al-Ba-Se BaAl2Se4 BaAl2Se4,tP30,126 P4/nnc 1.135,1.135,0.619,90,90,90 - colorless 4.22 X 14709
Al-Ba-Se BaAl4Se7 BaGa4Se7,mP24,7 P1c1 0.7556,0.6452,1.45741,90,121.23,90 - yellow 4.36 X 56091
Al-Ba-Se Ba5Al2Se8 Ba5Ga2S8,oS120,64 Cmce 2.34408,1.25091,1.22497,90,90,90 - - 5.08 A 56495
Al-Ba-Si BaAlSi AlB2,hP3,191 P6/mmm 0.43001,0.43001,0.51438,90,90,120 AlB2 family - 3.88 X 53230
Al-Ba-Si BaAl2Si2 hp CeAl2Ga2,tI10,139 I4/mmm 0.4231,0.4231,1.2601,90,90,90 - - 3.64 X 42914
Al-Ba-Si BaAl2Si2 BaCu2S2,oP20,62 Pnma 1.00807,0.4227,1.0874,90,90,90 - - 3.55 X 48432
Al-Ba-Si Ba3Al2Si2 Ba3Al2Ge2 ,oI14,71 Immm 0.4204,0.5081,1.957,90,90,90 - - 4.15 X 11102
Al-Ba-Si Ba4Al5Si18 Na4Si23,cP54,223 Pm-3n 1.05148,1.05148,1.05148,90,90,90 clathrate gray silver 3.40 X 58303
Al-Ba-Sn BaAlSn AlB2,hP3,191 P6/mmm 0.46331,0.46331,0.51408,90,90,120 AlB2 family - 4.92 X 53230
Al-Ba-Sn Ba3Al2Sn2 Ba3Al2Ge2 ,oI14,71 Immm 0.4594,0.523,2.0634,90,90,90 - gray silver 4.71 X 12881
Al-Ba-Sn Ba5Al5Sn Ba5Al5Sn,hP11,187 P-6m2 0.60505,0.60505,1.109,90,90,120 - - 4.44 X 47801
Al-Ba-Sn Ba9Al2.2 Sn5.8 Sr9Al2(Al0.2 Sn0.8 )Sn5,tP68,127 P4/mbm 1.3786,1.3786,1.3054,90,90,90 - gray silver 5.31 X 49577
Al-Ba-Sr Ba1.1 Sr3.9 Al9 Sr5Al9,hR42,166 R-3m 0.59088,0.59088,3.5852,90,90,120 - gray silver 3.38 X 53499
Handbook of Inorganic Substances – Edition 2015 : Data 199

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ba-Sr Ba16.7 Sr4.3 Al40 Ba21 Al40,hP61,157 P31m 1.04864,1.04864,1.7131,90,90,120 - gray silver 3.82 X 53499
Al-Ba-Sr Ba3.9 Sr3.1 Al13 Ba7Al13,hP20,164 P-3m1 0.5999,0.5999,1.6993,90,90,120 - gray silver 3.63 A 53499
Al-Ba-Te BaAl2Te4 tet1 BaAl2Te4,tP14,125 P4/nbm 0.8516,0.8516,0.6713,90,90,90 - - 4.79 X 15552
Al-Ba-Te Ba0.5 AlTe2 tet2 Sr0.5 AlTe2,tI16,140 I4/mcm 0.85,0.85,0.672,90,90,90 - red 4.80 X 7074
Al-Ba-Te Ba7Al6Te16 *,t**,* - 3.424,3.424,0.67,90,90,90 - - - N 7074
Al-Ba-Zn Ba14 Zn4.76 Al22.24 Ba14 (Zn0.53 Al0.47 )9Al18,mS82,12 C12/m1 3.61007,0.60834,1.0474,90,106.05,90 - gray silver 4.26 X 41871
Al-Be-Ce Be1.2 CeAl2.8 CeAl2Ga2,tI10,139 I4/mmm 0.418,0.418,1.057,90,90,90 - - 4.07 X 2805
Al-Be-Cr Be2Cr0.5 Al0.5 cub MgCu2,cF24,227 Fd-3m 0.612,0.612,0.612,90,90,90 Friauf-Laves phase - 3.33 X 1939
Al-Be-Cr Be2Cr0.5 Al0.5 hex MgZn2,hP12,194 P63/mmc 0.436,0.436,0.71,90,90,120 Friauf-Laves phase - 3.27 A 1939
Al-Be-Cu Be2Cu0.5 Al0.5 MgCu2,cF24,227 Fd-3m 0.6232,0.6232,0.6232,90,90,90 Friauf-Laves phase - 3.47 X 3667
Al-Be-Fe Be2.3 FeAl2 Be2.3 FeAl2,mS12,12 C12/m1 0.7718,0.44554,0.45424,90,124.53,90 Friauf-Laves phase - 3.37 X 660
Al-Be-La BeLaAl3 BaAl4,tI10,139 I4/mmm 0.428,0.428,1.058,90,90,90 - - 3.92 A 4676
Al-Be-Mn Be2Mn0.5 Al0.5 MgCu2,cF24,227 Fd-3m 0.611,0.611,0.611,90,90,90 Friauf-Laves phase - 3.44 X 1939
Al-Be-Nb Be0.05 Nb3Al0.95 Cr3Si,cP8,223 Pm-3n 0.5197,0.5197,0.5197,90,90,90 Frank-Kasper phase - 7.21 X 7632
Al-Be-Ni Be2NiAl *,c**,* - 0.6227,0.6227,0.6227,90,90,90 - - - N 19414
Al-Be-Ni Be2Ni0.5 Al0.5 MgCu2,cF24,227 Fd-3m 0.6011,0.6011,0.6011,90,90,90 Friauf-Laves phase - 3.72 X 19414
Al-Be-O BeAl2O4 MgAl2S4,oP28,62 Pnma 0.9396,0.5471,0.4424,90,90,90 chrysoberyl lilac 3.71 X 20568
Al-Be-O BeAl6O10 BeAl6O10,mP136,14 P121/c1 0.8924,1.38123,0.95483,90,90.026,90 - - 3.74 X 40305
Al-Bi-Br AlBiBr6 AlBiBr6,aP16,2 P-1 0.7693,0.7706,0.9739,104.19,102.65,99.46 - yellow 4.47 X 45762
Al-Bi-Br Al3Bi5Br12 lt Al3Bi5Cl12,hR120,167 R-3c 1.2415,1.2415,3.041,90,90,120 - - 5.12 X 49579
Al-Bi-Br Al3Bi5Br12 rt Al3Bi5Br12,cF1080,226 Fm-3c 1.7622,1.7622,1.7622,90,90,90 - red dark 5.06 X 49579
Al-Bi-Ca Ca5Al2Bi6 Ca5Al2Bi6,oP26,55 Pbam 0.7582,2.3333,0.4529,90,90,90 - - 6.25 X 17725
Al-Bi-Cl AlBiCl6 AlBiCl6,mP32,14 P121/c1 0.77322,1.19565,1.03535,90,95.09,90 - colorless 3.13 X 45762
Al-Bi-Cl AlBi4Cl4 AlBi4Cl4,hP124,176 P63/m 1.7854,1.7854,1.2953,90,90,120 - black 5.60 X 31486
Al-Bi-Cl Al3Bi5Cl12 Al3Bi5Cl12,hR120,167 R-3c 1.186,1.186,3.01,90,90,120 - black 4.22 X 19069
Al-Bi-Gd GdAl1.60 Bi0.40 MgCu2,cF24,227 Fd-3m 0.7898,0.7898,0.7898,90,90,90 Friauf-Laves phase - 7.66 X 23616
Al-Bi-I Al3Bi5I12 Al3Bi5I12,oP80,62 Pnma 2.1436,1.8891,0.81174,90,90,90 - black 5.35 X 49579
Al-Bi-O AlBiO3 hp1 *,hR15,160 R3m 0.53087,0.53087,0.65601,90,90,120 - - 8.84 N 53250
Al-Bi-O AlBiO3 hp2 *,oS*,38 Amm2 0.37373,0.52652,0.52866,90,90,90 - - - N 53250
Al-Bi-O AlBiO3 LiNbO3,hR30,161 R3c 0.53755,0.53755,1.33933,90,90,120 - white 8.44 X 46200
Al-Bi-O AlBi12O20 Bi12.8 O19.2 ,cI66,197 I23 1.01755,1.01755,1.01755,90,90,90 - - 9.00 X 47456
Al-Bi-O Al4Bi2O9 Al4Bi2O9,oP30,55 Pbam 0.77134,0.81139,0.56914,90,90,90 - brown 6.25 X 36295
Al-Bi-Pd Pd2.8 Al0.6 Bi0.6 m BiF3 ,cF16,225 Fm-3m 0.6279,0.6279,0.6279,90,90,90 b.c.c. family - 11.79 X 23068
Al-Bi-Pd Pd3Al0.5 Bi0.5 Cu3Au,cP4,221 Pm-3m 0.395,0.395,0.395,90,90,90 close-packed structure - 11.78 X 5603
Al-Bi-S Al2BiS4 Al2BiS4,tP28,126 P4/nnc 0.7492,0.7492,1.1883,90,90,90 - red ruby 3.90 X 35118
Al-Bi-Se Al2BiSe 4 m Al2BiS4,tP28,126 P4/nnc 0.7764,0.7764,1.2395,90,90,90 - black gray 5.15 X 35118
Al-Br-Cd CdAl2Br8 CdAl2Cl8,mP22,7 P1c1 0.7431,0.6927,1.358,90,92.68,90 - - 3.83 A 20803
Al-Br-Ce CeAl3Br12 LaAl3Br12,hP48,152 P3121 1.0418,1.0418,1.8558,90,90,120 - yellow pale 3.37 A 26819
Al-Br-Cs CsAlBr4 Ba[SO4],oP24,62 Pnma 1.22137,0.75304,0.99293,90,90,90 - - 3.49 X 32731
Al-Br-Cu CuAlBr4 CuAlCl4,tP12,112 P-42c 0.57321,0.57321,1.06046,90,90,90 - colorless 3.91 X 34326
Al-Br-Ga AlGaBr4 KTlBr4,oP24,52 Pnna 0.75601,1.011,1.0106,90,90,90 - - 3.58 A 24177
Al-Br-Gd GdAl3Br12 LaAl3Br12,hP48,152 P3121 1.0388,1.0388,1.8296,90,90,120 - colorless 3.49 A 26819
Al-Br-In AlInBr4 GaInBr4,mP24,13 P12/c1 0.9007,0.739,1.2976,90,106.03,90 - - 3.69 A 24177
Al-Br-K KAlBr4 GaInBr4,mP24,13 P12/c1 0.8801,0.7479,1.3103,90,105.42,90 - - 3.08 A 24177
Al-Br-K KAl2Br7 KAl2Br7,mP40,14 P121/c1 1.06776,1.0822,1.4444,90,123.345,90 - - 3.11 X 7116
Al-Br-La LaAl3Br12 LaAl3Br12,hP48,152 P3121 1.0436,1.0436,1.8642,90,90,120 - colorless 3.34 X 26819
Al-Br-La La10 Al5Br4 La10 Ga5Cl4,tI76,140 I4/mcm 0.82713,0.82713,3.2835,90,90,90 - - 5.45 X 42465
Al-Br-La La4Al5Br2 La4Al5Br2,oS44,65 Cmmm 1.6115,1.7206,0.4328,90,90,90 - golden 4.71 X 42352
Al-Br-La La5Al4Br4 La5Al4Br4,tI52,140 I4/mcm 0.8292,0.8292,2.0122,90,90,90 - gray silver 5.39 X 44018
Al-Br-Na NaAlBr4 NaGaBr4,oP24,62 Pnma 1.4018,0.74567,0.7451,90,90,90 - - 3.15 A 24177
Al-Br-Nd NdAl3Br12 LaAl3Br12,hP48,152 P3121 1.0396,1.0396,1.8441,90,90,120 - violet dark 3.42 X 26819
Al-Br-O AlBrO GaClO,oP12,29 Pca21 0.673,1.002,0.492,90,90,90 - colorless 2.46 A 2033
Al-Br-Pr PrAl3Br12 LaAl3Br12,hP48,152 P3121 1.0408,1.0408,1.8487,90,90,120 - green 3.39 X 26819
Al-Br-Rb RbAlBr4 Ba[SO4],oP24,62 Pnma 1.1649,0.7478,0.9912,90,90,90 - - 3.32 A 24177
Al-Br-Se AlSeBr *,mP120,11 P121/m1 1.697,1.287,1.8731,90,94.,90 - - - N 3448
Al-Br-Se AlSeBr7 AlSCl7,mP18,7 P1c1 0.6707,0.6639,1.4286,90,101.21,90 - yellow 3.54 X 31018
Al-Br-Sm SmAl3Br12 LaAl3Br12,hP48,152 P3121 1.0399,1.0399,1.8368,90,90,120 - yellow 3.45 A 26819
Al-Br-Te Al3Te 3Br Al3Te3I,oP28,62 Pnma 1.0928,0.4078,1.9339,90,90,90 - yellow 4.19 A 24326
Al-Br-Ti TiAl2Br8 ht TiAl2Br8,oP22,34 Pnn2 0.6274,1.2801,0.8676,90,90,90 - green 3.53 X 24029
Al-Br-Ti TiAl2Br8 rt CoAl2Cl8,mS44,15 C12/c1 1.8232,0.8066,1.2441,90,130.997,90 - green light 3.56 A 19726
Al-Br-Tl TlAlBr4 rt GaInBr4,mP24,13 P12/c1 0.8998,0.7399,1.3038,90,106.51,90 - colorless 4.40 X 53503
Al-C-Ce Ce3AlC CaTiO3,cP5,221 Pm-3m 0.5029,0.5029,0.5029,90,90,90 perovskite family - 6.00 X 33965
Al-C-Cl AlC10Cl3 *,hP*,* - 0.246,0.246,1.908,90,90,120 - blue dark - N 709
Al-C-Cl AlC18Cl3 *,hP*,* - 0.246,0.246,1.283,90,90,120 - black gray - N 709
Al-C-Cl AlC50Cl3 *,hP*,* - 0.246,0.246,1.969,90,90,120 - - - N 709
Al-C-Co Co0.84 Al0.16 C0.03 NaCl,cF8,225 Fm-3m 0.35819,0.35819,0.35819,90,90,90 rocksalt family - 7.83 X 52221
Al-C-Co Co3 AlC0.545 CaTiO3,cP5,221 Pm-3m 0.36509,0.36509,0.36509,90,90,90 perovskite family - 7.18 X 52221
Al-C-Cr Cr2AlC Cr2AlC,hP8,194 P63/mmc 0.286,0.286,1.282,90,90,120 - - 5.23 X 1969
Al-C-Cr Cr3Al2C *,hP*,* - 0.247,0.247,0.739,90,90,120 - - - N 2380
Al-C-Dy DyAl3C3 ScAl3C3,hP14,194 P63/mmc 0.3412,0.3412,1.7279,90,90,120 - - 5.33 A 19591
Al-C-Dy Dy3 AlC CaTiO3,cP5,221 Pm-3m 0.486,0.486,0.486,90,90,90 perovskite family - 7.62 X 33965
Al-C-Er ErAl3C3 ScAl3C3,hP14,194 P63/mmc 0.3399,0.3399,1.7145,90,90,120 - - 5.50 A 19591
Al-C-Er Er3AlC CaTiO3,cP5,221 Pm-3m 0.4804,0.4804,0.4804,90,90,90 perovskite family - 8.10 X 33965
Al-C-Fe Fe3AlC CaTiO3,cP5,221 Pm-3m 0.379,0.379,0.379,90,90,90 perovskite family - 6.30 X 26044
Al-C-Gd GdAl3C3 ScAl3C3,hP14,194 P63/mmc 0.3428,0.3428,1.7395,90,90,120 - - 5.14 A 19591
Al-C-Gd Gd3 AlC CaTiO3,cP5,221 Pm-3m 0.4935,0.4935,0.4935,90,90,90 perovskite family - 7.06 X 33965
Al-C-Hf HfAl4C4 HfAl4C4,hP18,164 P-3m1 0.3308,0.3308,2.19,90,90,120 - - 5.35 X 54472
Al-C-Hf Hf2Al3C4 Zr2Al3C4,hP20,194 P63/mmc 0.3319,0.3319,2.209,90,90,120 - - 7.66 A 13850
200 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-C-Hf Hf2Al4C5 *,hR33,166 R-3m 0.3299,0.3299,4.079,90,90,120 - - 6.80 N 54472


Al-C-Hf Hf3Al3C5 Zr3Al3C5,hP22,194 P63 /mmc 0.3316,0.3316,2.742,90,90,120 - - 8.60 X 51343
Al-C-Hf Hf3Al4C6 Hf3Al4C6,hR39,166 R-3m 0.3302,0.3302,4.876,90,90,120 - - 7.74 X 51343
Al-C-Hf Hf5Al3C CuHf5Sn3,hP18,193 P63 /mcm 0.812,0.812,0.5679,90,90,120 AlB2 family - 10.09 A 13850
Al-C-Ho HoAl3C3 ScAl3C3,hP14,194 P63 /mmc 0.3406,0.3406,1.7187,90,90,120 - - 5.42 A 19591
Al-C-Ho Ho3AlC CaTiO3,cP5,221 Pm-3m 0.4826,0.4826,0.4826,90,90,90 perovskite family - 7.89 X 33965
Al-C-La La3AlC CaTiO3,cP5,221 Pm-3m 0.5109,0.5109,0.5109,90,90,90 perovskite family - 5.67 X 33965
Al-C-Lu LuAl3C3 ScAl3C3,hP14,194 P63 /mmc 0.3386,0.3386,1.7085,90,90,120 - - 5.72 A 19591
Al-C-Lu Lu3AlC CaTiO3,cP5,221 Pm-3m 0.4734,0.4734,0.4734,90,90,90 perovskite family - 8.83 X 33965
Al-C-Mg MgAl2C2 hex *,h**,* - 0.34017,0.34017,1.2292,90,90,120 - - - N 34309
Al-C-Mg MgAl2C2 trig Ce2SO2,hP5,164 P-3m1 0.3377,0.3377,0.5817,90,90,120 - - 2.96 X 34309
Al-C-Mn Mn1.074 Al0.871 C0.055 CoO,tI4,139 I4/mmm 0.27687,0.27687,0.35995,90,90,90 rocksalt family - 10.01 X 17070
Al-C-Mn Mn3AlC CaTiO3,cP5,221 Pm-3m 0.38722,0.38722,0.38722,90,90,90 perovskite family - 5.83 X 54645
Al-C-Mo Mo3Al2C Mo3Al2C,cP24,213 P4132 0.686,0.686,0.686,90,90,90 - - 7.28 X 1963
Al-C-N Al[CN]3 Ga[CN]3,cP7,221 Pm-3m 0.5205,0.5205,0.5205,90,90,90 - colorless 1.24 X 39149
Al-C-N Al5C3N Al5C3N-b,hP18,186 P63 mc 0.3281,0.3281,2.158,90,90,120 - - 3.05 X 2904
Al-C-N Al6C3N2 Al6C3N2,hR33,166 R-3m 0.3248,0.3248,4.003,90,90,120 - brown 3.08 X 2904
Al-C-N Al7C3N3 Al7C3N3,hP26,186 P63 mc 0.3226,0.3226,3.17,90,90,120 - brown 3.10 X 2904
Al-C-N Al8C3N4 Al8C3N4,hR45,166 R-3m 0.3211,0.3211,5.508,90,90,120 - brown 3.12 X 2904
Al-C-Nb Nb2AlC Cr2AlC,hP8,194 P63 /mmc 0.3106,0.3106,1.389,90,90,120 - - 6.43 A 13850
Al-C-Nb Nb3Al2C *,hP*,* - 0.267,0.267,0.802,90,90,120 - - - N 2380
Al-C-Nb Nb4AlC3 CsYb3Se4,hP16,194 P63 /mmc 0.31296,0.31296,2.41208,90,90,120 - - 7.06 X 49453
Al-C-Nd Nd3AlC CaTiO3,cP5,221 Pm-3m 0.5025,0.5025,0.5025,90,90,90 perovskite family - 6.17 X 33965
Al-C-Ni NiAl0.5 C0.5 NaCl,cF8,225 Fm-3m 0.366,0.366,0.366,90,90,90 rocksalt family - 10.59 X 48506
Al-C-Ni Ni3AlC0.1 CaTiO3,cP5,221 Pm-3m 0.3588,0.3588,0.3588,90,90,90 perovskite family - 7.34 X 55238
Al-C-O AlC0.5 O0.5 hex2 Al(C0.5 O0.5 ),hP8,194 P63 /mmc 0.3176,0.3176,0.5076,90,90,120 - - 3.07 X 43558
Al-C-O AlC0.5 O0.5 hp ZnO,hP4,186 P63 mc 0.3114,0.3114,0.4979,90,90,120 adamantane structure - 3.26 X 43558
Al-C-O Al2CO orth *,oP72,* - 0.9465,0.9976,1.6294,90,90,90 - - - N 43558
Al-C-O Al2CO rhom Al2CO,hR36,146 R3 0.54505,0.54505,1.49722,90,90,120 - - 3.18 X 42060
Al-C-O Al4CO4 Al4CO4,oS36,36 Cmc21 0.576,0.8537,0.9121,90,90,90 - colorless 2.72 X 1812
Al-C-Pr Pr3AlC CaTiO3,cP5,221 Pm-3m 0.5054,0.5054,0.5054,90,90,90 perovskite family - 5.94 X 33965
Al-C-Pt Pt3AlC0.5 CaTiO3,cP5,221 Pm-3m 0.3893,0.3893,0.3893,90,90,90 perovskite family - 17.40 X 1560
Al-C-Sc ScAl3C3 ScAl3C3,hP14,194 P63 /mmc 0.3355,0.3355,1.6776,90,90,120 - - 3.29 X 19591
Al-C-Sc Sc3AlC CaTiO3,cP5,221 Pm-3m 0.44981,0.44981,0.44981,90,90,90 perovskite family - 3.17 X 33965
Al-C-Si Al4SiC4 Al5C3N-b,hP18,186 P63 mc 0.32771,0.32771,2.1676,90,90,120 - yellow 3.03 X 13407
Al-C-Si Al4Si2C5 Al4Si2C5,hR33,166 R-3m 0.32512,0.32512,4.01078,90,90,120 - - 3.04 X 13407
Al-C-Si Al8SiC7 *,hP16,* - 0.33127,0.33127,1.9242,90,90,120 - - - N 17056
Al-C-Sm Sm3AlC CaTiO3,cP5,221 Pm-3m 0.4968,0.4968,0.4968,90,90,90 perovskite family - 6.64 X 33965
Al-C-Ta Ta2AlC Cr2AlC,hP8,194 P63 /mmc 0.3075,0.3075,1.383,90,90,120 - - 11.76 A 16743
Al-C-Ta Ta3AlC2 Ti3SiC2,hP12,194 P63 /mmc 0.31004,0.31004,1.92,90,90,120 - black 12.34 X 48391
Al-C-Ta Ta3Al2C cub Mo3Al2C,cP24,213 P4132 0.7038,0.7038,0.7038,90,90,90 - - 11.60 X 2297
Al-C-Ta Ta3Al2C hex *,hP*,* - 0.268,0.268,0.797,90,90,120 - - - N 2380
Al-C-Ta Ta4AlC3 CsYb3Se4,hP16,194 P63 /mmc 0.31123,0.31123,2.4111,90,90,120 - black 12.92 X 48391
Al-C-Ta Ta5Al3C CuHf5Sn3,hP18,193 P63 /mcm 0.77337,0.77337,0.52446,90,90,120 AlB2 family - 12.20 A 13850
Al-C-Tb TbAl3C3 ScAl3C3,hP14,194 P63 /mmc 0.3417,0.3417,1.7338,90,90,120 - - 5.23 A 19591
Al-C-Tb Tb3AlC CaTiO3,cP5,221 Pm-3m 0.4894,0.4894,0.4894,90,90,90 perovskite family - 7.31 X 33965
Al-C-Th ThAl4C4 UCr4C4,tI18,87 I4/m 0.8231,0.8231,0.33273,90,90,90 - - 5.72 X 31773
Al-C-Th Th2Al2C3 Th2Al2C3,oP14,58 Pnnm 0.5406,1.1556,0.35201,90,90,90 - - 8.37 X 31773
Al-C-Ti Ti2AlC Cr2AlC,hP8,194 P63 /mmc 0.30502,0.30502,1.36469,90,90,120 - - 4.07 X 52752
Al-C-Ti Ti3AlC CaTiO3,cP5,221 Pm-3m 0.415,0.415,0.415,90,90,90 perovskite family - 4.24 X 16743
Al-C-Ti Ti3AlC2 Ti3SiC2,hP12,194 P63 /mmc 0.3073,0.3073,1.8557,90,90,120 - - 4.26 X 45319
Al-C-Ti Ti3Al2C *,hP*,* - 0.263,0.263,0.787,90,90,120 - - - N 2380
Al-C-Ti Ti5Al2C3 hex Ti5Al2C3,hP20,194 P63 /mmc 0.3038,0.3038,3.2261,90,90,120 - - 4.24 X 58472
Al-C-Ti Ti5Al2C3 rhom Ti5Al2C3,hR30,166 R-3m 0.30564,0.30564,4.81846,90,90,120 - - 4.21 X 58416
Al-C-Tm TmAl3C3 ScAl3C3,hP14,194 P63 /mmc 0.339,0.339,1.709,90,90,120 - - 5.58 A 19591
Al-C-Tm Tm3 AlC CaTiO3,cP5,221 Pm-3m 0.4781,0.4781,0.4781,90,90,90 perovskite family - 8.29 X 33965
Al-C-U UAl3C3 hex1 ScAl3C3,hP14,186 P63 mc 0.3387,0.3387,1.7393,90,90,120 - - 6.82 X 34860
Al-C-U UAl3C3 hex2 UAl3C3,hP16,194 P63 /mmc 0.3389,0.3389,1.7394,90,90,120 - gray light 6.81 X 26147
Al-C-U U2Al3C4 U2Al3C4,hP18,186 P63 mc 0.3422,0.3422,2.323,90,90,120 - black 8.53 X 31251
Al-C-V V12Al3C8 V12Al3C8,hP46,193 P63 /mcm 0.50882,0.50882,2.2983,90,90,120 - - 5.08 X 48470
Al-C-V V2 AlC Cr2AlC,hP8,194 P63 /mmc 0.29107,0.29107,1.3101,90,90,120 - - 4.87 X 48470
Al-C-V V3 Al2C *,hP*,* - 0.252,0.252,0.752,90,90,120 - - - N 2380
Al-C-V V4 AlC2.69 CsYb3Se4,hP16,194 P63 /mmc 0.29302,0.29302,2.2745,90,90,120 - black 5.17 X 48470
Al-C-W W0.75 Al0.25 C WC,hP2,187 P-6m2 0.29051,0.29051,0.28364,90,90,120 AlB2 family - 12.55 X 43398
Al-C-Y YAl3C3 ScAl3C3,hP14,186 P63 mc 0.34216,0.34216,1.7282,90,90,120 - - 3.90 X 48534
Al-C-Y YAlxCx rt Mg,hP2,194 P63 /mmc 0.3622,0.3622,0.5739,90,90,120 close-packed structure - 4.53 X 2815
Al-C-Y Y3 AlC CaTiO3,cP5,221 Pm-3m 0.489,0.489,0.489,90,90,90 perovskite family - 4.34 X 2537
Al-C-Yb YbAl3C3 lt YbAl3C3,oP56,61 Pbca 0.5886,1.711,0.6796,90,90,90 - - 5.63 X 51079
Al-C-Yb YbAl3C3 rt ScAl3C3,hP14,194 P63 /mmc 0.33988,0.33988,1.7113,90,90,120 - gray 5.63 A 26147
Al-C-Yb Yb3 AlC CaTiO3,cP5,221 Pm-3m 0.4757,0.4757,0.4757,90,90,90 perovskite family - 8.61 X 33965
Al-C-Zr ZrAl4C4 ZrAl4C4,hP18,156 P3m1 0.33247,0.33247,2.19717,90,90,120 - - 3.90 X 50545
Al-C-Zr ZrAl8C7 ZrAl8C7,hR48,166 R-3m 0.33284,0.33284,5.78221,90,90,120 - - 3.51 X 50546
Al-C-Zr Zr2Al3C4 U2Al3C4,hP18,186 P63 mc 0.33468,0.33468,2.22394,90,90,120 - - 4.79 X 44798
Al-C-Zr Zr2Al4C5 Zr2(Al0.89 Si0.11 )4C5,hR33,160 R3m 0.33217,0.33217,4.09479,90,90,120 - - 4.46 X 50974
Al-C-Zr Zr3Al3C5 Zr3Al3C5,hP22,186 P63 mc 0.3343,0.3343,2.7609,90,90,120 - - 5.15 X 34860
Al-C-Zr Zr3Al4C6 Zr3(Al0.89 Si0.11 )4C6,hR39,160 R3m 0.33181,0.33181,4.89771,90,90,120 - - 4.84 X 50974
Al-C-Zr Zr5Al3C CuHf5Sn3,hP18,193 P63 /mcm 0.822,0.822,0.568,90,90,120 AlB2 family - 5.49 A 13850
Al-Ca-Cd CaCd1.25 Al0.75 KHg2,oI12,74 Imma 0.4816,0.7536,0.8339,90,90,90 AlB2 family - 4.41 X 18075
Handbook of Inorganic Substances – Edition 2015 : Data 201

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ca-Cd Ca3Cd17Al Ca3Cd17Al,hR504,146 R3 2.2134,2.2134,2.7108,90,90,120 - gray 7.13 X 19098


Al-Ca-Co CaCo 2Al8 CeFe 2Al8,oP44,55 Pbam 1.2466,1.4411,0.4028,90,90,90 - - 3.43 X 21783
Al-Ca-Co CaCo 2Al9 BaFe 2Al9,hP12,191 P6/mmm 0.8117,0.8117,0.389,90,90,120 - - 3.00 X 21783
Al-Ca-Cr CaCr2Al10 CaCr2Al10,tP52,129 P4/nmm 1.2957,1.2957,0.5179,90,90,90 CaCu5-Zr4Al3 gray silver 3.16 X 17150
Al-Ca-Cr CaCr2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4496,1.4496,1.4496,90,90,90 - - 2.98 A 34455
Al-Ca-Cr Ca4Cr7Al51 Ca4Cr7Al51,hP62,156 P3m1 1.0281,1.0281,1.1579,90,90,120 - - 2.98 X 17103
Al-Ca-Cu CaCuAl4 *,hR21,160 R3m 0.5684,0.5684,1.3919,90,90,120 - - - N 22231
Al-Ca-Cu CaCu0.4 Al1.6 hex1 MgZn2,hP12,194 P63/mmc 0.5644,0.5644,0.8909,90,90,120 Friauf-Laves phase - 2.94 A 12792
Al-Ca-Cu CaCu0.4 Al1.6 hex2 MgNi2,hP24,194 P63/mmc 0.5655,0.5655,1.8275,90,90,120 Friauf-Laves phase - 2.85 A 26689
Al-Ca-Cu CaCu2 Al3 PrNi2Al3,hP6,191 P6/mmm 0.53797,0.53797,0.41099,90,90,120 - - 4.00 X 22231
Al-Ca-Cu CaCu4 Al CaCu5,hP6,191 P6/mmm 0.51658,0.51658,0.4134,90,90,120 - - 5.58 X 26689
Al-Ca-Cu CaCu4 Al8 CeMn4Al8,tI26,139 I4/mmm 0.8823,0.8823,0.5151,90,90,90 CaCu5-Zr4Al3 - 4.23 X 17150
Al-Ca-Cu CaCu6.76 Al6.24 CaCu(Cu0.48 Al0.52)12 ,cF112,226 Fm-3c 1.1935,1.1935,1.1935,90,90,90 - - 4.99 X 18075
Al-Ca-Cu Ca10 Cu8.4 Al12.6 Ca10 Cu(Cu0.4 Al0.6)18 Al2,hP93,191 P6/mmm 1.5298,1.5298,0.9289,90,90,120 - - 3.37 X 21802
Al-Ca-Cu Ca3Cu2Al7 Ca3Cu2Al7,hR36,166 R-3m 0.5614,0.5614,2.5853,90,90,120 Laves-CaCu5 - 3.08 X 17150
Al-Ca-D CaAlD5 BaFeF5,mP56,14 P121/c1 0.83598,0.69081,1.24503,90,128.244,90 - - 1.81 X 52555
Al-Ca-D CaAl2D8 Ca[BF4 ]2,oP88,61 Pbca 0.90203,1.34491,0.95334,90,90,90 - - 1.27 X 52555
Al-Ca-Dy Ca0.5 Dy0.5 Al2 MgCu2,cF24,227 Fd-3m 0.7925,0.7925,0.7925,90,90,90 Friauf-Laves phase - 4.14 X 18119
Al-Ca-Er Ca0.5 Er0.5Al2 MgCu2,cF24,227 Fd-3m 0.791,0.791,0.791,90,90,90 Friauf-Laves phase - 4.23 X 18119
Al-Ca-F CaAlF5 rt mon1 CrMnF5,mS28,15 C12/c1 0.8712,0.6317,0.7349,90,115.04,90 jakobssonite - 2.94 X 24364
Al-Ca-F CaAlF5 rt mon2 CaFeF5,mP28,14 P121/c1 0.53361,0.98298,0.73271,90,109.911,90 - - 2.98 X 45237
Al-Ca-F Ca2AlF7 Ca2AlF7,oP40,62 Pnma 0.7685,0.6998,0.9549,90,90,90 - - 3.11 X 13846
Al-Ca-Fe CaFe 4Al8 CeMn4Al8,tI26,139 I4/mmm 0.885,0.885,0.489,90,90,90 CaCu5-Zr4Al3 - 4.16 A 5218
Al-Ca-Ga CaAlGa KHg2,oI12,74 Imma 0.4551,0.7428,0.7814,90,90,90 AlB2 family - 3.44 X 26887
Al-Ca-Ga CaAl0.33 Ga0.67 Ca(Al0.33 Ga0.67 ),mS72,15 C12/c1 2.7177,1.1599,0.6074,90,92.42,90 - - 2.99 X 52438
Al-Ca-Ga CaAl0.6 Ga1.4 CaIn2,hP6,194 P63/mmc 0.451,0.451,0.7385,90,90,120 AlB2 family - 3.93 A 20238
Al-Ca-Ga CaAl1.8 Ga0.2 MgCu2,cF24,227 Fd-3m 0.8022,0.8022,0.8022,90,90,90 Friauf-Laves phase - 2.64 X 20238
Al-Ca-Ga CaAl2Ga2 CeAl2Ga2,tI10,139 I4/mmm 0.4278,0.4278,1.1015,90,90,90 - - 3.85 X 26888
Al-Ca-Ga CaGa0.90 Al0.10 TlI,oS8,63 Cmcm 0.4183,1.1483,0.4392,90,90,90 CrB(TlI)-FeB - 3.32 X 52438
Al-Ca-Ga Ca11 Al5Ga2 Ca11 Ga7,cF144,225 Fm-3m 1.6329,1.6329,1.6329,90,90,90 - - 2.18 X 50550
Al-Ca-Ga Ca3Al1.79 Ga3.21 Hf3Ni2Si3,oS32,63 Cmcm 0.44836,1.0891,1.5077,90,90,90 - gray silver 3.54 X 47577
Al-Ca-Gd Ca0.5 Gd0.5 Al2 MgCu2,cF24,227 Fd-3m 0.7893,0.7893,0.7893,90,90,90 Friauf-Laves phase - 4.12 X 13463
Al-Ca-Ge CaAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.41759,0.41759,0.71767,90,90,120 - - 3.67 X 39649
Al-Ca-Ge Ca10 Al3Ge6.5 Ca10 Al3Ge6.5 ,hP40,176 P63/m 1.6009,1.6009,0.45848,90,90,120 - gray silver 3.11 X 49727
Al-Ca-Ge Ca10 Al6Ge9 Ca10 Al6Ge9,hR150,166 R-3m 1.39845,1.39845,2.1074,90,90,120 - - 3.39 X 49727
Al-Ca-Ge Ca3Al2Ge2 Ba3Al2Ge2,oI14,71 Immm 0.408,0.458,1.854,90,90,90 - white silver3.06 X 10301
Al-Ca-Ge Ca3Al2Ge3 Ca3Al2Ge3,oP32,62 Pnma 1.1395,0.43468,1.4833,90,90,90 - - 3.54 X 15653
Al-Ca-H CaAlH5 BaFeF5,mP56,14 P121/c1 0.83797,0.69293,1.24775,90,128.297,90 - - 1.68 X 46445
Al-Ca-In CaAl1.2 In0.8 CaIn2,hP6,194 P63/mmc 0.4747,0.4747,0.7537,90,90,120 AlB2 family gray silver 3.71 X 49752
Al-Ca-In CaAl1.8 In0.2 MgCu2,cF24,227 Fd-3m 0.8103,0.8103,0.8103,90,90,90 Friauf-Laves phase gray silver 2.79 X 49752
Al-Ca-In Ca10.95 Al4In3.05 Ca11 Ga7,cF144,225 Fm-3m 1.651,1.651,1.651,90,90,90 - - 2.65 X 50550
Al-Ca-La Ca0.5 La0.5 Al2 MgCu2,cF24,227 Fd-3m 0.81,0.81,0.81,90,90,90 Friauf-Laves phase - 3.59 X 18119
Al-Ca-Li Li0.16 Ca7.84 Al3 Ca8In3,aP22,2 P-1 0.947,0.9602,0.9646,99.17,101.08,119.5 - - 1.84 X 26129
Al-Ca-Li Li0.33 CaAl1.67 MgNi2,hP24,194 P63/mmc 0.5734,0.5734,1.8578,90,90,120 Friauf-Laves phase - 2.20 X 27419
Al-Ca-Li Li0.81 CaAl1.19 MgZn2,hP12,194 P63/mmc 0.582,0.582,0.9366,90,90,120 Friauf-Laves phase - 1.88 X 27419
Al-Ca-Li Li11 Ca6Al12 Th6Mn23,cF116,225 Fm-3m 1.343,1.343,1.343,90,90,90 - gray 1.76 X 31681
Al-Ca-Mg CaMg1.07 Al0.93 MgNi2,hP24,194 P63/mmc 0.5935,0.5935,1.9258,90,90,120 Friauf-Laves phase gray silver 2.06 X 41507
Al-Ca-Mg CaMg1.56 Al0.44 MgZn2,hP12,194 P63/mmc 0.60755,0.60755,0.97708,90,90,120 Friauf-Laves phase gray silver 1.91 X 41507
Al-Ca-Mg Ca0.71 Mg0.29 Al2 MgNi2,hP24,194 P63/mmc 0.558,0.558,1.805,90,90,120 Friauf-Laves phase - 2.44 A 54230
Al-Ca-Mg Ca0.9 Mg0.1 Al2 MgCu2,cF24,227 Fd-3m 0.80209,0.80209,0.80209,90,90,90 Friauf-Laves phase gray silver 2.38 X 49154
Al-Ca-Mg Ca2.2 Mg25.8 Al45 Mg28 Al45,cF1832,227 Fd-3m 2.83126,2.83126,2.83126,90,90,90 - - 2.26 A 54230
Al-Ca-Mg Ca4MgAl3 Ca4MgAl3,oP32,57 Pbcm 0.61792,2.42113,0.58864,90,90,90 - - 2.00 X 44903
Al-Ca-Mn CaMn4Al8 CeMn4Al8,tI26,139 I4/mmm 0.8957,0.8957,0.5168,90,90,90 CaCu5-Zr4Al3 - 3.81 X 16136
Al-Ca-Mn Ca2Mn0.32 Al3.68 Ca2(Mn0.32 Al0.68 )Al3 ,hP24,194 P63/mmc 0.5723,0.5723,1.8264,90,90,120 Friauf-Laves phase - 2.53 X 16136
Al-Ca-Mo CaMo 2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4617,1.4617,1.4617,90,90,90 - - 3.28 A 34455
Al-Ca-N Ca3AlN3 Rb3TlO3,mP28,14 P121/c1 0.6937,0.6149,0.9871,90,94.01,90 - yellow 2.99 X 36787
Al-Ca-N Ca3Al2N4 mon1 Ca3Al2As4,mS36,15 C12/c1 1.0606,0.826,0.5517,90,87.9,90 - colorless 3.17 X 37230
Al-Ca-N Ca3Al2N4 mon2 Ca3Al2N4,mP36,14 P121/c1 0.9572,0.5802,0.9563,90,111.62,90 - gray 3.10 X 37230
Al-Ca-N Ca3Al2N4 orth Ca3Al2N4,oP72,19 P212121 0.5826,1.0691,1.5854,90,90,90 - colorless 3.10 X 37230
Al-Ca-Nb CaNb2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4783,1.4783,1.4783,90,90,90 - - 3.15 A 34455
Al-Ca-Ni CaNiAl9 CaNiAl9,hP22,194 P63/mmc 0.76002,0.76002,0.79457,90,90,120 - - 2.85 X 20738
Al-Ca-Ni CaNi0.2 Al1.8 MgCu2,cF24,227 Fd-3m 0.80317,0.80317,0.80317,90,90,90 Friauf-Laves phase - 2.57 X 45371
Al-Ca-Ni CaNi2Al8 CeFe 2Al8,oP44,55 Pbam 1.2532,1.45,0.3975,90,90,90 - - 3.43 X 21783
Al-Ca-Ni Ca8Ni0.27 Al2.73 Ca8Ni0.27 Al2.73 ,aP26,2 P-1 0.9505,0.9601,0.9689,99.04,101.17,119.61 - - 1.89 X 44645
Al-Ca-O CaAl12O19 BaFe 12O19,hP66,194 P63/mmc 0.55587,0.55587,2.18929,90,90,120 magnetoplumbite family colorless 3.79 X 21518
Al-Ca-O CaAl2O4 hp mon2 CaAl2O4,mP14,11 P121/m1 0.5556,0.37627,0.7056,90,101.36,90 - colorless 3.63 X 47517
Al-Ca-O CaAl2O4 hp1 CaGa2O4,mP56,14 P121/c1 0.79719,0.86284,1.02628,90,94.801,90 - - 2.98 X 49685
Al-Ca-O CaAl2O4 hp2 *,o*14,* - 0.439,0.507,0.696,90,90,90 - - 3.39 N 13590
Al-Ca-O CaAl2O4 hp3 CaV2O4,oP28,62 Pnma 0.892,0.28713,1.03155,90,90,90 - - 3.97 X 47517
Al-Ca-O CaAl2O4 m SrAl2O4,hP42,173 P63 0.87402,0.87402,0.80904,90,90,120 - - 2.94 X 48888
Al-Ca-O CaAl2O4 CaAl2O4,mP84,14 P121/c1 0.86996,0.80994,1.75035,90,119.615,90 krotite colorless 2.94 X 55789
Al-Ca-O CaAl4O7 CaAl4O7,mS48,15 C12/c1 1.2866,0.8879,0.544,90,106.75,90 grossite - 2.90 X 6270
Al-Ca-O Ca2Al2O5 hp Ca2(Fe 0.5 Al0.5)2O5,oI36,46 Ima2 1.44686,0.54004,0.52281,90,90,90 - - 3.48 X 36883
Al-Ca-O Ca2Al2O5 hp-ht Sr2Fe2O5,oI44,74 Imma 0.52699,1.46984,0.54196,90,90,90 - colorless 3.39 X 50009
Al-Ca-O Ca3Al2O6 Ca3Al2O6,cP264,205 Pa-3 1.5291,1.5291,1.5291,90,90,90 - white 3.01 X 10155
Al-Ca-O Ca4Al6O13 cub Zn4B6O13,cI46,217 I-43m 0.88214,0.88214,0.88214,90,90,90 zeolite SOD - 2.57 X 49672
Al-Ca-O Ca4Al6O13 orth Ca4Al6O13,oP184,60 Pbcn 1.7761,0.53002,2.10887,90,90,90 - - 3.55 X 36896
Al-Ca-O Ca5Al6O14 Ca5Al6O14,oS100,36 Cmc21 1.1253,1.0966,1.029,90,90,90 - colorless 3.07 X 11187
202 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ca-O Ca5.65 Al7O16.15 Ca6Al7O16.5 ,cI140,220 I-43d 1.1981,1.1981,1.1981,90,90,90 mayenite gray 2.60 X 19803
Al-Ca-O Ca6Al7O16 Ca6Al7O16 ,cI116,220 I-43d 1.19986,1.19986,1.19986,90,90,90 - black 2.64 X 52008
Al-Ca-P Ca3Al2P 4 Ca3Al2As4 ,mS36,15 C12/c1 1.26236,0.98358,0.64469,90,89.546,90 - orange 2.47 X 58898
Al-Ca-Pb CaAl0.2Pb2.8 Cu3Au,cP4,221 Pm-3m 0.491,0.491,0.491,90,90,90 close-packed structure - 8.78 X 7079
Al-Ca-Pb Ca10.8 Al4Pb3.2 Ca11Ga7,cF144,225 Fm-3m 1.6422,1.6422,1.6422,90,90,90 - - 3.61 X 50550
Al-Ca-Pd CaPdAl CaPdAl,oP12,57 Pbcm 0.575,0.779,0.562,90,90,90 - gray silver 4.58 X 28257
Al-Ca-Pd Ca2Pd6Al10 Ca2Pd6(Pd0.88 Al0.12)Al9,hP18,191 P6/mmm 0.9373,0.9373,0.4248,90,90,120 - gray silver 5.08 X 27375
Al-Ca-Pr Ca0.5 Pr0.5 Al2 MgCu2,cF24,227 Fd-3m 0.8035,0.8035,0.8035,90,90,90 Friauf-Laves phase - 3.70 X 18119
Al-Ca-Pt CaPtAl TiNiSi,oP12,62 Pnma 0.71581,0.42853,0.77536,90,90,90 AlB2 family gray 7.32 X 55715
Al-Ca-S CaAl2S4 EuGa2S4,oF224,70 Fddd 1.2026,2.0052,2.0163,90,90,90 - colorless 2.43 X 16533
Al-Ca-Sb Ca11AlSb9 Ca11InSb9,oI84,45 Iba2 1.1839,1.2536,1.6716,90,90,90 - gray silver 4.19 A 29954
Al-Ca-Sb Ca14AlSb11 Ca14AlSb11 ,tI208,142 I41/acd 1.6676,1.6676,2.2423,90,90,90 - - 4.11 X 17637
Al-Ca-Sb Ca3AlSb3 Ca3AlAs3,oP28,62 Pnma 1.2835,0.4489,1.4282,90,90,90 - - 4.14 X 17725
Al-Ca-Sb Ca5Al2Sb6 Ca5Ga2As6,oP26,55 Pbam 1.209,1.407,0.446,90,90,90 - gray 4.31 X 14591
Al-Ca-Se CaAl2Se4 CaAl2Se4,oS36,66 Cccm 0.633,1.048,1.053,90,90,90 - red 3.90 X 12035
Al-Ca-Si CaAlSi 5L Ca(Al0.5 Si0.5 )2,hP15,187 P-6m2 0.41772,0.41772,2.19372,90,90,120 - gray 2.38 X 46114
Al-Ca-Si CaAlSi hex1 AlB2,hP3,191 P6/mmm 0.4186,0.4186,0.43972,90,90,120 AlB2 family - 2.37 X 53230
Al-Ca-Si CaAlSi hex3 Ca(Al0.5 Si0.5 )2,hP18,187 P-6m2 0.41772,0.41772,2.63246,90,90,120 - gray 2.38 X 46114
Al-Ca-Si CaAl0.24 Si1.76 CaSi2,hR18,166 R-3m 0.38585,0.38585,3.0695,90,90,120 - - 2.42 X 57364
Al-Ca-Si CaAl2Si2 Ce2SO2,hP5,164 P-3m1 0.413,0.413,0.7145,90,90,120 - gray 2.36 X 3755
Al-Ca-Si Ca2Al4Si3 *,cP18,* - 0.715,0.715,0.715,90,90,90 - - 2.47 N 766
Al-Ca-Si Ca3Al2Si2 Ba3Al2Ge2 ,oI14,71 Immm 0.4,0.4576,1.824,90,90,90 - - 2.29 X 11102
Al-Ca-Si Ca3Al6Si2 *,hP*,* - 0.73,0.73,1.199,90,90,120 - gray dark - N 766
Al-Ca-Sm Ca0.5 Sm0.5 Al2 MgCu2,cF24,227 Fd-3m 0.798,0.798,0.798,90,90,90 Friauf-Laves phase - 3.90 X 18119
Al-Ca-Sn Ca10.89 Al4.84 Sn2.27 Ca11Ga7,cF144,225 Fm-3m 1.6393,1.6393,1.6393,90,90,90 - - 2.52 X 50550
Al-Ca-Sn Ca9Al4.7 Sn10.0 Ca9Al2.7 (Al0.5 Sn0.5 )4Sn8.0 ,mS108,12 C12/m1 2.1752,1.2108,1.0074,90,103.38,90 - gray silver 4.31 X 49577
Al-Ca-Sr Sr0.73 Ca0.27 Al2 MgCu2,cF24,227 Fd-3m 0.8212,0.8212,0.8212,90,90,90 Friauf-Laves phase gray silver 3.09 X 53499
Al-Ca-Sr Sr0.94 Ca1.06 Al (Sr0.47 Ca0.53)2Al,tI72,139 I4/mmm 1.19,1.19,1.6811,90,90,90 - - 2.54 X 48653
Al-Ca-Sr Sr4.5 Ca0.5 Al9 Sr5Al9,hR42,166 R-3m 0.58261,0.58261,3.549,90,90,120 - gray silver 3.14 X 53499
Al-Ca-Sr Sr5.9 Ca1.1 Al13 Ba7Al13,hP20,164 P-3m1 0.58235,0.58235,1.6552,90,90,120 - gray silver 3.11 X 53499
Al-Ca-Ta CaTa2 Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4781,1.4781,1.4781,90,90,90 - - 3.87 A 34455
Al-Ca-Te Ca0.5 Al3Te 5 Ca0.5 Al3Te5,cP72,213 P4132 1.028,1.028,1.028,90,90,90 - - 4.52 X 12897
Al-Ca-Ti CaTi2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4739,1.4739,1.4739,90,90,90 - - 2.80 A 34455
Al-Ca-V CaV2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4587,1.4587,1.4587,90,90,90 - - 2.92 X 24043
Al-Ca-W Ca6W4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1084,1.1084,1.7788,90,90,120 - - 3.75 X 34455
Al-Ca-Yb Ca0.5 Yb0.5 Al2 MgCu2,cF24,227 Fd-3m 0.798,0.798,0.798,90,90,90 Friauf-Laves phase - 4.20 X 18119
Al-Ca-Zn CaZnAl KHg2,oI12,74 Imma 0.4567,0.7375,0.792,90,90,90 AlB2 family - 3.30 X 49663
Al-Ca-Zn CaZn0.1 Al1.9 MgCu2,cF24,227 Fd-3m 0.80202,0.80202,0.80202,90,90,90 Friauf-Laves phase gray silver 2.52 X 50917
Al-Ca-Zn CaZn0.6 Al1.4 MgNi2,hP24,194 P63 /mmc 0.5681,0.5681,1.835,90,90,120 Friauf-Laves phase gray silver 3.03 X 49663
Al-Ca-Zn CaZn1.85 Al2.15 CeAl2Ga2,tI10,139 I4/mmm 0.4118,0.4118,1.1629,90,90,90 - - 3.69 X 53526
Al-Ca-Zn CaZn10.2 Al0.8 BaCd11,tI48,141 I41/amd 1.0706,1.0706,0.6851,90,90,90 - - 6.16 X 53526
Al-Ca-Zn Ca0.885 Zn4.92 Al0.31 Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.5377,0.5377,0.4294,90,90,120 CaCu5-Zr4Al3 - 5.65 X 53526
Al-Ca-Zn Ca2Zn15.5 Al1.5 Zn17Th2,hR57,166 R-3m 0.9123,0.9123,1.3266,90,90,120 CaCu5-Zr4Al3 - 5.91 X 53526
Al-Ca-Zn Ca3.33 Zn8.99 Al Ca3.33 Zn10.11 ,hP32,194 P63 /mmc 0.9157,0.9157,0.7365,90,90,120 - - 4.65 X 53526
Al-Cd-Cl CdAlCl4 CdAlCl4,aP12,2 P-1 0.65319,0.65547,0.93523,76.39,83.482,60.341 - yellow pale 2.76 X 20803
Al-Cd-Cl CdAl2Cl8 CdAl2Cl8,mP22,7 P1c1 0.7051,0.6602,1.2887,90,92.89,90 - colorless 2.49 X 20803
Al-Cd-O CdAl2O4 Fe3O4,cF56,227 Fd-3m 0.8078,0.8078,0.8078,90,90,90 spinel family brown 5.81 X 710
Al-Cd-O CdAl4O7 CaAl4O7,mS48,15 C12/c1 1.268,0.886,0.54,90,105.98,90 - - 3.78 A 3038
Al-Cd-O Cd0.61 Al11 O17.11 Cd0.61 Al11 O17.11 ,hP116,194 P63 /mmc 0.55869,0.55869,2.237,90,90,120 β-alumina - 3.51 X 24520
Al-Cd-O Cd0.73 Al0.18 O NaCl,cF8,225 Fm-3m 0.46576,0.46576,0.46576,90,90,90 rocksalt family - 6.77 X 55082
Al-Cd-S CdAl2S4 hp MgAl2O4,cF56,227 Fd-3m 1.024,1.024,1.024,90,90,90 spinel family - 3.65 A 4320
Al-Cd-S CdAl2S4 rt CdGa2S4,tI14,82 I-4 0.55523,0.55523,1.01031,90,90,90 - yellowish 3.14 X 24238
Al-Cd-Se CdAl2Se4 hp MgAl2O4,cF56,227 Fd-3m 1.077,1.077,1.077,90,90,90 spinel family - 5.13 A 4320
Al-Cd-Se CdAl2Se4 rt CdGa2S4,tI14,82 I-4 0.57606,0.57606,1.07138,90,90,90 - black 4.50 X 32933
Al-Cd-Te CdAl2 Te4 tet1 CdGa2S4,tI14,82 I-4 0.6011,0.6011,1.221,90,90,90 - black 5.09 X 710
Al-Cd-Te CdAl2 Te4 tet2 CdIn2Se4,tP7,111 P-42m 0.6011,0.6011,0.6107,90,90,90 - - 5.09 X 710
Al-Ce-Co CeCoAl hex MgZn2,hP12,194 P63 /mmc 0.5501,0.5501,0.8677,90,90,120 Friauf-Laves phase - 6.60 A 4085
Al-Ce-Co CeCoAl mon CeCoAl,mS12,12 C12/m1 1.1098,0.441,0.4807,90,104.61,90 - - 6.60 X 16571
Al-Ce-Co CeCoAl4 LaCoAl4,oP12,51 Pmma 0.76606,0.40469,0.6915,90,90,90 - - 4.76 X 43247
Al-Ce-Co CeCo 0.3Al1.7 MgCu2,cF24,227 Fd-3m 0.801,0.801,0.801,90,90,90 Friauf-Laves phase - 5.26 X 13205
Al-Ce-Co CeCo 1.7Al0.3 MgCu2,cF24,227 Fd-3m 0.719,0.719,0.719,90,90,90 Friauf-Laves phase - 8.88 X 13205
Al-Ce-Co CeCo 2Al8 CeFe2Al8,oP44,55 Pbam 1.241,1.43,0.412,90,90,90 - - 4.30 A 13205
Al-Ce-Co CeCo 4Al ht CaCu5,hP6,191 P6/mmm 0.4958,0.4958,0.406,90,90,120 - - 7.74 X 23456
Al-Ce-Co Ce2Co15Al2 Ce2Co15Al2,hR57,166 R-3m 0.844,0.844,1.23,90,90,120 CaCu5-Zr4Al3 - 8.00 X 2004
Al-Ce-Co Ce3Co3Al4 Ce3Co3Al4 ,oP40,62 Pnma 2.4607,0.4222,0.7054,90,90,90 - - 6.39 X 21419
Al-Ce-Cr CeCr2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4491,1.4491,1.4491,90,90,90 - - 3.42 X 58994
Al-Ce-Cr CeCr4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.898,0.898,0.517,90,90,90 CaCu5-Zr4Al3 - 4.49 A 8599
Al-Ce-Cr Ce2Cr7Al10 Zn17Th2,hR57,166 R-3m 0.907,0.907,1.301,90,90,120 CaCu5-Zr4Al3 - 4.91 A 8599
Al-Ce-Cu CuCeAl ZrNiAl,hP9,189 P-62m 0.7177,0.7177,0.4208,90,90,120 Fe2P family - 6.12 A 34409
Al-Ce-Cu CuCeAl3 CeAl2Ga2,tI10,139 I4/mmm 0.425,0.425,1.065,90,90,90 - - 4.91 X 2805
Al-Ce-Cu Cu3CeAl2 PrNi2Al3,hP6,191 P6/mmm 0.52486,0.52486,0.41797,90,90,120 - - 6.41 X 27905
Al-Ce-Cu Cu4CeAl CaCu5,hP6,191 P6/mmm 0.5184,0.5184,0.4163,90,90,120 - - 7.22 X 57238
Al-Ce-Cu Cu4CeAl8 CeMn4Al8 ,tI26,139 I4/mmm 0.884,0.884,0.517,90,90,90 CaCu5-Zr4Al3 - 5.02 X 2004
Al-Ce-Cu Cu6.5 CeAl6.5 CaCu(Cu0.48 Al0.52)12,cF112,226 Fm-3c 1.1822,1.1822,1.1822,90,90,90 - gray silver 5.86 X 18106
Al-Ce-Cu Cu6.5 Ce2Al10.5 Zn17Th2,hR57,166 R-3m 0.898,0.898,1.307,90,90,120 CaCu5-Zr4Al3 - 5.33 X 2004
Al-Ce-Eu Ce0.5 Eu0.5 Al2 MgCu2,cF24,227 Fd-3m 0.807,0.807,0.807,90,90,90 Friauf-Laves phase - 5.06 X 18119
Al-Ce-Fe CeFe0.8 Al1.2 MgCu2,cF24,227 Fd-3m 0.791,0.791,0.791,90,90,90 Friauf-Laves phase - 5.83 X 22471
Al-Ce-Fe CeFe1.76 Al0.24 rt MgCu2,cF24,227 Fd-3m 0.734,0.734,0.734,90,90,90 Friauf-Laves phase - 8.23 X 22471
Handbook of Inorganic Substances – Edition 2015 : Data 203

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ce-Fe CeFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.9002,1.0222,0.9073,90,90,90 - - 4.15 A 34696


Al-Ce-Fe CeFe 2Al8 CeFe 2Al8,oP44,55 Pbam 1.24866,1.44291,0.40388,90,90,90 - - 4.27 X 38896
Al-Ce-Fe CeFe 4Al8 CeMn4Al8,tI26,139 I4/mmm 0.8793,0.8793,0.5047,90,90,90 CaCu5-Zr4Al3 - 4.93 A 11676
Al-Ce-Fe Ce2Fe15Al2 Zn17 Th2,hR57,166 R-3m 0.86053,0.86053,1.25263,90,90,120 CaCu5-Zr4Al3 - 7.27 A 22332
Al-Ce-Fe Ce6Fe11Al3 La6Co 9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.81903,0.81903,2.3101,90,90,90 - - 6.58 A 26296
Al-Ce-Ga CeAlGa AlB2 ,hP3,191 P6/mmm 0.4378,0.4378,0.4329,90,90,120 AlB2 family - 5.47 X 22495
Al-Ce-Ga CeAl2Ga2 CeAl2Ga2,tI10,139 I4/mmm 0.4203,0.4203,1.0955,90,90,90 - - 5.72 X 21394
Al-Ce-Ga CeAl2.7 Ga0.3 Mg3 Cd,hP8,194 P63/mmc 0.6544,0.6544,0.4598,90,90,120 close-packed structure - 4.56 A 33249
Al-Ce-Ge CeAlGe ht ThSi2,tI12,141 I41/amd 0.425,0.425,1.4711,90,90,90 - - 5.99 X 34785
Al-Ce-Ge CeAlGe rt LaPtSi,tI12,109 I41md 0.4267,0.4267,1.463,90,90,90 - - 5.98 A 31896
Al-Ce-Ge CeAl0.3 Ge1.7 ht GdSi1.4 ,oI12,74 Imma 0.43,0.444,1.414,90,90,90 - - 6.68 A 5286
Al-Ce-Ge CeAl1.62 Ge0.38 AlB2 ,hP3,191 P6/mmm 0.4353,0.4353,0.4309,90,90,120 AlB2 family - 4.96 X 34785
Al-Ce-Ge CeAl1.94 Ge0.06 MgCu2,cF24,227 Fd-3m 0.8034,0.8034,0.8034,90,90,90 Friauf-Laves phase - 5.04 X 3532
Al-Ce-Ge CeAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4283,0.4283,0.69254,90,90,120 - - 5.12 X 34785
Al-Ce-Ge CeAl2.7 Ge0.3 Mg3 Cd,hP8,194 P63/mmc 0.6521,0.6521,0.4609,90,90,120 close-packed structure - 4.59 A 33249
Al-Ce-Ge Ce2Al1.5 Ge1.5 Pr2Al(Al0.5 Ge0.5 )Ge,oS20,63 Cmcm 0.41918,2.6366,0.4386,90,90,90 - - 5.89 A 50109
Al-Ce-Ge Ce2Al1.6 Ge5.4 La2AlGe6,mS36,12 C12/m1 0.8284,0.8721,1.0767,90,101.09,90 - - 6.23 X 34785
Al-Ce-Ge Ce2Al3Ge4 Ba2Cd3Bi4,oS36,64 Cmce 0.6078,1.5069,0.7963,90,90,90 - - 5.93 X 34785
Al-Ce-I Ce2.29 Al2I2 Y2Fe2.23 Br2,hR21,166 R-3m 0.43645,0.43645,3.5914,90,90,120 - - 5.29 X 49759
Al-Ce-I Ce3Al2I2 La3Al2I2,mS28,12 C12/m1 1.9542,0.4272,1.2198,90,121.35,90 - - 5.56 X 42474
Al-Ce-I Ce9.67 Al4.67 I9.33 Ce9.67 Al4.67 I9.33 ,mS58,12 C12/m1 1.9471,0.4308,1.9526,90,102.75,90 - gray silver 5.54 X 45718
Al-Ce-Ir CeIrAl TiNiSi,oP12,62 Pnma 0.68931,0.43205,0.79361,90,90,90 AlB2 family - 10.10 A 30303
Al-Ce-Ir Ce2Ir3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3243,0.7646,0.9479,90,90,90 - - 7.61 A 43418
Al-Ce-Ir Ce4Ir1.05 Al0.95 Gd4RhIn,cF96,216 F-43m 1.3951,1.3951,1.3951,90,90,90 - - 7.71 X 57034
Al-Ce-La La0.5 Ce0.5Al2 MgCu2,cF24,227 Fd-3m 0.8107,0.8107,0.8107,90,90,90 Friauf-Laves phase - 4.82 X 17290
Al-Ce-Lu Ce0.5 Lu0.5 Al2 MgCu2,cF24,227 Fd-3m 0.786,0.786,0.786,90,90,90 Friauf-Laves phase - 5.79 X 18119
Al-Ce-Mg Mg1.85 Ce0.15 Al2 MgZn2,hP12,194 P63/mmc 0.552,0.552,0.889,90,90,120 Friauf-Laves phase - 3.40 A 3722
Al-Ce-Mn CeMnAl MgCu2,cF24,227 Fd-3m 0.8024,0.8024,0.8024,90,90,90 Friauf-Laves phase - 5.71 X 33268
Al-Ce-Mn CeMn1.5 Al0.5 MgZn2,hP12,194 P63/mmc 0.54446,0.54446,0.88909,90,90,120 Friauf-Laves phase - 6.87 X 37370
Al-Ce-Mn CeMn2Al10 CaCr2Al10,tP52,129 P4/nmm 1.2858,1.2858,0.5134,90,90,90 CaCu5-Zr4Al3 gray silver 4.07 A 35381
Al-Ce-Mn CeMn4Al8 CeMn4Al8,tI26,139 I4/mmm 0.898,0.898,0.517,90,90,90 CaCu5-Zr4Al3 - 4.59 X 2004
Al-Ce-Mn Ce0.003Mn0.01 Al0.987 Cu,cF4,225 Fm-3m 0.4047,0.4047,0.4047,90,90,90 close-packed structure - 2.77 X 1994
Al-Ce-Mn Ce2Mn7Al10 Ce2Mn3(Mn0.67 Al0.33 )6Al8,hR57,166 R-3m 0.904,0.904,1.317,90,90,120 CaCu5-Zr4Al3 - 5.00 X 2004
Al-Ce-Mo CeMo1.474 Al20.526 CeCr2Al20,cF184,227 Fd-3m 1.4575,1.4575,1.4575,90,90,90 - - 3.58 X 30512
Al-Ce-N Ce3AlN0.8 CaTiO3,cP5,221 Pm-3m 0.5008,0.5008,0.5008,90,90,90 perovskite family - 6.06 X 18040
Al-Ce-Nb CeNb2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4748,1.4748,1.4748,90,90,90 - - 3.58 A 34455
Al-Ce-Nb Ce0.998 Nb0.001 Al0.001 ht1 Cu,cF4,225 Fm-3m 0.513,0.513,0.513,90,90,90 close-packed structure - 6.89 X 21235
Al-Ce-Nd Ce0.5 Nd0.5 Al2 MgCu2,cF24,227 Fd-3m 0.803,0.803,0.803,90,90,90 Friauf-Laves phase - 5.03 X 18119
Al-Ce-Ni CeNiAl ZrNiAl,hP9,189 P-62m 0.6976,0.6976,0.40186,90,90,120 Fe2P family - 6.64 X 48629
Al-Ce-Ni CeNiAl2 MgCuAl2,oS16,63 Cmcm 0.40862,1.0956,0.6904,90,90,90 - - 5.43 A 52439
Al-Ce-Ni CeNiAl4 YNiAl4,oS24,63 Cmcm 0.41553,1.5883,0.66432,90,90,90 - gray silver 4.65 X 37394
Al-Ce-Ni CeNi0.08 Al1.92 MgCu2,cF24,227 Fd-3m 0.80424,0.80424,0.80424,90,90,90 Friauf-Laves phase - 5.02 X 52439
Al-Ce-Ni CeNi1.7 Al0.3 MgCu2,cF24,227 Fd-3m 0.7366,0.7366,0.7366,90,90,90 Friauf-Laves phase - 8.24 X 16524
Al-Ce-Ni CeNi2Al5 PrNi2Al5,oI16,71 Immm 0.3988,0.7006,0.9566,90,90,90 - - 4.88 X 29208
Al-Ce-Ni CeNi2.5 Al0.5 CeNi3,hP24,194 P63/mmc 0.50754,0.50754,1.6431,90,90,120 Laves-CaCu5 - 8.16 A 52439
Al-Ce-Ni CeNi3Al2 PrNi2Al3,hP6,191 P6/mmm 0.5081,0.5081,0.4115,90,90,120 - - 6.68 X 30443
Al-Ce-Ni CeNi4Al CaCu5,hP6,191 P6/mmm 0.495,0.495,0.4089,90,90,120 - - 7.69 X 30443
Al-Ce-Ni Ce0.005 Ni0.005 Al0.99 Cu,cF4,225 Fm-3m 0.40495,0.40495,0.40495,90,90,90 close-packed structure - 2.77 X 52439
Al-Ce-Ni Ce0.01 Ni0.92 Al1.07 CsCl,cP2,221 Pm-3m 0.28757,0.28757,0.28757,90,90,90 b.c.c. family - 5.88 X 52439
Al-Ce-Ni Ce0.02 Ni1.98 Al3 Ni2Al3,hP5,164 P-3m1 0.40357,0.40357,0.4883,90,90,120 - - 4.82 A 52439
Al-Ce-Ni Ce0.03 Ni0.90 Al3.07 Fe3C-b,oP16,62 Pnma 0.65874,0.73269,0.48015,90,90,90 - - 4.01 A 52439
Al-Ce-Ni Ce0.07 Ni3.08 Al0.85 Cu3Au,cP4,221 Pm-3m 0.35687,0.35687,0.35687,90,90,90 close-packed structure - 7.80 X 50361
Al-Ce-Ni Ce0.85 Ni0.15 Al3 Mg3 Cd,hP8,194 P63/mmc 0.70742,0.70742,0.5453,90,90,120 close-packed structure - 2.94 A 50361
Al-Ce-Ni Ce0.95 Ni0.05 Al3 Mg3 Cd,hP8,194 P63/mmc 0.65526,0.65526,0.4603,90,90,120 close-packed structure - 4.21 A 52439
Al-Ce-Ni Ce2Ni2.15 Al0.85 W2CoB2,oI10,71 Immm 0.4241,0.5331,0.8404,90,90,90 - - 7.51 A 15468
Al-Ce-Ni Ce2Ni6.6 Al0.4 Ce2Ni7,hP36,194 P63/mmc 0.49979,0.49979,2.4505,90,90,120 Laves-CaCu5 - 8.50 A 52439
Al-Ce-Ni Ce3Ni0.25 Al10.75 La3Al11,oI28,71 Immm 0.43696,1.00979,1.2966,90,90,90 - - 4.21 A 50361
Al-Ce-Ni Ce4Ni6Al23 Y4Ni6Al23,mS66,12 C12/m1 1.6042,0.414,1.838,90,113.24,90 - - 4.54 X 41972
Al-Ce-O CeAlO3 ht1 Ba(Pb0.5 Bi0.5 )O3,oI20,74 Imma 0.53373,0.7537,0.53572,90,90,90 - - 6.63 X 48930
Al-Ce-O CeAlO3 ht2 LaAlO3,hR30,167 R-3c 0.53587,0.53587,1.30868,90,90,120 perovskite family - 6.59 X 48930
Al-Ce-O CeAlO3 ht3 CaTiO3,cP5,221 Pm-3m 0.38079,0.38079,0.38079,90,90,90 perovskite family - 6.47 X 48930
Al-Ce-O CeAlO3 rt SrZrO3,tI20,140 I4/mcm 0.53297,0.53297,0.75868,90,90,90 perovskite family - 6.63 X 48930
Al-Ce-O Ce0.9 Al0.1 O1.95 m CaF2 ,cF12,225 Fm-3m 0.538,0.538,0.538,90,90,90 fluorite family - 6.83 X 52799
Al-Ce-O Ce3AlO CaTiO3,cP5,221 Pm-3m 0.49574,0.49574,0.49574,90,90,90 perovskite family - 6.32 X 47706
Al-Ce-Os CeOs2Al10 YbFe 2Al10,oS52,63 Cmcm 0.91216,1.02543,0.9169,90,90,90 - - 6.12 X 55277
Al-Ce-Os Ce3Os4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.8876,0.8876,0.9553,90,90,120 - gray dark 7.67 A 40923
Al-Ce-Pd CePdAl ht ZrNiAl,hP9,189 P-62m 0.72198,0.72198,0.42329,90,90,120 Fe2P family gray silver 7.13 X 28432
Al-Ce-Pd CePdAl rt CePdAl,oP42,59 Pmmn 0.42607,2.88758,0.7219,90,90,90 - - 7.16 X 46799
Al-Ce-Pd CePdAl4 YNiAl4,oS24,63 Cmcm 0.3976,1.4812,0.6555,90,90,90 - - 6.10 A 26688
Al-Ce-Pd CePd1.5Al5.5 SrAu(Au0.5 Ga0.5 )2Ga4,tP8,123 P4/mmm 0.42298,0.42298,0.8075,90,90,90 - - 5.15 X 55037
Al-Ce-Pd CePd2Al CePd2Al,oP16,33 Pna21 0.74568,0.59286,0.69948,90,90,90 - - 8.16 X 40012
Al-Ce-Pd CePd2Al3 PrNi2Al3,hP6,191 P6/mmm 0.547,0.547,0.4216,90,90,120 - - 6.59 X 29219
Al-Ce-Pd CePd4Al7 BaCd11,tI48,141 I41/amd 1.0706,1.0706,0.6923,90,90,90 - - 6.32 X 29203
Al-Ce-Pd CePd5Al2 ht ZrNi2Al5,tI16,139 I4/mmm 0.4156,0.4156,1.4883,90,90,90 - - 9.38 X 51065
Al-Ce-Pd Ce0.85Pd1.65 Al2.5 CeAl2Ga2,tI10,139 I4/mmm 0.4367,0.4367,1.0998,90,90,90 - - 5.73 A 26688
Al-Ce-Pd Ce8Pd24Al Ce8Pd24Sb,cP33,221 Pm-3m 0.8404,0.8404,0.8404,90,90,90 - - 10.36 A 36430
Al-Ce-Pr Ce0.5 Pr0.5 Al2 MgCu2,cF24,227 Fd-3m 0.805,0.805,0.805,90,90,90 Friauf-Laves phase - 4.95 X 18119
Al-Ce-Pt CePtAl TiNiSi,oP12,62 Pnma 0.7205,0.4471,0.778,90,90,90 AlB2 family - 9.60 X 28756
204 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ce-Pt CePt3Al2 hex PrNi2Al3,hP6,191 P6/mmm 0.5428,0.5428,0.4414,90,90,120 - - 11.49 X 27455


Al-Ce-Pt CePt3Al5 orth YNi5Si3,oP36,62 Pnma 2.0651,0.41381,0.72842,90,90,90 - gray light 9.18 X 44292
Al-Ce-Pt Ce0.67Pt2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63 /mmc 0.43105,0.43105,1.6494,90,90,120 - - 7.75 X 44902
Al-Ce-Pt Ce1.33Pt3Al8 Gd1.33Pt3Al8,hR51,166 R-3m 0.4361,0.4361,3.9,90,90,120 - - 7.66 X 44902
Al-Ce-Pt Ce2Pt9Al16 Ce2Pt9Al16 ,oI54,71 Immm 0.41597,1.191,1.8186,90,90,90 - - 9.10 X 52226
Al-Ce-Pt Ce3Pt4Al6 Ce3Pt4Al6 ,oP52,62 Pnma 1.36589,0.43331,1.7474,90,90,90 - - 8.75 X 50114
Al-Ce-Re CeRe2Al9.52 CaCr2Al10 ,tP52,129 P4/nmm 1.2955,1.2955,0.5172,90,90,90 CaCu5-Zr4Al3 gray silver 5.89 X 35381
Al-Ce-Rh CeRhAl LaNiAl,oP24,62 Pnma 0.7107,0.42237,1.5965,90,90,90 - - 7.48 X 50591
Al-Ce-Rh Ce2Rh3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3145,0.7688,0.9559,90,90,90 - - 5.72 X 33257
Al-Ce-Rh Ce4Rh1.14 Al0.86 Gd4RhIn,cF96,216 F-43m 1.3946,1.3946,1.3946,90,90,90 - - 6.87 X 57034
Al-Ce-Ru CeRuAl LaNiAl,oP24,62 Pnma 0.72057,0.40589,1.58728,90,90,90 - - 7.67 X 50591
Al-Ce-Ru CeRu2Al10 YbFe2Al10 ,oS52,63 Cmcm 0.91272,1.0282,0.91902,90,90,90 - gray light 4.71 X 44233
Al-Ce-Ru CeRu2.83 Al10.17 CeRu2(Ru0.83 Al0.17 )Al10,oI64,74 Imma 0.42213,1.25014,1.76689,90,90,90 - - 4.99 X 44924
Al-Ce-Ru Ce11Ru2Al6 La11Ru2Al6,oP38,55 Pbam 1.40799,1.54879,0.44685,90,90,90 - golden 6.49 X 53941
Al-Ce-Ru Ce2RuAl3 Mg2Cu3Si,hP12,194 P63 /mmc 0.56538,0.56538,0.8883,90,90,120 Friauf-Laves phase gray silver 6.24 X 57520
Al-Ce-Ru Ce2Ru3Al15 Ce2Ru3Al15 ,hP80,193 P63 /mcm 1.3122,1.3122,0.90964,90,90,120 - gray light 4.84 X 42623
Al-Ce-Ru Ce3Ru4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.88652,0.88652,0.957,90,90,120 - - 5.86 X 43104
Al-Ce-Ru Ce4RuAl Gd4RhIn,cF96,216 F-43m 1.3774,1.3774,1.3774,90,90,90 - gray dark 7.00 A 57034
Al-Ce-Ru Ce5Ru3Al2 Ce5Ru3Al2 ,hR60,146 R3 1.391,1.391,0.8314,90,90,120 - - 7.57 X 55154
Al-Ce-S Ce3Al1.67 S7 Ce3Al1.67 S7,hP24,173 P63 1.005,1.005,0.608,90,90,120 - yellow 4.31 X 3982
Al-Ce-Sc Sc0.1 Ce0.9Al2 MgCu2,cF24,227 Fd-3m 0.806,0.806,0.806,90,90,90 Friauf-Laves phase - 4.68 X 17170
Al-Ce-Sc Sc0.996 Ce0.004 Al3 Cu3Au,cP4,221 Pm-3m 0.4103,0.4103,0.4103,90,90,90 close-packed structure - 3.04 X 52216
Al-Ce-Se Ce3Al1.67 Se7 Ce3Al1.67 S7,hP24,173 P63 1.0361,1.0361,0.62,90,90,120 - - 5.87 A 4521
Al-Ce-Si CeAlSi LaPtSi,tI12,109 I41md 0.4242,0.4242,1.4538,90,90,90 - - 4.96 A 31896
Al-Ce-Si CeAlSi2 rt CeAlSi2,hP8,164 P-3m1 0.41707,0.41707,1.12147,90,90,120 - - 4.39 X 32141
Al-Ce-Si CeAl0.5 Si0.5 TlI,oS8,63 Cmcm 0.45015,1.1395,0.40972,90,90,90 CrB(TlI)-FeB - 5.30 A 43109
Al-Ce-Si CeAl1.2 Si0.8 ThSi2,tI12,141 I41/amd 0.42741,0.42741,1.4732,90,90,90 - - 4.81 X 34785
Al-Ce-Si CeAl1.5 Si0.5 AlB2,hP3,191 P6/mmm 0.433,0.433,0.4335,90,90,120 AlB2 family - 4.59 X 31896
Al-Ce-Si CeAl1.94 Si0.06 MgCu2,cF24,227 Fd-3m 0.804,0.804,0.804,90,90,90 Friauf-Laves phase - 4.96 X 3532
Al-Ce-Si CeAl2Si2 m Ce2SO2,hP5,164 P-3m1 0.421,0.421,0.694,90,90,120 - - 3.90 A 7031
Al-Ce-Si CeAl2.7 Si0.3 rt Mg3Cd,hP8,194 P63 /mmc 0.6505,0.6505,0.4593,90,90,120 close-packed structure - 4.37 A 33249
Al-Ce-Si Ce3Al4Si6 Ce3Al4Si6 ,hP13,164 P-3m1 0.41887,0.41887,1.81202,90,90,120 - - 4.20 X 32141
Al-Ce-Sn CeAl1.625 Sn0.375 AlB2,hP3,191 P6/mmm 0.4454,0.4454,0.4282,90,90,120 AlB2 family - 5.16 X 3532
Al-Ce-Sn CeAl1.97 Sn0.03 MgCu2,cF24,227 Fd-3m 0.805,0.805,0.805,90,90,90 Friauf-Laves phase - 5.01 X 3532
Al-Ce-Ta CeTa2 Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4748,1.4748,1.4748,90,90,90 - - 4.31 A 34455
Al-Ce-Th Th0.5 Ce0.5 Al3 Mg3Cd,hP8,194 P63 /mmc 0.6518,0.6518,0.4619,90,90,120 close-packed structure - 5.22 A 18413
Al-Ce-Th Th1.5 Ce0.5 Al CuAl2,tI12,140 I4/mcm 0.76,0.76,0.586,90,90,90 - - 8.73 A 1985
Al-Ce-Ti CeTi2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.471,1.471,1.471,90,90,90 - - 3.24 X 58994
Al-Ce-U Ce0.2 U0.8 Al2 MgCu2,cF24,227 Fd-3m 0.779,0.779,0.779,90,90,90 Friauf-Laves phase - 7.66 X 27951
Al-Ce-U Ce0.7 U0.3 Al2 MgCu2,cF24,227 Fd-3m 0.797,0.797,0.797,90,90,90 Friauf-Laves phase - 5.86 X 27951
Al-Ce-V CeV2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4558,1.4558,1.4558,90,90,90 - - 3.37 X 58994
Al-Ce-W CeW2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4589,1.4589,1.4589,90,90,90 - - 4.48 A 30512
Al-Ce-Y Y0.85 Ce0.15 Al2 MgCu2,cF24,227 Fd-3m 0.78893,0.78893,0.78893,90,90,90 Friauf-Laves phase - 4.07 X 20229
Al-Ce-Zn ZnCeAl KHg2,oI12,74 Imma 0.4634,0.761,0.7735,90,90,90 AlB2 family - 5.66 A 24841
Al-Ce-Zn Zn0.3 CeAl0.7 CsCl,cP2,221 Pm-3m 0.3715,0.3715,0.3715,90,90,90 b.c.c. family - 5.79 X 25375
Al-Ce-Zn Zn2CeAl2 CeAl2Ga2,tI10,139 I4/mmm 0.4244,0.4244,1.0986,90,90,90 - gray silver 5.45 X 18106
Al-Cl-Co CoAl2Cl8 CoAl2Cl8,mS44,15 C12/c1 1.6883,0.775,1.15,90,130.695,90 - blue bright 2.31 X 1625
Al-Cl-Cr CrAl2Cl8 CrAl2Cl8,oP44,29 Pca21 1.51007,0.60418,1.30077,90,90,90 - colorless 2.18 X 49758
Al-Cl-Cs CsAlCl4 Ba[SO4],oP24,62 Pnma 1.1641,0.7116,0.9373,90,90,90 - colorless 2.58 X 12108
Al-Cl-Cu CuAlCl4 m CuAlCl4,oP24,33 Pna21 1.28388,0.76455,0.61264,90,90,90 - colorless 2.57 X 34326
Al-Cl-Cu CuAlCl4 rt CuAlCl4,tP12,112 P-42c 0.543,0.543,1.0096,90,90,90 - colorless 2.59 X 15746
Al-Cl-Cu CuAl2Cl8 CuAl2Cl8,mP22,14 P121/c1 0.6582,0.7362,1.2265,90,94.03,90 - green 2.25 X 29782
Al-Cl-Dy DyAl3Cl12 rt DyAl3Cl12 ,hP48,151 P3112 1.0492,1.0492,1.5636,90,90,120 - colorless 2.24 X 24189
Al-Cl-Eu EuAl2Cl8 *,oP44,61 Pbca 1.1353,2.0253,1.1459,90,90,90 - colorless 1.23 N 25901
Al-Cl-Eu EuAl3Cl12 DyAl3Cl12 ,hP48,151 P3112 1.0518,1.0518,1.572,90,90,120 - - 2.18 A 25901
Al-Cl-Ga AlGaCl4 AlGaCl4,mP24,14 P121/c1 0.7164,1.0179,1.13915,90,125.686,90 - - 2.35 X 20828
Al-Cl-Hg Hg3Al2Cl8 Hg3Al2Cl8 ,mP52,14 P121/c1 0.71321,1.50468,1.41771,90,99.05,90 - yellow 4.15 X 6669
Al-Cl-Ho HoAl3Cl12 rt DyAl3Cl12 ,hP48,151 P3112 1.0486,1.0486,1.5625,90,90,120 - pinkish 2.25 A 24189
Al-Cl-I [ICl2]AlCl4 [ICl2]AlCl4,mP16,4 P1211 0.611,1.102,0.692,90,99.1,90 - red 2.65 X 1073
Al-Cl-I [I3Cl2]AlCl4 [I3Cl2]AlCl4,mS80,15 C12/c1 2.753,0.712,1.4188,90,110.36,90 - black 3.16 X 14802
Al-Cl-In AlInCl4 Ba[SO4],oP24,62 Pnma 1.0937,0.70519,0.92671,90,90,90 - colorless 2.64 X 44261
Al-Cl-K KAlCl4 ht Ba[SO4],oP24,62 Pnma 1.0859,0.7142,0.9387,90,90,90 - colorless 1.90 A 13862
Al-Cl-K KAlCl4 rt KAlCl4,mP24,4 P1211 0.7183,1.0481,0.9273,90,93.1,90 - colorless 1.98 X 11178
Al-Cl-Li LiAlCl4 LiAlCl4,mP24,14 P121/c1 0.7004,0.6503,1.2996,90,93.3,90 - colorless 1.98 X 15669
Al-Cl-Mg MgAl2Cl8 CoAl2Cl8,mS44,15 C12/c1 1.69828,0.78959,1.1617,90,130.767,90 - - 2.04 X 20574
Al-Cl-Na NaAlCl4 NaAlCl4,oP24,19 P212121 0.6165,0.9887,1.0314,90,90,90 - colorless 2.03 X 15669
Al-Cl-Nb NbAlCl8 NbAlCl8,oS40,63 Cmcm 0.8016,1.7139,0.8116,90,90,90 - yellow 2.40 X 16985
Al-Cl-Ni NiAl2Cl8 CoAl2Cl8,mS44,15 C12/c1 1.68399,0.77141,1.14547,90,130.759,90 - orange 2.34 X 49725
Al-Cl-O AlClO GaClO,oP12,29 Pca21 0.55,0.823,0.492,90,90,90 - colorless 2.34 A 2033
Al-Cl-Pd PdAl2Cl8 PdAl2Cl8,mP22,14 P121/c1 0.6583,0.7342,1.3033,90,96.4,90 - red dark 2.36 X 14726
Al-Cl-Rb RbAlCl4 Ba[SO4],oP24,62 Pnma 1.1135,0.7083,0.9258,90,90,90 - colorless 2.31 A 13862
Al-Cl-S AlSCl7 AlSCl7,mP18,7 P1c1 0.6287,0.6266,1.3047,90,101.36,90 - - 2.02 X 16709
Al-Cl-Se AlSeCl *,mP120,11 P121/m1 1.633,1.287,1.8172,90,94.,90 - - - N 3448
Al-Cl-Se AlSeCl7 AlSeCl7,aP18,1 P1 0.63761,0.827,0.987,86.2,77.586,83.237 - yellow 2.33 X 5699
Al-Cl-Se AlSe2Cl4 AlSe2Cl4,oP56,55 Pbam 1.3223,1.3245,0.9266,90,90,90 - orange 2.67 X 15231
Al-Cl-Se AlSe4Cl4 AlSe4Cl4,oP72,29 Pca21 1.492,1.067,1.322,90,90,90 - - 3.06 X 5924
Al-Cl-Tb TbAl3Cl12 rt DyAl3Cl12 ,hP48,151 P3112 1.0498,1.0498,1.5673,90,90,120 - green light 2.22 X 38243
Al-Cl-Te AlTeCl7 mon AlTeCl7,mP36,14 P121/c1 0.66,1.2675,1.3578,90,105.72,90 - colorless 2.45 X 6338
Handbook of Inorganic Substances – Edition 2015 : Data 205

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Cl-Te AlTeCl7 tricl AlTeCl7,aP36,2 P-1 0.6554,0.8391,1.9691,92.79,96.11,97.31 - yellow 2.51 X 18973


Al-Cl-Te AlTe 2Cl4 AlTe 2Cl4,oP56,61 Pbca 1.0721,1.4128,1.1832,90,90,90 - violet 3.14 X 55491
Al-Cl-Te Al2Te 2Cl7 Al2Te2Cl7,mP44,14 P121/c1 0.9113,1.1151,1.3096,90,90.2,90 - rose 2.78 X 6665
Al-Cl-Ti TiAl2Cl8 mon1 TiAl2Cl8,mP22,14 P121/c1 0.5981,0.7477,1.3161,90,90.48,90 - blue 2.18 X 15470
Al-Cl-Ti TiAl2Cl8 mon2 CoAl2Cl8,mS44,15 C12/c1 1.71312,0.7708,1.1772,90,130.771,90 - - 2.18 X 26640
Al-Cl-Tl TlAlCl4 Ba[SO4],oP24,62 Pnma 1.0921,0.7031,0.9226,90,90,90 - colorless 3.50 X 53503
Al-Cl-V VAl2Cl8 CoAl2Cl8,mS44,15 C12/c1 1.69706,0.7763,1.1635,90,130.86,90 - amber 2.23 X 49572
Al-Cl-Y YAl3Cl12 DyAl3Cl12,hP48,151 P3112 1.0468,1.0468,1.5623,90,90,120 - colorless 2.00 X 31042
Al-Cl-Zr Zr12 Al4Cl51 *,mS48,12 C12/m1 2.31727,1.3323,0.66227,90,106.46,90 - black blue - P 13238
Al-Co-Cr CrCoAl MgAgAs,cF12,216 F-43m 0.5742,0.5742,0.5742,90,90,90 - - 4.84 X 52716
Al-Co-Cr CrCo 2Al rt Cu2MnAl,cF16,225 Fm-3m 0.589,0.589,0.589,90,90,90 b.c.c. family - 6.40 X 31938
Al-Co-Cr Cr0.25 Co0.5 Al0.25 W,cI2,229 Im-3m 0.286,0.286,0.286,90,90,90 b.c.c. family - 6.99 X 49220
Al-Co-Cr Cr0.5 CoAl0.5 ht CsCl,cP2,221 Pm-3m 0.28645,0.28645,0.28645,90,90,90 b.c.c. family - 6.95 X 50562
Al-Co-Cu CuCo 4Al12 CuCo 4Al12,mS102,8 C1m1 1.52202,0.80851,1.23898,90,108.114,90 - - 4.28 X 29634
Al-Co-Cu Cu0.71 Co0.29 Al CsCl,cP2,221 Pm-3m 0.2921,0.2921,0.2921,90,90,90 b.c.c. family - 5.94 X 41675
Al-Co-Cu Cu1.45 Co0.55 Al3 Ni2Al3,hP5,164 P-3m1 0.4112,0.4112,0.4958,90,90,120 - - 4.70 X 25389
Al-Co-Cu Cu2CoAl7 Cu2FeAl7,tP40,128 P4/mnc 0.63047,0.63047,1.4756,90,90,90 - - 4.25 X 754
Al-Co-Dy DyCoAl hex MgZn2,hP12,194 P63/mmc 0.5344,0.5344,0.85193,90,90,120 Friauf-Laves phase - 7.83 X 54623
Al-Co-Dy DyCo 1.6 Al0.4 cub MgCu2,cF24,227 Fd-3m 0.73,0.73,0.73,90,90,90 Friauf-Laves phase - 9.14 X 31921
Al-Co-Dy DyCo 4Al PrNi2Al3,hP6,191 P6/mmm 0.499,0.499,0.4028,90,90,120 - - 8.13 X 41768
Al-Co-Dy Dy2 Co2Al W2CoB2,oI10,71 Immm 0.4063,0.546,0.8438,90,90,90 - - 8.34 X 40993
Al-Co-Dy Dy2 Co3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.274,0.7522,0.9411,90,90,90 - - 5.48 A 38877
Al-Co-Er ErCo 0.4 Al1.6 cub MgCu2,cF24,227 Fd-3m 0.7677,0.7677,0.7677,90,90,90 Friauf-Laves phase - 6.87 X 14289
Al-Co-Er ErCo 0.5 Al1.5 hex MgZn2,hP12,194 P63/mmc 0.5403,0.5403,0.8625,90,90,120 Friauf-Laves phase - 7.23 X 7496
Al-Co-Er Er2Co2Al W2CoB2,oI10,71 Immm 0.4042,0.5436,0.8327,90,90,90 - - 8.70 A 40993
Al-Co-Er Er2Co3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.2738,0.7509,0.9378,90,90,90 - - 5.58 A 38877
Al-Co-Eu EuCo 2Al9 BaFe 2Al9,hP12,191 P6/mmm 0.7865,0.7865,0.3898,90,90,120 - gray silver 4.08 X 36722
Al-Co-Fe FeCo 2Al rt Cu2MnAl,cF16,225 Fm-3m 0.57254,0.57254,0.57254,90,90,90 b.c.c. family - 7.10 X 46387
Al-Co-Fe Fe0.5 CoAl0.5 ht CsCl,cP2,221 Pm-3m 0.28632,0.28632,0.28632,90,90,90 b.c.c. family - 7.10 X 46387
Al-Co-Ga CoAlGa2 IrIn3 ,tP16,136 P42/mnm 0.6232,0.6232,0.6396,90,90,90 - - 6.03 A 33267
Al-Co-Ga CoAl0.5 Ga0.5 CsCl,cP2,221 Pm-3m 0.2874,0.2874,0.2874,90,90,90 b.c.c. family - 7.50 X 26492
Al-Co-Gd GdCo 0.56 Al1.44 MgCu2,cF24,227 Fd-3m 0.77395,0.77395,0.77395,90,90,90 Friauf-Laves phase - 6.57 X 55807
Al-Co-Gd GdCo 0.87 Al1.13 MgZn2,hP12,194 P63/mmc 0.54578,0.54578,0.86718,90,90,120 Friauf-Laves phase - 7.10 A 55807
Al-Co-Gd GdCo 1.82 Al0.18 MgCu2,cF24,227 Fd-3m 0.7296,0.7296,0.7296,90,90,90 Friauf-Laves phase - 9.21 X 49457
Al-Co-Gd GdCo 3.97 Al1.03 CaCu5,hP6,191 P6/mmm 0.5051,0.5051,0.40396,90,90,120 - - 7.80 X 33292
Al-Co-Gd Gd2 Co15Al2 Ce2Co15Al2,hR57,166 R-3m 0.8418,0.8418,1.2272,90,90,120 CaCu5-Zr4Al3 - 8.28 A 38842
Al-Co-Gd Gd2 Co2Al W2CoB2,oI10,71 Immm 0.41016,0.5504,0.8536,90,90,90 - - 7.92 X 40993
Al-Co-Gd Gd2 Co3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.27883,0.74955,0.93711,90,90,90 - - 5.43 X 55917
Al-Co-Gd Gd2 Co6Al11 Th2Ni17,hP38,194 P63/mmc 0.8723,0.8723,0.8931,90,90,120 CaCu5-Zr4Al3 - 5.45 A 11727
Al-Co-Gd Gd5.17 Co1.8 Al2.03 Gd5Co 2Al2,oP18,55 Pbam 0.71329,1.41794,0.41725,90,90,90 - - 7.66 X 58593
Al-Co-Hf HfCoAl4 *,hP*,182 P6322 0.718,0.718,0.895,90,90,120 - - - N 4605
Al-Co-Hf HfCo 0.29Al1.71 MgCu2,cF24,227 Fd-3m 0.7375,0.7375,0.7375,90,90,90 Friauf-Laves phase - 8.01 X 5903
Al-Co-Hf HfCo 0.95Al1.05 MgZn2,hP12,194 P63/mmc 0.51,0.51,0.82,90,90,120 Friauf-Laves phase - 9.45 A 5903
Al-Co-Hf HfCo 2Al Cu2MnAl,cF16,225 Fm-3m 0.602,0.602,0.602,90,90,90 b.c.c. family - 9.84 X 31938
Al-Co-Hf Hf6CoAl2 *,hP9,182 P6322 0.781,0.781,0.328,90,90,120 - - 11.35 N 4605
Al-Co-Hf Hf6Co7Al16 Th6Mn23,cF116,225 Fm-3m 1.206,1.206,1.206,90,90,90 - - 7.25 A 4605
Al-Co-Ho HoCoAl MgZn2,hP12,194 P63/mmc 0.5336,0.5336,0.8487,90,90,120 Friauf-Laves phase - 7.96 A 7537
Al-Co-Ho HoCo0.3 Al1.7 MgCu2,cF24,227 Fd-3m 0.7737,0.7737,0.7737,90,90,90 Friauf-Laves phase - 6.55 X 7537
Al-Co-Ho Ho2 Co14Al3 Th2Ni17,hP38,194 P63/mmc 0.827,0.827,0.9706,90,90,120 CaCu5-Zr4Al3 - 7.14 A 17118
Al-Co-Ho Ho2 Co2Al W2CoB2,oI10,71 Immm 0.4058,0.5456,0.837,90,90,90 - - 8.51 A 40993
Al-Co-Ho Ho2 Co3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.2746,0.7511,0.938,90,90,90 - - 5.54 A 38877
Al-Co-La LaCoAl4 LaCoAl4,oP12,51 Pmma 0.7701,0.4082,0.7023,90,90,90 - - 4.60 X 10609
Al-Co-La LaCo 4Al CaCu5,hP6,191 P6/mmm 0.5152,0.5152,0.4045,90,90,120 - - 7.17 X 23456
Al-Co-La LaCo 9.1 Al3.9 NaZn13,cF112,226 Fm-3c 1.154,1.154,1.154,90,90,90 - - 6.75 A 23464
Al-Co-Lu LuCo 0.5 Al1.5 MgZn2,hP12,194 P63/mmc 0.5374,0.5374,0.8616,90,90,120 Friauf-Laves phase - 7.55 X 7496
Al-Co-Lu LuCo 1.56 Al0.44 MgCu2,cF24,227 Fd-3m 0.722,0.722,0.722,90,90,90 Friauf-Laves phase - 9.84 X 24956
Al-Co-Mn MnCo 2Al rt Cu2MnAl,cF16,225 Fm-3m 0.5749,0.5749,0.5749,90,90,90 b.c.c. family - 6.98 X 14341
Al-Co-Mn Mn0.005 Co0.0001 Al0.9949 Cu,cF4,225 Fm-3m 0.40455,0.40455,0.40455,90,90,90 close-packed structure - 2.72 X 5293
Al-Co-Mn Mn0.5 Co0.5 Al ht CsCl,cP2,221 Pm-3m 0.2925,0.2925,0.2925,90,90,90 b.c.c. family - 5.57 X 26257
Al-Co-Mn Mn2 CoAl Li2AgSb,cF16,216 F-43m 0.58388,0.58388,0.58388,90,90,90 b.c.c. family - 6.53 X 51222
Al-Co-Mo MoCo0.28 Al2.72 TiAl3,tI8,139 I4/mmm 0.3743,0.3743,0.8401,90,90,90 close-packed structure - 5.24 X 10954
Al-Co-Nb NbCo 0.06 Al2.94 TiAl3,tI8,139 I4/mmm 0.384,0.384,0.8617,90,90,90 close-packed structure - 4.59 X 54238
Al-Co-Nb NbCo 0.76 Al1.24 MgZn2,hP12,194 P63/mmc 0.49935,0.49935,0.80713,90,90,120 Friauf-Laves phase gray light 6.52 X 55572
Al-Co-Nb NbCo 2Al Cu2MnAl,cF16,225 Fm-3m 0.594,0.594,0.594,90,90,90 b.c.c. family - 7.54 X 31938
Al-Co-Nb Nb0.04 Co0.84 Al0.12 Cu,cF4,225 Fm-3m 0.3591,0.3591,0.3591,90,90,90 close-packed structure - 8.10 X 54238
Al-Co-Nb Nb0.12 CoAl0.88 CsCl,cP2,221 Pm-3m 0.2904,0.2904,0.2904,90,90,90 b.c.c. family - 6.36 X 54238
Al-Co-Nb Nb0.5 Co2Al0.5 ht MgZn2,hP12,194 P63/mmc 0.4752,0.4752,0.7746,90,90,120 Friauf-Laves phase - 7.80 A 19107
Al-Co-Nb Nb0.8 Co2Al0.2 MgCu2,cF24,227 Fd-3m 0.6759,0.6759,0.6759,90,90,90 Friauf-Laves phase - 8.50 X 18051
Al-Co-Nb Nb0.8 Co2Al0.2 MgNi2,hP24,194 P63/mmc 0.4772,0.4772,1.554,90,90,120 Friauf-Laves phase - 8.57 A 54238
Al-Co-Nb Nb1.34 Co0.08 Al0.58 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9892,0.9892,0.516,90,90,90 Frank-Kasper phase - 14.29 A 54238
Al-Co-Nb Nb6.29 Co4.06 Al2.65 W6Fe7,hR39,166 R-3m 0.4988,0.4988,2.696,90,90,120 Frank-Kasper phase - 7.68 A 54238
Al-Co-Nd NdCoAl4 LaCoAl4,oP12,51 Pmma 0.76574,0.40401,0.68499,90,90,90 - black 4.88 X 46643
Al-Co-Nd NdCo 2Al8 CeFe 2Al8,oP44,55 Pbam 1.24517,1.43621,0.40055,90,90,90 - - 4.43 X 52426
Al-Co-Nd NdCo 4Al CaCu5,hP6,191 P6/mmm 0.5067,0.5067,0.4039,90,90,120 - - 7.52 X 23455
Al-Co-Nd Nd2 Co2Al W2CoB2,oI10,71 Immm 0.4151,0.5579,0.8689,90,90,90 - - 7.15 X 40993
Al-Co-Nd Nd2 Co3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.28911,0.75594,0.94703,90,90,90 - black 5.10 X 46643
Al-Co-Nd Nd7 Co6Al7 Pr7Co6Al7,tP40,127 P4/mbm 1.37362,1.37362,0.42124,90,90,90 - - 6.49 X 38824
Al-Co-Ni CoNi2Al4 Ni3Ga4,cI112,230 Ia-3d 1.13962,1.13962,1.13962,90,90,90 - - 5.10 X 13761
206 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Co-Ni Co0.28 Ni2.72 Al Cu3Au,cP4,221 Pm-3m 0.3569,0.3569,0.3569,90,90,90 close-packed structure - 7.42 X 17833
Al-Co-Ni Co0.39 Ni0.33 Al0.28 In,tI2,139 I4/mmm 0.28,0.28,0.315,90,90,90 close-packed structure - 6.71 X 49230
Al-Co-Ni Co0.76 Ni0.66 Al0.58 lt CuAu,tP2,123 P4/mmm 0.27139,0.27139,0.31311,90,90,90 close-packed structure - 7.14 X 44989
Al-Co-Ni Co0.76 Ni0.66 Al0.58 rt CsCl,cP2,221 Pm-3m 0.28571,0.28571,0.28571,90,90,90 b.c.c. family - 7.06 X 44989
Al-Co-Ni Co1.48 Ni1.36 Al1.16 cub Cu2MnAl,cF16,225 Fm-3m 0.57138,0.57138,0.57138,90,90,90 b.c.c. family - 7.06 X 52040
Al-Co-Ni Co1.48 Ni1.36 Al1.16 tet VRh2Sn,tI8,139 I4/mmm 0.38261,0.38261,0.6392,90,90,90 b.c.c. family - 7.04 X 52040
Al-Co-Ni Co14.5 Ni14.5 Al71 *,o**,* - 0.815,3.766,3.94,90,90,90 - - - N 34602
Al-Co-Ni Co2NiAl9 Co2NiAl9,oI96,71 Immm 0.75553,1.20646,1.5353,90,90,90 - - 3.98 X 35245
Al-Co-Ni Co2.54 Ni1.46 Al9 (Co 0.64Ni0.36)4Al9,mS26,12 C12/m1 1.2146,0.40702,0.7652,90,105.88,90 - - 4.37 X 47286
Al-Co-Ni Co3.52 Ni0.48 Al12.1 (Co 0.88Ni0.12)4Al12.1 ,mS36,12 C12/m1 1.70377,0.40993,0.7491,90,115.941,90 - - 3.97 X 31148
Al-Co-O CoAl2O4 MgAl2O4,cF56,227 Fd-3m 0.81047,0.81047,0.81047,90,90,90 spinel family blue dark 4.41 X 57718
Al-Co-O Co2AlO4 MgAl2O4,cF56,227 Fd-3m 0.80868,0.80868,0.80868,90,90,90 spinel family - 5.25 X 59049
Al-Co-Pr PrCoAl4 LaCoAl4,oP12,51 Pmma 0.763,0.40416,0.6869,90,90,90 - - 4.83 X 43299
Al-Co-Pr PrCo 0.6 Al1.4 MgCu2,cF24,227 Fd-3m 0.768,0.768,0.768,90,90,90 Friauf-Laves phase - 6.28 X 3595
Al-Co-Pr PrCo 1.8 Al0.2 MgCu2,cF24,227 Fd-3m 0.7312,0.7312,0.7312,90,90,90 Friauf-Laves phase - 8.58 X 3595
Al-Co-Pr PrCo 2Al8 CeFe2Al8,oP44,55 Pbam 1.24623,1.437,0.40117,90,90,90 - - 4.39 X 45236
Al-Co-Pr PrCo 4Al PrNi2Al3,hP6,191 P6/mmm 0.5076,0.5076,0.4043,90,90,120 - - 7.43 X 40408
Al-Co-Pr Pr2Co14Al3 Zn17Th2,hR57,166 R-3m 0.8515,0.8515,1.2356,90,90,120 CaCu5-Zr4Al3 - 7.63 A 17164
Al-Co-Pr Pr2Co2Al ht Ca2Ir2Si,mS20,15 C12/c1 0.9595,0.5609,0.7758,90,103.89,90 - - 6.99 X 40993
Al-Co-Pr Pr2Co2Al rt W2CoB2,oI10,71 Immm 0.41592,0.5573,0.874,90,90,90 - - 6.99 X 40993
Al-Co-Pr Pr2Co6Al19 U2Co6Al19 ,mS108,12 C12/m1 1.76031,1.21052,0.82399,90,103.903,90 - - 4.47 X 45236
Al-Co-Pr Pr3Co8Al Ce3Co8Si,hP24,194 P63 /mmc 0.511,0.511,1.625,90,90,120 Laves-CaCu5 - 8.33 A 17920
Al-Co-Pr Pr7Co6Al7 Pr7Co6Al7 ,tP40,127 P4/mbm 1.3784,1.3784,0.4229,90,90,90 - - 6.32 X 19581
Al-Co-Pu PuCoAl ZrNiAl,hP9,189 P-62m 0.6844,0.6844,0.3922,90,90,120 Fe2P family - 10.33 A 8280
Al-Co-Ru Ru0.38 Co0.62 Al CsCl,cP2,221 Pm-3m 0.292,0.292,0.292,90,90,90 b.c.c. family - 6.80 X 13686
Al-Co-S CoAl2S4 FeGa2S4,hP7,164 P-3m1 0.362,0.362,1.197,90,90,120 - brown dark 2.95 X 55972
Al-Co-Sc ScCoAl MgZn2,hP12,194 P63 /mmc 0.51,0.51,0.82,90,90,120 Friauf-Laves phase - 4.71 X 2598
Al-Co-Sc ScCo 1.4Al0.6 MgCu2,cF24,227 Fd-3m 0.707,0.707,0.707,90,90,90 Friauf-Laves phase - 5.40 X 19343
Al-Co-Sc Sc2Co3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.255,0.7317,0.9084,90,90,90 - - 4.06 X 39260
Al-Co-Sc Sc6Co8Al15 Th6Mn23,cF116,225 Fm-3m 1.2094,1.2094,1.2094,90,90,90 - - 4.30 A 39260
Al-Co-Si CoAl0.23 Si0.77 FeSi,cP8,198 P213 0.44826,0.44826,0.44826,90,90,90 - - 6.40 A 44646
Al-Co-Si CoAl0.28 Si1.72 CaF2,cF12,225 Fm-3m 0.5402,0.5402,0.5402,90,90,90 fluorite family - 4.84 X 44646
Al-Co-Si CoAl0.64 Si0.36 CsCl,cP2,221 Pm-3m 0.28328,0.28328,0.28328,90,90,90 b.c.c. family - 6.31 X 44646
Al-Co-Si Co19Al45Si9.87 Co19Al45Si9.9 ,mS296,15 C12/c1 1.9991,1.9143,1.28137,90,123.583,90 - - 4.25 X 46468
Al-Co-Si Co2AlSi2 Ni2Al3,hP5,164 P-3m1 0.38696,0.38696,0.4758,90,90,120 - - 5.41 A 44646
Al-Co-Si Co2Al0.08Si0.92 Co2Si-b,oP12,62 Pnma 0.4917,0.37398,0.7105,90,90,90 - - 7.42 A 44646
Al-Co-Si Co2Al4.85 Si0.15 Co2Al5,hP28,194 P63 /mmc 0.7656,0.7656,0.75851,90,90,120 - - 4.36 A 44646
Al-Co-Si Co2Al8.27 Si0.73 Co2Al9,mP22,14 P121/c1 0.61915,0.62299,0.85508,90,94.918,90 - - 3.65 A 44646
Al-Co-Si Co2.8 Al5.5 Si1.7 *,o**,* - 0.396,0.694,1.216,90,90,90 - - - N 14669
Al-Co-Si Co3Al3Si4 Ru3Sn7,cI40,229 Im-3m 0.8091,0.8091,0.8091,90,90,90 - - 4.64 X 1718
Al-Co-Si Co3Al4Si2 *,mS*,* - 0.74293,0.38838,1.1851,90,103.171,90 - - - N 44646
Al-Co-Si Co4Al7.75 Si1.25 Co4Al7.75 Si1.25,mS32,12 C12/m1 1.19935,0.40098,0.7659,90,106.357,90 - - 4.51 X 44695
Al-Co-Si Co5Al14Si2 Co5Al14Si2,oP168,62 Pnma 1.38948,2.3039,0.73397,90,90,90 - - 4.12 X 46468
Al-Co-Si Co6Al11Si6 Co6Al11Si6,oP52,62 Pnma 2.13536,0.4042,0.72723,90,90,90 - gray 4.33 X 48083
Al-Co-Sm SmCoAl4 *,o**,* - 0.631,0.933,1.244,90,90,90 - - - N 17920
Al-Co-Sm SmCo0.3 Al1.7 MgCu2,cF24,227 Fd-3m 0.782,0.782,0.782,90,90,90 Friauf-Laves phase - 5.94 X 17920
Al-Co-Sm SmCo1.85 Al0.15 rt MgCu2,cF24,227 Fd-3m 0.731,0.731,0.731,90,90,90 Friauf-Laves phase - 8.96 X 17920
Al-Co-Sm SmCo2Al8 CeFe2Al8,oP44,55 Pbam 1.231,1.444,0.397,90,90,90 - - 4.56 A 17920
Al-Co-Sm SmCo4Al CaCu5,hP6,191 P6/mmm 0.5048,0.5048,0.4034,90,90,120 - - 7.71 X 23456
Al-Co-Sm Sm0.78 Co5.33 Al0.12 Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.49005,0.49005,0.40681,90,90,120 CaCu5-Zr4Al3 - 8.53 A 58570
Al-Co-Sm Sm2Co13.2 Al3.8 rt Zn17Th2,hR57,166 R-3m 0.8509,0.8509,1.2413,90,90,120 CaCu5-Zr4Al3 - 7.56 A 7489
Al-Co-Sm Sm2Co2Al W2CoB2,oI10,71 Immm 0.4118,0.5516,0.8591,90,90,90 - - 7.58 A 40993
Al-Co-Sm Sm2Co3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.28263,0.75192,0.94054,90,90,90 - - 5.28 X 55917
Al-Co-Sm Sm7Co6Al7 Pr7Co6Al7 ,tP40,127 P4/mbm 1.3618,1.3618,0.4182,90,90,90 - - 6.83 A 19581
Al-Co-Sr SrCo 2Al9 BaFe2Al9,hP12,191 P6/mmm 0.791,0.791,0.396,90,90,120 - - 3.47 X 9094
Al-Co-Ta TaCo2Al Cu2MnAl,cF16,225 Fm-3m 0.593,0.593,0.593,90,90,90 b.c.c. family - 10.38 X 31938
Al-Co-Ta Ta0.6 Co2Al0.4 MgNi2,hP24,194 P63 /mmc 0.4748,0.4748,1.5479,90,90,120 Friauf-Laves phase - 10.43 A 22428
Al-Co-Ta Ta0.8 Co2Al0.2 MgCu2,cF24,227 Fd-3m 0.6765,0.6765,0.6765,90,90,90 Friauf-Laves phase - 11.50 X 22428
Al-Co-Ta Ta5.7 Co2.9 Al4.4 W6Fe7,hR39,166 R-3m 0.4994,0.4994,2.738,90,90,120 Frank-Kasper phase - 11.13 A 4314
Al-Co-Tb TbCoAl MgZn2,hP12,194 P63 /mmc 0.537,0.537,0.8512,90,90,120 Friauf-Laves phase - 7.65 A 7537
Al-Co-Tb TbCo0.48 Al1.52 MgCu2,cF24,227 Fd-3m 0.7731,0.7731,0.7731,90,90,90 Friauf-Laves phase - 6.56 X 7537
Al-Co-Tb TbCo1.65 Al0.35 MgCu2,cF24,227 Fd-3m 0.727,0.727,0.727,90,90,90 Friauf-Laves phase - 9.18 X 7537
Al-Co-Tb Tb2Co2Al W2CoB2,oI10,71 Immm 0.4078,0.5472,0.8472,90,90,90 - - 8.13 X 40993
Al-Co-Tb Tb2Co3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.27606,0.74783,0.93332,90,90,90 - - 5.50 X 55917
Al-Co-Th ThCoAl ZrNiAl,hP9,189 P-62m 0.70467,0.70467,0.40364,90,90,120 Fe2P family - 9.13 A 4278
Al-Co-Th ThCo3Al2 PrNi2Al3,hP6,191 P6/mmm 0.5063,0.5063,0.4088,90,90,120 - - 8.47 X 12437
Al-Co-Ti TiCo 2Al rt Cu2MnAl,cF16,225 Fm-3m 0.585,0.585,0.585,90,90,90 b.c.c. family - 6.40 X 31938
Al-Co-Ti Ti0.5 CoAl0.5 CsCl,cP2,221 Pm-3m 0.2934,0.2934,0.2934,90,90,90 b.c.c. family - 6.34 X 58782
Al-Co-Ti Ti0.9 Co3Al0.1 Cu3Au,cP4,221 Pm-3m 0.36091,0.36091,0.36091,90,90,90 close-packed structure - 7.86 X 19411
Al-Co-Ti Ti1.2 Co0.3Al2.5 Cu3Au,cP4,221 Pm-3m 0.3965,0.3965,0.3965,90,90,90 close-packed structure - 3.80 X 38106
Al-Co-Ti Ti8.92 Co7.34 Al13.74 (Ti0.42 Al0.58)15Pt7Al8,cF120,225 Fm-3m 1.1936,1.1936,1.1936,90,90,90 - - 4.81 X 44639
Al-Co-Tm TmCoAl MgZn2,hP12,194 P63 /mmc 0.5276,0.5276,0.8435,90,90,120 Friauf-Laves phase - 8.32 A 6026
Al-Co-Tm TmCo1.9 Al0.1 MgCu2,cF24,227 Fd-3m 0.71646,0.71646,0.71646,90,90,90 Friauf-Laves phase - 10.24 X 33137
Al-Co-Tm TmCo4Al CaCu5,hP6,191 P6/mmm 0.4934,0.4934,0.4058,90,90,120 - - 8.38 X 23456
Al-Co-Tm Tm2Co2Al W2CoB2,oI10,71 Immm 0.4026,0.5421,0.8306,90,90,90 - - 8.84 A 40993
Al-Co-U UCoAl cub MgCu2,cF24,227 Fd-3m 0.7389,0.7389,0.7389,90,90,90 Friauf-Laves phase - 10.67 X 18567
Al-Co-U UCoAl hex MgNi2,hP24,194 P63 /mmc 0.6514,0.6514,2.1414,90,90,120 Friauf-Laves phase - 5.47 A 2440
Al-Co-U UCoAl hp MgZn2,hP12,194 P63 /mmc 0.5961,0.5961,0.9846,90,90,120 Friauf-Laves phase - 7.10 X 24885
Handbook of Inorganic Substances – Edition 2015 : Data 207

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Co-U UCoAl rt ZrNiAl,hP9,189 P-62m 0.6675,0.6675,0.3962,90,90,120 Fe2P family - 10.56 A 35925


Al-Co-U UCoAl4 UCoAl4,hP18,189 P-62m 0.9161,0.9161,0.4114,90,90,120 - black 6.75 X 42591
Al-Co-U UCo 0.6Al2.4 Cu3Au,cP4,221 Pm-3m 0.42,0.42,0.42,90,90,90 close-packed structure - 7.58 X 28753
Al-Co-U UCo 1.5Al0.5 MgZn2,hP12,194 P63/mmc 0.512,0.512,0.7693,90,90,120 Friauf-Laves phase - 12.93 X 2426
Al-Co-U UCo 2.4Al0.6 PuNi3,hR36,166 R-3m 0.498,0.498,2.439,90,90,120 Laves-CaCu5 - 11.29 A 28753
Al-Co-U U2Co 2Al Mo2 FeB2,tP10,127 P4/mbm 0.7091,0.7091,0.3461,90,90,90 - - 11.85 X 4090
Al-Co-U U2Co 3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.2824,0.7515,0.9249,90,90,90 - - 6.67 X 48362
Al-Co-U U2Co 6Al19 U2Co 6Al19,mS108,12 C12/m1 1.74617,1.20474,0.82003,90,103.915,90 - black 5.32 X 41947
Al-Co-U U3Co 4.55Al11.45 Gd3Ru4Al12,hP38,194 P63/mmc 0.86518,0.86518,0.9262,90,90,120 - black 7.14 X 43386
Al-Co-V VCoAl MgZn2,hP12,194 P63/mmc 0.4953,0.4953,0.7961,90,90,120 Friauf-Laves phase - 5.37 A 2738
Al-Co-V VCo 2Al Cu2MnAl,cF16,225 Fm-3m 0.57798,0.57798,0.57798,90,90,90 b.c.c. family - 6.74 X 55291
Al-Co-V V0.5 CoAl0.5 CsCl,cP2,221 Pm-3m 0.2885,0.2885,0.2885,90,90,90 b.c.c. family - 6.77 X 23465
Al-Co-W WCoAl MgZn2,hP12,194 P63/mmc 0.4939,0.4939,0.7984,90,90,120 Friauf-Laves phase - 10.62 A 2738
Al-Co-Y YCoAl MgZn2,hP12,194 P63/mmc 0.539,0.539,0.867,90,90,120 Friauf-Laves phase - 5.32 X 7030
Al-Co-Y YCoAl2 MgCuAl2,oS16,63 Cmcm 0.408,1.015,0.706,90,90,90 - - 4.58 X 7033
Al-Co-Y YCo 0.6 Al1.4 MgCu2,cF24,227 Fd-3m 0.771,0.771,0.771,90,90,90 Friauf-Laves phase - 4.70 X 5907
Al-Co-Y YCo 1.85 Al0.15 MgCu2,cF24,227 Fd-3m 0.7266,0.7266,0.7266,90,90,90 Friauf-Laves phase - 6.99 X 28013
Al-Co-Y YCo 2Al7 *,o**,* - 0.41,1.195,1.69,90,90,90 - - - N 5907
Al-Co-Y YCo 4Al PrNi2Al3,hP6,191 P6/mmm 0.4982,0.4982,0.4023,90,90,120 - - 6.75 X 40408
Al-Co-Y Y2Co 15Al2 Th2Ni17,hP38,194 P63/mmc 0.838,0.838,0.819,90,90,120 CaCu5-Zr4Al3 - 7.44 A 5907
Al-Co-Y Y2Co 2Al W2CoB2,oI10,71 Immm 0.4076,0.5485,0.8476,90,90,90 - - 5.66 A 40993
Al-Co-Y Y2Co 3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.274,0.74635,0.9321,90,90,90 - - 4.48 X 26068
Al-Co-Yb YbCoAl MgZn2,hP12,194 P63/mmc 0.5298,0.5298,0.8466,90,90,120 Friauf-Laves phase - 8.36 A 6026
Al-Co-Yb YbCo 2Al8 CeFe 2Al8,oP44,55 Pbam 1.2383,1.44004,0.39608,90,90,90 - - 4.77 X 32518
Al-Co-Zr ZrCoAl4 *,hP*,182 P6322 0.726,0.726,0.909,90,90,120 - - - N 4606
Al-Co-Zr ZrCo 0.5 Al1.5 MgCu2,cF24,227 Fd-3m 0.7378,0.7378,0.7378,90,90,90 Friauf-Laves phase - 5.33 X 2957
Al-Co-Zr ZrCo 1.2 Al0.8 MgZn2,hP12,194 P63/mmc 0.50721,0.50721,0.81725,90,90,120 Friauf-Laves phase - 6.70 A 26743
Al-Co-Zr ZrCo 2Al Cu2MnAl,cF16,225 Fm-3m 0.608,0.608,0.608,90,90,90 b.c.c. family - 6.98 X 31938
Al-Co-Zr Zr0.8 Co2Al0.2 MgCu2,cF24,227 Fd-3m 0.6888,0.6888,0.6888,90,90,90 Friauf-Laves phase - 7.98 X 18051
Al-Co-Zr Zr6CoAl2 K2UF6,hP9,189 P-62m 0.793,0.793,0.331,90,90,120 Fe2P family - 6.08 X 5217
Al-Co-Zr Zr6Co7Al16 Mg6 Cu16Si7,cF116,225 Fm-3m 1.217,1.217,1.217,90,90,90 - - 5.13 A 4606
Al-Cr-Cu CuCrAl MoSi2,tI6,139 I4/mmm 0.299,0.299,0.865,90,90,90 b.c.c. family - 6.12 A 2865
Al-Cr-Cu Cu0.355 Cr0.035 Al0.61 rt *,cF*,* - 0.5828,0.5828,0.5828,90,90,90 - - - N 48665
Al-Cr-Cu Cu0.72 Cr0.36 Al0.92 ht CsCl,cP2,221 Pm-3m 0.298,0.298,0.298,90,90,90 b.c.c. family - 5.60 X 46645
Al-Cr-Cu Cu1.04 Cr3.77 Al8.19 ht Cu5Zn8,cI52,217 I-43m 0.9066,0.9066,0.9066,90,90,90 γ-brass - 4.31 A 48665
Al-Cr-Cu Cu11.06 Cr0.14 Al8.80 *,m**,* - 0.823,0.928,0.90325,90,93.064,90 - white - N 35849
Al-Cr-Cu Cu12.7 Cr19Al83.8 Cu7.5 (Cu0.54 Cr0.46)3...,hP244,176 P63/m 1.7714,1.7714,1.2591,90,90,120 - - 3.94 X 40222
Al-Cr-Cu Cu18.5 Cr17.0 Al66.8 Cu12.3(Cu0.26 Cr0.74)...,cF412,216 F-43m 1.816,1.816,1.816,90,90,90 - black 4.28 X 40222
Al-Cr-Cu Cu19 Cr12.7 Al68.3 *,cI*,* - 1.26,1.26,1.26,90,90,90 - gray - N 35849
Al-Cr-Cu Cu2CrAl Cu2MnAl,cF16,225 Fm-3m 0.5809,0.5809,0.5809,90,90,90 b.c.c. family - 6.98 X 14341
Al-Cr-Cu Cu2.3 Cr6.5Al43.2 V7 Al45,mS104,12 C12/m1 2.0594,0.7574,1.0949,90,107.339,90 - gray 3.36 A 35849
Al-Cr-Dy DyCrAl8 *,hP*,* - 1.075,1.075,1.76,90,90,120 - - - N 12791
Al-Cr-Dy DyCr2Al20 CeCr2Al20,cF184,227 Fd-3m 1.44523,1.44523,1.44523,90,90,90 - - 3.55 X 45626
Al-Cr-Dy DyCr4Al8 CeMn4Al8,tI26,139 I4/mmm 0.887,0.887,0.504,90,90,90 CaCu5-Zr4Al3 - 4.91 X 12791
Al-Cr-Dy Dy6 Cr4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0848,1.0848,1.765,90,90,120 - - 4.33 A 29673
Al-Cr-Er ErCr2Al20 CeCr2Al20,cF184,227 Fd-3m 1.438,1.438,1.438,90,90,90 - - 3.62 A 4015
Al-Cr-Er ErCr4Al8 CeMn4Al8,tI26,139 I4/mmm 0.89244,0.89244,0.51244,90,90,90 CaCu5-Zr4Al3 - 4.81 X 23593
Al-Cr-Er Er6Cr5.96Al41.04 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0853,1.0853,1.7543,90,90,120 - gray 4.49 X 29664
Al-Cr-Eu EuCr2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4485,1.4485,1.4485,90,90,90 - - 3.48 A 34455
Al-Cr-F CrAlF5 Cr2F5,mS28,15 C12/c1 0.758,0.746,0.70026,90,120.531,90 - - 3.39 A 7684
Al-Cr-Fe CrFe 2Al Cu2MnAl,cF16,225 Fm-3m 0.5805,0.5805,0.5805,90,90,90 b.c.c. family - 6.47 X 14341
Al-Cr-Fe CrFe 4Al12 Fe4Al13,mS102,12 C12/m1 1.5543,0.8029,1.245,90,107.47,90 - - 4.03 A 33134
Al-Cr-Fe Cr0.16 Fe0.84 Al2.5 FeAl2.8 ,oS24,63 Cmcm 0.7694,0.6443,0.4227,90,90,90 - - 3.89 A 33134
Al-Cr-Fe Cr0.25 Fe0.5 Al0.25 In,tI2,139 I4/mmm 0.3235,0.3235,0.4977,90,90,90 close-packed structure - 3.04 X 48747
Al-Cr-Fe Cr0.3 Fe0.4 Al0.3 ht2 W,cI2,229 Im-3m 0.2916,0.2916,0.2916,90,90,90 b.c.c. family - 6.17 X 39027
Al-Cr-Fe Cr0.5 FeAl0.5 ht1 CsCl,cP2,221 Pm-3m 0.2895,0.2895,0.2895,90,90,90 b.c.c. family - 6.52 X 58525
Al-Cr-Fe Cr0.8 Fe5.2 Al12 rt Fe5(Fe 0.5 Al0.5)3Al10,aP18,1 P1 0.4863,0.6454,0.87183,88.115,74.823,83.13 - - 4.15 A 33134
Al-Cr-Fe Cr0.95 Fe0.55 Al3.5 *,hP*,194 P63/mmc 2.1469,2.1469,1.634,90,90,120 - - - N 33134
Al-Cr-Fe Cr1.76 Fe0.24 Al rt MoSi2,tI6,139 I4/mmm 0.2977,0.2977,0.868,90,90,90 b.c.c. family - 5.69 X 4517
Al-Cr-Fe Cr18 Fe15Al120 Cr18 Fe15Al120 ,oI366,71 Immm 1.25,1.2617,3.0651,90,90,90 - - 3.44 X 43230
Al-Cr-Fe Cr2.8 Fe1.2 Al9 rt *,h**,* - 1.2847,1.2847,1.5459,90,90,120 - - - N 33134
Al-Cr-Fe Cr3.4 Fe6.6 Al16 rt Cr4.5(Cr0.56 Al0.44 )9Al12,hR78,160 R3m 1.2546,1.2546,0.7824,90,90,120 γ-brass - 4.56 A 33134
Al-Cr-Fe Cr63.4 Fe51.4 Al477.2 Cr63.4 Fe51.4 Al477.4 ,hP1192,176 P63/m 4.068,4.068,1.2546,90,90,120 - - 3.52 X 36938
Al-Cr-Gd GdCr2Al20 CeCr2Al20,cF184,227 Fd-3m 1.44832,1.44832,1.44832,90,90,90 - - 3.50 X 48675
Al-Cr-Gd GdCr3.5 Al8.5 CeMn4Al8,tI26,139 I4/mmm 0.899,0.899,0.51229,90,90,90 CaCu5-Zr4Al3 - 4.56 X 48630
Al-Cr-Gd Gd6 Cr4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.09252,1.09252,1.77563,90,90,120 - - 4.18 X 59675
Al-Cr-Ge CrAlGe TiSi2,oF24,70 Fddd 0.475,0.8224,0.8695,90,90,90 - - 5.93 X 20678
Al-Cr-Ge CrAl10.7 Ge1.3 WAl12,cI26,204 Im-3 0.75204,0.75204,0.75204,90,90,90 - - 3.40 X 17462
Al-Cr-Hf HfCrAl MgZn2,hP12,194 P63/mmc 0.518,0.518,0.847,90,90,120 Friauf-Laves phase - 8.69 A 2432
Al-Cr-Ho HoCr2Al20 CeCr2Al20,cF184,227 Fd-3m 1.439,1.439,1.439,90,90,90 - - 3.60 A 4015
Al-Cr-Ho HoCr4Al8 CeMn4Al8,tI26,139 I4/mmm 0.891,0.891,0.5126,90,90,90 CaCu5-Zr4Al3 - 4.81 A 12492
Al-Cr-Ho Ho6 Cr5.6 Al41.4 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0962,1.0962,1.7715,90,90,120 - gray 4.32 X 29664
Al-Cr-La LaCr2Al20 CeCr2Al20,cF184,227 Fd-3m 1.455,1.455,1.455,90,90,90 - - 3.37 X 58994
Al-Cr-La LaCr3Al9 ThMn12,tI26,139 I4/mmm 0.9138,0.9138,0.511,90,90,90 CaCu5-Zr4Al3 - 4.19 A 6308
Al-Cr-La LaCr4Al8 CeMn4Al8,tI26,139 I4/mmm 0.9156,0.9156,0.5137,90,90,90 CaCu5-Zr4Al3 - 4.34 A 9924
Al-Cr-La La2Cr6Al11 Zn17 Th2,hR57,166 R-3m 0.9154,0.9154,1.339,90,90,120 CaCu5-Zr4Al3 - 4.55 A 6308
Al-Cr-Lu LuCr6Al6 CeMn4Al8,tI26,139 I4/mmm 0.8866,0.8866,0.5119,90,90,90 CaCu5-Zr4Al3 - 5.36 A 13328
Al-Cr-Lu Lu6Cr6.76 Al40.24 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0851,1.0851,1.7322,90,90,120 - gray 4.68 X 29664
208 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Cr-Mg Mg3Cr2Al18 Mg3Cr2Al18,cF184,227 Fd-3m 1.453,1.453,1.453,90,90,90 - - 2.87 X 953


Al-Cr-Mn Cr0.01 Mn0.02 Al0.97 Cu,cF4,225 Fm-3m 0.4032,0.4032,0.4032,90,90,90 close-packed structure - 2.82 X 4825
Al-Cr-Mn Cr0.20 Mn0.80 Al12 WAl12,cI26,204 Im-3 0.7509,0.7509,0.7509,90,90,90 - - 2.97 X 6869
Al-Cr-Mn Cr0.33 Mn0.33 Al0.34 W,cI2,229 Im-3m 0.296,0.296,0.296,90,90,90 b.c.c. family - 5.69 X 2432
Al-Cr-Mn Cr0.6Mn1.4 Al11 *,mS*,15 C12/c1 1.76,3.05,1.76,90,90.,90 - - - N 52432
Al-Cr-Mn Cr1.5Mn0.5 Al rt MoSi2,tI6,139 I4/mmm 0.297,0.297,0.866,90,90,90 b.c.c. family - 5.76 A 2432
Al-Cr-Mn Cr2Mn2Al11 Mn4Al11,aP15,2 P-1 0.5051,0.5095,0.8879,74.92,89.35,79.53 - - 3.91 A 52432
Al-Cr-Mn Cr2.5Mn2.5 Al8 ht2 Cu5Zn8,cI52,217 I-43m 0.91,0.91,0.91,90,90,90 γ-brass - 4.26 A 52432
Al-Cr-Mn Cr27.5 Mn27.5 Al227 Mn55Al226.58 ,hP574,194 P63 /mmc 2.,2.,2.46,90,90,120 - - 3.53 A 52432
Al-Cr-Mn Cr3.9Mn3.1 Al45 V7 Al45,mS104,12 C12/m1 2.06013,0.7574,1.0949,90,107.353,90 - - 3.23 A 52432
Al-Cr-Mn Cr5Mn5Al16 ht1 Cr4.5(Cr0.56 Al0.44 )9Al12,hR78,160 R3m 1.27,1.27,0.794,90,90,120 γ-brass - 4.34 A 52432
Al-Cr-Mo Cr0.02 Mo0.01 Al0.97 Cu,cF4,225 Fm-3m 0.4031,0.4031,0.4031,90,90,90 close-packed structure - 2.86 X 4825
Al-Cr-Mo Cr0.40 Mo0.27 Al0.33 W,cI2,229 Im-3m 0.302,0.302,0.302,90,90,90 b.c.c. family - 6.70 X 2432
Al-Cr-Mo Cr1.8Mo0.2 Al rt MoSi2,tI6,139 I4/mmm 0.3,0.3,0.873,90,90,90 b.c.c. family - 5.91 A 2432
Al-Cr-N Cr0.57 Al0.43 N NaCl,cF8,225 Fm-3m 0.4136,0.4136,0.4136,90,90,90 rocksalt family - 5.19 X 49804
Al-Cr-Nb Nb0.07 Cr0.60 Al0.33 W,cI2,229 Im-3m 0.294,0.294,0.294,90,90,90 b.c.c. family - 6.09 X 2432
Al-Cr-Nb Nb0.2 Cr1.8 Al rt MoSi2,tI6,139 I4/mmm 0.2975,0.2975,0.8627,90,90,90 b.c.c. family - 6.05 A 2432
Al-Cr-Nb Nb0.5 Cr0.17 Al0.33 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.978,0.978,0.507,90,90,90 Frank-Kasper phase - 6.59 A 2432
Al-Cr-Nb Nb0.5 Cr2Al0.5 ht MgZn2,hP12,194 P63 /mmc 0.4964,0.4964,0.8143,90,90,120 Friauf-Laves phase - 6.27 A 19107
Al-Cr-Nb Nb0.76 Cr1.12 Al1.12 MgZn2,hP12,194 P63 /mmc 0.5037,0.5037,0.8293,90,90,120 Friauf-Laves phase - 5.80 A 4314
Al-Cr-Nb Nb0.9 Cr2Al0.1 ht MgCu2,cF24,227 Fd-3m 0.6809,0.6809,0.6809,90,90,90 Friauf-Laves phase - 8.01 X 19107
Al-Cr-Nb Nb3Cr0.6 Al0.4 Cr3Si,cP8,223 Pm-3n 0.519,0.519,0.519,90,90,90 Frank-Kasper phase - 7.62 X 4314
Al-Cr-Nd NdCr2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.441,1.441,1.441,90,90,90 - - 3.50 A 34455
Al-Cr-Nd NdCr4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.9,0.9,0.5136,90,90,90 CaCu5-Zr4Al3 - 4.54 A 12492
Al-Cr-Nd Nd6Cr4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0957,1.0957,1.7898,90,90,120 - - 3.99 A 29673
Al-Cr-Ni CrNiAl MgCu2,cF24,227 Fd-3m 0.7897,0.7897,0.7897,90,90,90 Friauf-Laves phase - 3.71 X 2320
Al-Cr-Ni CrNi2Al Cu2MnAl,cF16,225 Fm-3m 0.5737,0.5737,0.5737,90,90,90 b.c.c. family - 6.91 X 14341
Al-Cr-Ni Cr0.02 Ni1.02 Al2.96 Fe3C-b,oP16,62 Pnma 0.66157,0.73684,0.48175,90,90,90 - - 3.98 A 51108
Al-Cr-Ni Cr0.032 Ni0.015 Al0.953 Cu,cF4,225 Fm-3m 0.405,0.405,0.405,90,90,90 close-packed structure - 2.83 X 51108
Al-Cr-Ni Cr0.17 Ni0.77 Al1.06 CsCl,cP2,221 Pm-3m 0.28771,0.28771,0.28771,90,90,90 b.c.c. family - 5.76 X 51108
Al-Cr-Ni Cr0.24 Ni2.96 Al0.8 Cu3Au,cP4,221 Pm-3m 0.35861,0.35861,0.35861,90,90,90 close-packed structure - 7.48 X 51108
Al-Cr-Ni Cr0.25 Ni0.63 Al0.12 Cu,cF4,225 Fm-3m 0.35852,0.35852,0.35852,90,90,90 close-packed structure - 7.67 X 51108
Al-Cr-Ni Cr0.58 Ni0.34 Al4 *,oI*,71 Immm 1.2505,1.2619,3.066,90,90,90 - - - N 40220
Al-Cr-Ni Cr0.8 Ni0.04 Al0.16 W,cI2,229 Im-3m 0.29308,0.29308,0.29308,90,90,90 b.c.c. family - 6.37 X 51108
Al-Cr-Ni Cr12.4 Ni9.5 Al78.1 *,aP*,* - 1.255,1.775,2.51,69.3,75.524,69.3 - - - N 31712
Al-Cr-Ni Cr15.7 Ni5.8 Al78.5 mon *,mP*,* - 1.255,1.255,1.34,90,100.,90 - - - N 31712
Al-Cr-Ni Cr15.7 Ni5.8 Al78.5 orth *,oP*,33 Pna21 1.255,2.64,1.255,90,90,90 - - - N 31712
Al-Cr-Ni Cr18.7 Ni1.7 Al79.6 hex *,hP*,173 P63 3.07,3.07,1.24,90,90,120 - - - N 31712
Al-Cr-Ni Cr18.7 Ni1.7 Al79.6 rhom *,hR*,* - 1.77,1.77,8.04,90,90,120 - - - N 31712
Al-Cr-Ni Cr23.5 Ni3.9 Al112.6 Cr23.76(Cr0.23 Al0.77 ...,oS584,63 Cmcm 1.24,3.46,2.,90,90,90 - - 3.47 A 31712
Al-Cr-Ni Cr24.5 Ni0.5 Al88.5 Cr24.5 Ni0.5 Al88.5 ,hP238,176 P63 /m 1.7674,1.7674,1.2516,90,90,120 - - 3.62 X 34161
Al-Cr-Ni Cr3.4 Ni1.1 Al14.4 (Cr0.4 Ni0.1 Al0.5 )9Al10,hP228,173 P63 1.7674,1.7674,1.2516,90,90,120 - gray 3.71 X 32773
Al-Cr-Ni Cr53Ni2Al220 Mn55Al226.58 ,hP574,194 P63 /mmc 2.0201,2.0201,2.4896,90,90,120 - - 3.33 A 51108
Al-Cr-Ni Cr6.4 Ni1.1 Al44.5 mon1 V7 Al45,mS104,12 C12/m1 2.06546,0.75932,1.09703,90,107.263,90 - - 3.23 A 51108
Al-Cr-Ni Cr6.7 Ni0.9 Al44.4 mon2 *,mS208,12 C12/m1 1.1,2.47,1.32,90,113.85,90 - - - N 31712
Al-Cr-Ni Cr6.7 Ni0.9 Al44.4 tricl *,aP156,2 P-1 1.1,1.32,1.9013,105.818,95.431,113.85 - - - N 31712
Al-Cr-O Cr0.009 Al1.991 O3 Al2O3,hR30,167 R-3c 0.47606,0.47606,1.2994,90,90,120 - gray red 3.99 X 18423
Al-Cr-O Cr1.71 Al0.96 O4 Fe3O4,cF56,227 Fd-3m 0.7674,0.7674,0.7674,90,90,90 spinel family - 5.26 A 22603
Al-Cr-Pr PrCr2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4512,1.4512,1.4512,90,90,90 - - 3.41 X 58994
Al-Cr-Pr PrCr4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.9033,0.9033,0.5128,90,90,90 CaCu5-Zr4Al3 - 4.48 A 9924
Al-Cr-S Cr1.67 AlS4 MgAl2O4,cF56,227 Fd-3m 0.9893,0.9893,0.9893,90,90,90 spinel family brown 3.32 X 13508
Al-Cr-Si CrAl0.422 Si1.578 CrSi2,hP9,180 P6222 0.4496,0.4496,0.6377,90,90,120 - - 4.81 X 489
Al-Cr-Si Cr0.001 Al0.834 Si0.165 Cu,cF4,225 Fm-3m 0.40501,0.40501,0.40501,90,90,90 close-packed structure - 2.72 X 48613
Al-Cr-Si Cr0.82 Al0.107 Si0.073 W,cI2,229 Im-3m 0.29105,0.29105,0.29105,90,90,90 b.c.c. family - 6.41 X 48613
Al-Cr-Si Cr14.91 Al50.94 Si5.45 Cr14.91 Al50.94 Si5.45 ,oP592,62 Pnma 2.0098,1.2467,3.4477,90,90,90 - - 3.54 X 44870
Al-Cr-Si Cr2Al0.94 Si0.06 MoSi2,tI6,139 I4/mmm 0.3005,0.3005,0.8645,90,90,90 b.c.c. family - 5.57 A 48613
Al-Cr-Si Cr3Al0.6 Si0.4 Cr3Si,cP8,223 Pm-3n 0.4572,0.4572,0.4572,90,90,90 Frank-Kasper phase - 6.37 X 1486
Al-Cr-Si Cr3Al9Si Mn3Al9Si,hP26,194 P63 /mmc 0.75346,0.75346,0.78393,90,90,120 - - 3.68 A 48613
Al-Cr-Si Cr4Al13Si4 Cr4Al13Si4 ,cF84,216 F-43m 1.0917,1.0917,1.0917,90,90,90 - - 3.43 X 495
Al-Cr-Si Cr4Al8.9 Si2.1 Cr4Al8(Al0.3 Si0.7 )3,aP15,2 P-1 0.50489,0.51261,0.89839,73.446,84.132,79.262 - - 3.85 X 49302
Al-Cr-Si Cr5Al0.15 Si2.85 rt W5Si3,tI32,140 I4/mcm 0.9169,0.9169,0.46464,90,90,90 - - 5.85 A 48613
Al-Cr-Si Cr55Al197.2 Si25.6 Mn55Al226.58 ,hP574,194 P63 /mmc 2.0112,2.0112,2.4835,90,90,120 - - 3.40 A 48613
Al-Cr-Si Cr9.18 Al15.37 Si1.46 Cr4.5(Cr0.56 Al0.44 )9Al12,hR78,160 R3m 1.2694,1.2694,0.7964,90,90,120 γ-brass - 4.18 A 48613
Al-Cr-Sm SmCr2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4484,1.4484,1.4484,90,90,90 - - 3.47 X 58994
Al-Cr-Sm SmCr4Al8 ThMn12,tI26,139 I4/mmm 0.9001,0.9001,0.5198,90,90,90 CaCu5-Zr4Al3 - 4.53 X 21900
Al-Cr-Sm Sm6Cr4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0918,1.0918,1.7798,90,90,120 - - 4.10 A 29673
Al-Cr-Ta Ta0.5 Cr2Al0.5 MgZn2,hP12,194 P63 /mmc 0.4917,0.4917,0.8076,90,90,120 Friauf-Laves phase - 8.17 A 22428
Al-Cr-Tb TbCr2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4471,1.4471,1.4471,90,90,90 - - 3.52 X 21900
Al-Cr-Tb TbCr4Al8 ThMn12,tI26,139 I4/mmm 0.89,0.89,0.51382,90,90,90 CaCu5-Zr4Al3 - 4.76 X 21900
Al-Cr-Tb Tb6Cr5.6 Al41.4 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0964,1.0964,1.7719,90,90,120 - gray silver 4.25 X 29664
Al-Cr-Th ThCr1.825 Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.45214,1.45214,1.45214,90,90,90 - - 3.76 X 45626
Al-Cr-Th ThCr4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.9012,0.9012,0.51401,90,90,90 CaCu5-Zr4Al3 - 5.22 X 9924
Al-Cr-Ti TiCr0.1 Al0.9 CuAu,tP2,123 P4/mmm 0.28291,0.28291,0.40486,90,90,90 close-packed structure - 3.97 X 53042
Al-Cr-Ti TiCr0.4 Al1.6 HfGa2,tI24,141 I41/amd 0.39694,0.39694,2.429,90,90,90 close-packed structure - 3.88 A 53042
Al-Cr-Ti TiCr0.8 Al1.2 ht1 MgZn2,hP12,194 P63 /mmc 0.50365,0.50365,0.92801,90,90,120 Friauf-Laves phase - 3.97 A 53042
Al-Cr-Ti TiCr1.9 Al0.1 MgCu2,cF24,227 Fd-3m 0.6945,0.6945,0.6945,90,90,90 Friauf-Laves phase - 5.92 X 53042
Al-Cr-Ti Ti0.01 Cr0.01 Al0.98 Cu,cF4,225 Fm-3m 0.40481,0.40481,0.40481,90,90,90 close-packed structure - 2.75 X 53042
Al-Cr-Ti Ti0.1 Cr1.8 Al1.1 rt MoSi2,tI6,139 I4/mmm 0.3029,0.3029,0.8687,90,90,90 b.c.c. family - 5.34 A 53042
Handbook of Inorganic Substances – Edition 2015 : Data 209

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Cr-Ti Ti0.19 Cr0.50 Al0.31 W,cI2,229 Im-3m 0.29851,0.29851,0.29851,90,90,90 b.c.c. family - 5.43 X 53042
Al-Cr-Ti Ti0.3 Cr0.7 Al3 TiAl3,tI8,139 I4/mmm 0.38129,0.38129,0.8294,90,90,90 close-packed structure - 3.63 X 53042
Al-Cr-Ti Ti0.8 Cr6.5 Al44.7 V7 Al45,mS104,12 C12/m1 2.0755,0.76122,1.09998,90,107.131,90 - - 3.16 A 53042
Al-Cr-Ti Ti1.08 Cr0.32 Al2.6 Cu3Au,cP4,221 Pm-3m 0.3965,0.3965,0.3965,90,90,90 close-packed structure - 3.69 X 29836
Al-Cr-Ti Ti1.1 Cr9.7 Al15.2 Cr4.5(Cr0.56 Al0.44 )9Al12,hR78,160 R3m 1.2799,1.2799,0.7913,90,90,120 γ-brass - 4.29 A 53042
Al-Cr-Ti Ti1.2 Cr25.2 Al127.6 Cr19(Cr0.5Al0.5 )12Al123 ,mS732,15 C12/c1 1.7768,3.0491,1.7759,90,91.04,90 - - 3.32 A 53042
Al-Cr-Ti Ti1.3 Cr0.3 Al0.4 CsCl,cP2,221 Pm-3m 0.31854,0.31854,0.31854,90,90,90 b.c.c. family - 4.56 X 53042
Al-Cr-Ti Ti2.97 Cr0.07 Al0.96 Mg3 Cd,hP8,194 P63/mmc 0.5779,0.5779,0.4665,90,90,120 close-packed structure - 4.23 A 53042
Al-Cr-Tm TmCr6Al6 CeMn4Al8,tI26,139 I4/mmm 0.8872,0.8872,0.5122,90,90,90 CaCu5-Zr4Al3 - 5.30 A 13328
Al-Cr-Tm Tm6 Cr4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0818,1.0818,1.7533,90,90,120 - - 4.45 A 29673
Al-Cr-U UCr2Al20 CeCr2Al20,cF184,227 Fd-3m 1.44063,1.44063,1.44063,90,90,90 - - 3.92 X 58919
Al-Cr-U UCr4Al8 CeMn4Al8,tI26,139 I4/mmm 0.89132,0.89132,0.51091,90,90,90 CaCu5-Zr4Al3 - 5.42 X 24115
Al-Cr-U U6Cr4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0834,1.0834,1.7677,90,90,120 - - 5.17 A 29673
Al-Cr-V V0.07 Cr0.60 Al0.33 W,cI2,229 Im-3m 0.295,0.295,0.295,90,90,90 b.c.c. family - 5.65 X 2432
Al-Cr-V V0.2 Cr1.8 Al rt MoSi2,tI6,139 I4/mmm 0.301,0.301,0.862,90,90,90 b.c.c. family - 5.56 A 2432
Al-Cr-Y YCr2Al20 CeCr2Al20,cF184,227 Fd-3m 1.437,1.437,1.437,90,90,90 - - 3.28 A 4015
Al-Cr-Y YCr2.78 Al9.22 CeMn4Al8,tI26,139 I4/mmm 0.90299,0.90299,0.51208,90,90,90 CaCu5-Zr4Al3 - 3.84 X 30870
Al-Cr-Y Y6Cr6.57 Al40.43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.08601,1.08601,1.76783,90,90,120 - - 3.62 X 30870
Al-Cr-Yb YbCr2 Al20 CeCr2Al20,cF184,227 Fd-3m 1.4473,1.4473,1.4473,90,90,90 - - 3.58 X 58994
Al-Cr-Yb YbCr3.9 Al8.1 ThMn12,tI26,139 I4/mmm 0.894,0.894,0.51,90,90,90 CaCu5-Zr4Al3 - 4.84 A 30187
Al-Cr-Yb Yb6Cr4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.08819,1.08819,1.75876,90,90,120 - gray silver 4.43 X 59675
Al-Cr-Zn Zn0.24 Cr2Al0.76 rt MoSi2,tI6,139 I4/mmm 0.299,0.299,0.859,90,90,90 b.c.c. family - 6.06 A 2432
Al-Cr-Zn Zn13 Cr9.22 Al17.78 Zn13 (Cr0.34 Al0.66 )27,hR120,166 R-3m 0.75971,0.75971,3.6816,90,90,120 - gray silver 4.90 X 57457
Al-Cr-Zr ZrCr1.4Al0.6 MgZn2,hP12,194 P63/mmc 0.52,0.52,0.85,90,90,120 Friauf-Laves phase - 6.01 A 5570
Al-Cr-Zr ZrCr1.9Al0.1 rt MgCu2,cF24,227 Fd-3m 0.723,0.723,0.723,90,90,90 Friauf-Laves phase - 6.77 X 5570
Al-Cs-F CsAlF4 hex CsCrF4,hP18,189 P-62m 0.95,0.95,0.3713,90,90,120 - colorless 4.05 X 12865
Al-Cs-F CsAlF4 ht RbAlF4,tI120,120 I-4c2 1.18101,1.18101,1.33741,90,90,90 - - 4.20 X 25929
Al-Cs-F CsAlF4 rt CsAlF4,oP72,62 Pnma 1.05576,0.675,1.75954,90,90,90 - - 3.75 X 25929
Al-Cs-O CsAlO2 CsNbN2,cF32,227 Fd-3m 0.8098,0.8098,0.8098,90,90,90 - - 4.80 X 2164
Al-Cs-O Cs3AlO3 Cs3AlO3,mP56,14 P121/c1 0.7266,1.2564,1.4335,90,91.54,90 - colorless 4.81 X 24127
Al-Cs-O Cs9AlO4 Cs9InO4,tI56,140 I4/mcm 1.5572,1.5572,1.242,90,90,90 - - 2.84 X 53430
Al-Cs-P Cs3AlP 2 Cs3AlAs2,mP48,14 P121/c1 1.1233,0.8641,1.8986,90,100.056,90 - red dark 3.57 X 24288
Al-Cs-Sb Cs6AlSb3 Cs6AlSb3,mP20,11 P121/m1 1.0845,0.6507,1.2707,90,100.95,90 - black 4.49 X 24278
Al-Cs-Te CsAlTe 3 TlBS3,mP20,14 P121/c1 0.8154,1.394,0.7187,90,104.18,90 - gray 4.55 X 25654
Al-Cs-Te Cs3AlTe 3 Cs3GaSe3,mP28,14 P121/c1 0.91,1.4427,1.1908,90,126.38,90 - gray 4.27 X 25655
Al-Cs-Tl CsTl0.55 Al3.45 CeAl2Ga2,tI10,139 I4/mmm 0.4191,0.4191,1.1387,90,90,90 - black 5.62 X 26883
Al-Cu-Dy CuDyAl hp MgCu2,cF24,227 Fd-3m 0.7685,0.7685,0.7685,90,90,90 Friauf-Laves phase - 7.41 X 20231
Al-Cu-Dy CuDyAl rt ZrNiAl,hP9,189 P-62m 0.7015,0.7015,0.4024,90,90,120 Fe2P family - 7.35 A 35913
Al-Cu-Dy CuDyAl3 Ce(Ni0.59 Sb0.41 )4,oI10,71 Immm 0.4143,0.4205,0.9813,90,90,90 - - 5.96 A 22838
Al-Cu-Dy Cu0.45 DyAl0.55 CsCl,cP2,221 Pm-3m 0.3571,0.3571,0.3571,90,90,90 b.c.c. family - 7.51 X 22838
Al-Cu-Dy Cu0.9 DyAl2.1 PuNi3,hR36,166 R-3m 0.5457,0.5457,2.5317,90,90,120 Laves-CaCu5 - 6.33 A 26684
Al-Cu-Dy Cu1.94 DyAl0.06 KHg2,oI12,74 Imma 0.4312,0.6823,0.7301,90,90,90 AlB2 family - 8.89 A 22838
Al-Cu-Dy Cu10.3 Dy2Al6.7 Zn17 Th2,hR57,166 R-3m 0.8716,0.8716,1.2735,90,90,120 CaCu5-Zr4Al3 - 6.90 A 22838
Al-Cu-Dy Cu16 Dy6Al7 Mg6 Cu16Si7,cF116,225 Fm-3m 1.2275,1.2275,1.2275,90,90,90 - - 7.83 A 23310
Al-Cu-Dy Cu2.6 Dy3Al8.4 La3Al11,oI28,71 Immm 0.42125,0.98267,1.2432,90,90,90 - - 5.68 X 37386
Al-Cu-Dy Cu4DyAl CaCu5,hP6,191 P6/mmm 0.5064,0.5064,0.4152,90,90,120 - - 7.99 X 11684
Al-Cu-Dy Cu5.51 DyAl6.49 CeMn4Al8,tI26,139 I4/mmm 0.8694,0.8694,0.5116,90,90,90 CaCu5-Zr4Al3 - 5.91 X 56139
Al-Cu-Er CuErAl ZrNiAl,hP9,189 P-62m 0.6965,0.6965,0.4002,90,90,120 Fe2P family - 7.64 A 34409
Al-Cu-Er CuErAl3 Ce(Ni0.59Sb0.41 )4,oI10,71 Immm 0.4112,0.4184,0.9773,90,90,90 - - 6.16 A 22845
Al-Cu-Er Cu0.38 ErAl1.62 MgCu2,cF24,227 Fd-3m 0.7737,0.7737,0.7737,90,90,90 Friauf-Laves phase - 6.74 X 22845
Al-Cu-Er Cu0.60 ErAl0.40 CsCl,cP2,221 Pm-3m 0.3466,0.3466,0.3466,90,90,90 b.c.c. family - 8.62 X 22845
Al-Cu-Er Cu0.9 ErAl2.1 PuNi3,hR36,166 R-3m 0.5421,0.5421,2.5299,90,90,120 Laves-CaCu5 - 6.53 A 26684
Al-Cu-Er Cu1.9 Er3Al9.1 La3Al11,oI28,71 Immm 0.4187,0.9789,1.23518,90,90,90 - - 5.69 X 45628
Al-Cu-Er Cu16 Er6Al7 Mg6 Cu16Si7,cF116,225 Fm-3m 1.224,1.224,1.224,90,90,90 - - 8.00 A 23310
Al-Cu-Er Cu4ErAl CaCu5,hP6,191 P6/mmm 0.5039,0.5039,0.4139,90,90,120 - - 8.18 X 11684
Al-Cu-Er Cu4ErAl8 CeMn4Al8,tI26,139 I4/mmm 0.8663,0.8663,0.5105,90,90,90 CaCu5-Zr4Al3 - 5.52 A 22845
Al-Cu-Er Cu9.5 Er2Al7.5 Zn17 Th2,hR57,166 R-3m 0.871,0.871,1.2746,90,90,120 CaCu5-Zr4Al3 - 6.79 A 22845
Al-Cu-Eu Cu0.375 EuAl3.625 BaAl4,tI10,139 I4/mmm 0.42851,0.42851,1.129,90,90,90 - - 4.38 A 26689
Al-Cu-Eu Cu0.6 EuAl1.4 MgNi2,hP24,194 P63/mmc 0.589,0.589,1.917,90,90,120 Friauf-Laves phase - 5.26 A 26689
Al-Cu-Eu Cu2EuAl3 PrNi2Al3,hP6,191 P6/mmm 0.5387,0.5387,0.41396,90,90,120 - - 5.75 X 26689
Al-Cu-Eu Cu3.8 EuAl1.2 CaCu5,hP6,191 P6/mmm 0.52425,0.52425,0.40957,90,90,120 - - 7.25 X 26689
Al-Cu-Eu Cu4EuAl8 CeMn4Al8,tI26,139 I4/mmm 0.8872,0.8872,0.5122,90,90,90 CaCu5-Zr4Al3 - 5.12 A 26689
Al-Cu-Eu Cu6.41 EuAl6.59 NaZn13,cF112,226 Fm-3c 1.1928,1.1928,1.1928,90,90,90 - - 5.77 X 35768
Al-Cu-Eu Cu6.8 EuAl6.1 CaCu(Cu0.48 Al0.52)12 ,cF112,226 Fm-3c 1.19323,1.19323,1.19323,90,90,90 - - 5.85 X 58210
Al-Cu-Eu Cu8.4 Eu10Al12.6 Ca10 Cu(Cu0.4 Al0.6)18 Al2,hP93,191 P6/mmm 1.5528,1.5528,0.9414,90,90,120 - - 6.07 A 21802
Al-Cu-Fe CuFe 4Al12 CuFe4Al12,mS102,12 C12/m1 1.5603,0.79404,1.2506,90,108.07,90 - - 4.13 X 28805
Al-Cu-Fe Cu0.146 Fe0.834 Al1.02 ht CsCl,cP2,221 Pm-3m 0.29171,0.29171,0.29171,90,90,90 b.c.c. family - 5.58 X 53404
Al-Cu-Fe Cu0.2 FeAl2.67 FeAl2.8 ,oS24,63 Cmcm 0.76439,0.64476,0.42204,90,90,90 - - 4.49 A 52755
Al-Cu-Fe Cu0.26 FeAl5.74 MnAl6,oS28,63 Cmcm 0.74604,0.64343,0.87769,90,90,90 - - 3.59 X 1401
Al-Cu-Fe Cu0.50 Fe0.04 Al0.46 *,h**,* - 0.8146,0.8146,0.7557,90,90,120 - - - N 53404
Al-Cu-Fe Cu10 FeAl10 rt *,oF116,42 Fmm2 0.8153,1.4137,1.00736,90,90,90 - - 5.50 N 44635
Al-Cu-Fe Cu2FeAl7 Cu2FeAl7,tP40,128 P4/mnc 0.6336,0.6336,1.487,90,90,90 - - 4.14 X 754
Al-Cu-Fe Cu25.5 Fe12.5 Al62 *,c**,* - 0.63179,0.63179,0.63179,90,90,90 - - - N 28726
Al-Cu-Gd CuGdAl rt ZrNiAl,hP9,189 P-62m 0.7062,0.7062,0.4068,90,90,120 Fe2P family - 7.03 A 35913
Al-Cu-Gd CuGdAl3 BaAl4,tI10,139 I4/mmm 0.41591,0.41591,1.06363,90,90,90 - - 5.45 X 21780
Al-Cu-Gd Cu0.6 GdAl1.4 hp MgCu2,cF24,227 Fd-3m 0.78,0.78,0.78,90,90,90 Friauf-Laves phase - 6.53 X 7637
Al-Cu-Gd Cu0.9 GdAl2.1 PuNi3,hR36,166 R-3m 0.55153,0.55153,2.5519,90,90,120 Laves-CaCu5 - 6.03 X 38908
Al-Cu-Gd Cu1.86 GdAl0.14 KHg2,oI12,74 Imma 0.4342,0.6904,0.7342,90,90,90 AlB2 family - 8.43 A 19495
210 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Cu-Gd Cu2.1 Gd3Al8.9 La3Al11,oI28,71 Immm 0.42398,0.99393,1.25533,90,90,90 - - 5.31 X 38908


Al-Cu-Gd Cu4GdAl ht CaCu5,hP6,191 P6/mmm 0.50831,0.50831,0.4156,90,90,120 - - 7.83 X 46939
Al-Cu-Gd Cu4.7 GdAl7.3 ThMn12,tI26,139 I4/mmm 0.87559,0.87559,0.51445,90,90,90 CaCu5-Zr4Al3 - 5.50 X 38908
Al-Cu-Gd Cu6Gd2Al11 Th2Ni17,hP38,194 P63 /mmc 0.8923,0.8923,0.9016,90,90,120 CaCu5-Zr4Al3 - 5.30 A 11727
Al-Cu-Gd Cu6.6 GdAl4.4 Cu6(Cu0.1 Al0.9 )4TbAl,oF96,70 Fddd 0.65736,1.43034,1.49617,90,90,90 - - 6.57 X 38908
Al-Cu-Gd Cu7.8 GdAl3.2 BaCd11,tI48,141 I41/amd 1.02694,1.02694,0.66054,90,90,90 - - 7.05 X 38908
Al-Cu-Gd Cu9.4 Gd2Al7.6 Zn17Th2,hR57,166 R-3m 0.883,0.883,1.28568,90,90,120 CaCu5-Zr4Al3 - 6.41 X 38908
Al-Cu-Hf CuHfAl MgZn2,hP12,194 P63 /mmc 0.51567,0.51567,0.83211,90,90,120 Friauf-Laves phase - 9.33 X 56219
Al-Cu-Hf Cu0.5 HfAl1.5 cub MgCu2,cF24,227 Fd-3m 0.7343,0.7343,0.7343,90,90,90 Friauf-Laves phase - 8.41 X 56219
Al-Cu-Hf Cu0.5 HfAl2.5 Cu3Au,cP4,221 Pm-3m 0.4013,0.4013,0.4013,90,90,90 close-packed structure - 7.14 X 8180
Al-Cu-Hf Cu0.9 HfAl1.1 hex MgNi2,hP24,194 P63 /mmc 0.51641,0.51641,1.6763,90,90,120 Friauf-Laves phase - 9.11 X 56219
Al-Cu-Hf Cu2HfAl Cu2MnAl,cF16,225 Fm-3m 0.6172,0.6172,0.6172,90,90,90 b.c.c. family - 9.40 X 2803
Al-Cu-Hf Cu3.38 Hf6.24 Al3.38 W6Fe7,hR39,166 R-3m 0.5225,0.5225,2.88688,90,90,120 Frank-Kasper phase - 10.36 A 57893
Al-Cu-Ho CuHoAl3 Ce(Ni0.59 Sb0.41 )4,oI10,71 Immm 0.41331,0.42016,0.98176,90,90,90 - - 6.03 X 21120
Al-Cu-Ho Cu0.27 HoAl1.73 MgCu2,cF24,227 Fd-3m 0.7797,0.7797,0.7797,90,90,90 Friauf-Laves phase - 6.41 X 25472
Al-Cu-Ho Cu0.5 HoAl0.5 CsCl,cP2,221 Pm-3m 0.351,0.351,0.351,90,90,90 b.c.c. family - 8.07 X 25472
Al-Cu-Ho Cu0.9 HoAl2.1 PuNi3,hR36,166 R-3m 0.5451,0.5451,2.5306,90,90,120 Laves-CaCu5 - 6.40 X 26684
Al-Cu-Ho Cu1.23 HoAl0.77 ZrNiAl,hP9,189 P-62m 0.6969,0.6969,0.3984,90,90,120 Fe2P family - 7.84 A 44642
Al-Cu-Ho Cu1.85 HoAl0.15 KHg2,oI12,74 Imma 0.4292,0.6768,0.7297,90,90,90 AlB2 family - 8.98 A 25472
Al-Cu-Ho Cu11.58 Ho2Al5.42 Zn17Th2,hR57,166 R-3m 0.8665,0.8665,1.2663,90,90,120 CaCu5-Zr4Al3 - 7.33 A 44642
Al-Cu-Ho Cu16Ho6Al7 Mg6Cu16Si7,cF116,225 Fm-3m 1.2258,1.2258,1.2258,90,90,90 - - 7.92 A 25472
Al-Cu-Ho Cu2.28 HoAl2.72 CaCu5,hP6,191 P6/mmm 0.5248,0.5248,0.4088,90,90,120 - - 6.53 X 44642
Al-Cu-Ho Cu2.4 Ho3Al8.6 La3Al11,oI28,71 Immm 0.41962,0.9807,1.23946,90,90,90 - - 5.73 X 37386
Al-Cu-Ho Cu4.98 HoAl1.02 (Cu0.74 Mn0.26 )6Ce,tI14,139 I4/mmm 0.6404,0.6404,0.4922,90,90,90 - - 8.37 A 44642
Al-Cu-Ho Cu6.12 HoAl5.88 CeMn4Al8 ,tI26,139 I4/mmm 0.8663,0.8663,0.5004,90,90,90 CaCu5-Zr4Al3 - 6.30 A 44642
Al-Cu-In Cu0.92 Al0.03 In0.05 Cu,cF4,225 Fm-3m 0.3669,0.3669,0.3669,90,90,90 close-packed structure - 8.74 X 692
Al-Cu-In Cu9Al2.05 In1.95 rt Cu9Al4,cP52,215 P-43m 0.893,0.893,0.893,90,90,90 γ-brass - 7.94 A 692
Al-Cu-Ir CuIrAl2 rt CuIrAl2,oS16,67 Cmme 0.50646,0.81196,0.51851,90,90,90 - - 9.65 X 54552
Al-Cu-Ir Cu0.42 Ir0.58 Al CsCl,cP2,221 Pm-3m 0.29753,0.29753,0.29753,90,90,90 b.c.c. family - 10.41 X 54534
Al-Cu-Ir Cu0.45 Ir0.9 Al2.4 IrAl2.75 ,cP60,195 P23 0.76746,0.76746,0.76746,90,90,90 - - 7.83 A 54534
Al-Cu-Ir Cu7.74 Ir0.58 Al4.68 Cu5Zn8,cI52,217 I-43m 0.87433,0.87433,0.87433,90,90,90 γ-brass - 7.25 A 54534
Al-Cu-La CuLaAl3 BaAl4,tI10,139 I4/mmm 0.4294,0.4294,1.053,90,90,90 - - 4.85 A 4834
Al-Cu-La Cu0.5 LaAl3.5 CeAl2Ga2,tI10,139 I4/mmm 0.4309,0.4309,1.0817,90,90,90 - - 4.38 X 23588
Al-Cu-La Cu1.43 LaAl1.43 *,hP*,* - 0.8255,0.8255,0.6882,90,90,120 - - - N 19802
Al-Cu-La Cu2LaAl10 ThMn12,tI26,139 I4/mmm 0.88,0.88,0.517,90,90,90 CaCu5-Zr4Al3 - 4.44 A 4834
Al-Cu-La Cu3.5 LaAl1.5 PrNi2Al3,hP6,191 P6/mmm 0.52381,0.52381,0.42077,90,90,120 - - 6.67 X 27905
Al-Cu-La Cu4LaAl CaCu5,hP6,191 P6/mmm 0.5238,0.5238,0.4189,90,90,120 - - 7.01 X 11684
Al-Cu-La Cu6.28 LaAl6.72 NaZn13,cF112,226 Fm-3c 1.1949,1.1949,1.1949,90,90,90 - - 5.60 X 18075
Al-Cu-Li Li0.24 Cu0.96 Al1.8 CaF2,cF12,225 Fm-3m 0.58325,0.58325,0.58325,90,90,90 fluorite family - 3.72 X 691
Al-Cu-Li Li1.67 Cu1.67 Al3.33 Li1.67 Cu1.67 Al3.33 ,hP14,191 P6/mmm 0.4954,0.4954,0.9327,90,90,120 - gray 3.48 X 23721
Al-Cu-Li Li13Cu4.8 Al22.2 Li13(Cu0.53 Si0.47)27,cI160,204 Im-3 1.39056,1.39056,1.39056,90,90,90 - - 2.46 X 21673
Al-Cu-Li Li4Cu4.20 Al4.79 W6Fe7,hR39,166 R-3m 0.49301,0.49301,2.7561,90,90,120 Frank-Kasper phase gray dark 3.64 X 55667
Al-Cu-Li Li4Cu6.58 Al2.42 Li4Cu6(Cu0.19 Al0.81)3,hP26,194 P63 /mmc 0.49351,0.49351,1.838,90,90,120 - gray silver 4.38 X 49810
Al-Cu-Li Li6Cu9.6 Al11.4 Li6Cu8(Cu0.16 Al0.84)10Al3,tP54,127 P4/mbm 1.2696,1.2696,0.4982,90,90,90 - gray silver 3.97 X 49829
Al-Cu-Li Li9Cu7.5 Al3.5 Li9Cu7.5 Al3.5 ,oF84,69 Fmmm 0.49484,0.84367,2.9171,90,90,90 - - 3.46 X 53615
Al-Cu-Lu CuLuAl hp MgCu2,cF24,227 Fd-3m 0.7585,0.7585,0.7585,90,90,90 Friauf-Laves phase - 8.08 X 20231
Al-Cu-Lu Cu0.8 LuAl0.2 CsCl,cP2,221 Pm-3m 0.342,0.342,0.342,90,90,90 b.c.c. family - 9.60 X 26683
Al-Cu-Lu Cu0.9 LuAl2.1 PuNi3,hR36,166 R-3m 0.5347,0.5347,2.5196,90,90,120 Laves-CaCu5 - 6.92 A 26684
Al-Cu-Lu Cu1.1 LuAl0.9 rt ZrNiAl,hP9,189 P-62m 0.6898,0.6898,0.3959,90,90,120 Fe2P family - 8.22 A 26683
Al-Cu-Lu Cu1.85 LuAl0.15 KHg2,oI12,74 Imma 0.4276,0.6704,0.7242,90,90,90 AlB2 family - 9.49 A 26683
Al-Cu-Lu Cu16Lu6Al7 Mg6Cu16Si7,cF116,225 Fm-3m 1.2198,1.2198,1.2198,90,90,90 - - 8.25 X 23310
Al-Cu-Lu Cu3.5 LuAl1.5 CaCu5,hP6,191 P6/mmm 0.5082,0.5082,0.4135,90,90,120 - - 7.86 X 26683
Al-Cu-Lu Cu4.7 LuAl0.3 Be5Au,cF24,216 F-43m 0.6988,0.6988,0.6988,90,90,90 Friauf-Laves phase - 9.38 A 26683
Al-Cu-Lu Cu6LuAl6 CeMn4Al8 ,tI26,139 I4/mmm 0.8605,0.8605,0.505,90,90,90 CaCu5-Zr4Al3 - 6.38 A 13328
Al-Cu-Lu Cu9.1 Lu2Al7.9 Zn17Th2,hR57,166 R-3m 0.8746,0.8746,1.2771,90,90,120 CaCu5-Zr4Al3 - 6.72 A 26683
Al-Cu-Mg MgCuAl 10H Mg(Cu0.5 Al0.5)2,hP60,187 P-6m2 0.514,0.514,4.21,90,90,120 Friauf-Laves phase - 3.96 X 1613
Al-Cu-Mg MgCuAl 5H Mg(Cu0.5 Al0.5)2,hP30,164 P-3m1 0.514,0.514,2.105,90,90,120 - - 3.96 X 1613
Al-Cu-Mg MgCuAl 9R Mg(Cu0.5 Al0.5)2,hR54,166 R-3m 0.514,0.514,3.789,90,90,120 Friauf-Laves phase - 3.96 X 1613
Al-Cu-Mg MgCuAl2 MgCuAl2,oS16,63 Cmcm 0.40119,0.9265,0.7124,90,90,90 - gray silver 3.56 X 45854
Al-Cu-Mg MgCu0.8 Al1.2 2H MgZn2,hP12,194 P63 /mmc 0.512,0.512,0.839,90,90,120 Friauf-Laves phase - 3.75 A 14575
Al-Cu-Mg MgCu1.07 Al0.93 16H Mg(Cu0.54 Al0.46)2,hP96,194 P63 /mmc 0.510,0.510,6.67,90,90,120 Friauf-Laves phase - 4.15 X 11023
Al-Cu-Mg MgCu1.07 Al0.93 6H Mg(Cu0.54 Al0.46)2,hP36,187 P-6m2 0.510,0.510,2.50,90,90,120 Friauf-Laves phase - 4.15 X 11023
Al-Cu-Mg MgCu1.1 Al0.9 4H MgNi2,hP24,194 P63 /mmc 0.5102,0.5102,1.676,90,90,120 Friauf-Laves phase - 4.17 A 14575
Al-Cu-Mg MgCu1.3 Al0.7 3R MgCu2,cF24,227 Fd-3m 0.7117,0.7117,0.7117,90,90,90 Friauf-Laves phase - 4.64 X 14575
Al-Cu-Mg Mg11Cu6Al12 Mg11Cu6Al12,cF464,227 Fd-3m 2.01416,2.01416,2.01416,90,90,90 - - 3.16 X 56134
Al-Cu-Mg Mg2Cu6Al5 Mg2Cu6Al5,cP39,200 Pm-3 0.8311,0.8311,0.8311,90,90,90 - - 4.90 X 313
Al-Cu-Mg Mg32Cu8Al41 Mg32(Zn0.65 Al0.35)49,cI162,204 Im-3 1.435,1.435,1.435,90,90,90 Frank-Kasper phase - 2.69 A 2942
Al-Cu-Mn Cu0.01 Mn0.79 Al0.2 ht1 Mn,cP20,213 P4132 0.59615,0.59615,0.59615,90,90,90 - - 7.75 A 12484
Al-Cu-Mn Cu0.24 Mn0.8 Al0.96 ht1 CsCl,cP2,221 Pm-3m 0.2977,0.2977,0.2977,90,90,90 b.c.c. family - 5.36 X 55307
Al-Cu-Mn Cu0.25 Mn0.85 Al0.9 CuAu,tP2,123 P4/mmm 0.285,0.285,0.32,90,90,90 close-packed structure - 5.55 X 1676
Al-Cu-Mn Cu0.708 Mn0.042 Al0.250 *,o**,* - 0.424,0.445,0.53,90,90,90 - - - N 2761
Al-Cu-Mn Cu1.5 MnAl0.5 MgCu2,cF24,227 Fd-3m 0.69046,0.69046,0.69046,90,90,90 Friauf-Laves phase - 6.61 X 4154
Al-Cu-Mn Cu2MnAl rt Cu2MnAl,cF16,225 Fm-3m 0.5958,0.5958,0.5958,90,90,90 b.c.c. family - 6.56 X 14527
Al-Cu-Mn Cu2.2 Mn0.8 Al *,o**,* - 0.254,0.413,0.728,90,90,90 - - - N 30757
Al-Cu-Mn Cu2.5 Mn0.5 Al rt BiF3,cF16,225 Fm-3m 0.589,0.589,0.589,90,90,90 b.c.c. family - 6.93 X 14521
Al-Cu-Mn Cu4Mn11Al60 Mn11Ni4Al60,oS156,63 Cmcm 0.761,2.411,1.248,90,90,90 - - 3.59 A 22688
Al-Cu-Mn Cu5Mn3Al11 *,oP380,* - 1.21,1.921,2.408,90,90,90 - - - N 3297
Al-Cu-Mo Cu0.5 MoAl2.5 TiAl3,tI8,139 I4/mmm 0.3716,0.3716,0.8445,90,90,90 close-packed structure - 5.56 X 10952
Handbook of Inorganic Substances – Edition 2015 : Data 211

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Cu-Mo Cu2MoAl7 *,o**,* - 0.505,0.841,1.968,90,90,90 - - - N 10952


Al-Cu-Mo Cu2MoAl7.92 Cu2MoAl7.92 ,hP66,168 P6 0.86769,0.86769,1.52149,90,90,120 - - 4.39 X 58175
Al-Cu-Mo Cu2.3 MoAl7.7 (Cu0.23 Al0.77)10Mo,hP11,191 P6/mmm 0.50083,0.50083,0.76034,90,90,120 - - 4.52 X 37098
Al-Cu-Mo Cu2.50 MoAl7.50 (Cu0.83 Al0.17)3MoAl7 ,hP17,191 P6/mmm 0.5003,0.5003,0.76279,90,90,120 - - 4.59 X 58175
Al-Cu-Nb CuNbAl MgZn2,hP12,194 P63/mmc 0.5023,0.5023,0.809,90,90,120 Friauf-Laves phase - 6.89 A 4314
Al-Cu-Nb Cu0.05 Nb0.6 Al0.35 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9939,0.9939,0.517,90,90,90 Frank-Kasper phase - 6.67 A 4314
Al-Cu-Nb Cu3.25 Nb6.5 Al3.25 W6Fe7,hR39,166 R-3m 0.50276,0.50276,2.7361,90,90,120 Frank-Kasper phase - 7.47 A 57893
Al-Cu-Nd CuNdAl ZrNiAl,hP9,189 P-62m 0.7166,0.7166,0.4114,90,90,120 Fe2P family - 6.39 A 34409
Al-Cu-Nd CuNdAl3 BaNiSn3,tI10,107 I4mm 0.42191,0.42191,1.06264,90,90,90 - - 5.07 X 59275
Al-Cu-Nd Cu4NdAl CaCu5,hP6,191 P6/mmm 0.515,0.515,0.4181,90,90,120 - - 7.36 X 11684
Al-Cu-Nd Cu4NdAl8 CeMn4Al8,tI26,139 I4/mmm 0.884,0.884,0.519,90,90,90 CaCu5-Zr4Al3 - 5.03 A 9396
Al-Cu-Nd Cu6.5 NdAl6.5 NaZn13,cF112,226 Fm-3c 1.184,1.184,1.184,90,90,90 - - 5.86 A 13328
Al-Cu-Nd Cu8Nd2Al9 Zn17 Th2,hR57,166 R-3m 0.891,0.891,1.297,90,90,120 CaCu5-Zr4Al3 - 5.81 A 9396
Al-Cu-Nd Cu8.6 NdAl2.4 BaCd11,tI48,141 I41/amd 1.027,1.027,0.657,90,90,90 - - 7.24 A 9396
Al-Cu-Ni Cu0.03 Ni0.10 Al0.87 Cu,cF4,225 Fm-3m 0.365,0.365,0.365,90,90,90 close-packed structure - 4.27 X 34474
Al-Cu-Ni Cu0.06 Ni0.20 Al1.74 *,oP40,51 Pmma 0.453,0.52,3.8,90,90,90 close-packed structure - - N 34474
Al-Cu-Ni Cu0.2 Ni0.75Al0.05 Cu,cF4,225 Fm-3m 0.35427,0.35427,0.35427,90,90,90 close-packed structure - 8.68 X 149
Al-Cu-Ni Cu0.3 NiAl0.7 CuAu,tP2,123 P4/mmm 0.25988,0.25988,0.33004,90,90,90 close-packed structure - 7.20 X 50367
Al-Cu-Ni Cu0.5 Ni0.5Al CsCl,cP2,221 Pm-3m 0.29065,0.29065,0.29065,90,90,90 b.c.c. family - 5.96 X 54496
Al-Cu-Ni Cu0.6 Ni2Al1.4 Cu3Au,cP4,221 Pm-3m 0.35777,0.35777,0.35777,90,90,90 close-packed structure - 7.01 X 50367
Al-Cu-Ni Cu2Ni0.5 Al3.5 (Cu0.80 Ni0.20)2.53 Al3.5 ,hR42,166 R-3m 0.4105,0.4105,3.997,90,90,120 - gray 4.29 X 748
Al-Cu-Ni Cu2.74 Ni0.15 Al1.11 (Cu0.92 Ni0.08)2(Cu0....,mP24,11 P121/m1 0.4437,0.5301,1.2783,90,95.88,90 - - 7.09 X 12228
Al-Cu-Ni Cu2.75 Ni0.11 Al1.14 rt BiF3 ,cF16,225 Fm-3m 0.58412,0.58412,0.58412,90,90,90 b.c.c. family - 7.06 X 2983
Al-Cu-Ni Cu2.8 Ni0.1Al1.1 Cu3Ti,oP8,59 Pmmn 0.42244,0.53424,0.43896,90,90,90 close-packed structure - 7.16 X 23883
Al-Cu-Ni Cu8.5 Ni0.5Al4 rt Cu9Al4,cP52,215 P-43m 0.8735,0.8735,0.8735,90,90,90 γ-brass - 6.75 X 41500
Al-Cu-Np Cu4NpAl8 CeMn4Al8,tI26,139 I4/mmm 0.88,0.88,0.506,90,90,90 CaCu5-Zr4Al3 - 5.99 A 18172
Al-Cu-O CuAlO2 hex AgFeO2,hP8,194 P63/mmc 0.2863,0.2863,1.1314,90,90,120 - black 5.07 X 19727
Al-Cu-O CuAlO2 rhom CuFeO2,hR12,166 R-3m 0.28584,0.28584,1.6958,90,90,120 - black 5.09 X 15324
Al-Cu-O CuAl2O4 MgAl2O4,cF56,227 Fd-3m 0.80793,0.80793,0.80793,90,90,90 spinel family - 4.57 X 57717
Al-Cu-O Cu2Al4O7 Cu2Al4O7,cF52,216 F-43m 0.809,0.809,0.809,90,90,90 - red dark 4.35 X 14472
Al-Cu-Pd CuPd2Al ht1 *,tP*,123 P4/mmm 0.907,0.907,0.572,90,90,90 - - - N 6921
Al-Cu-Pd CuPd6Al3 *,o*10,* - 0.4036,0.52,0.776,90,90,90 - - 7.98 N 2342
Al-Cu-Pd Cu0.5 PdAl0.5 ht2 CsCl,cP2,221 Pm-3m 0.3003,0.3003,0.3003,90,90,90 b.c.c. family - 9.30 X 6921
Al-Cu-Pr CuPrAl ZrNiAl,hP9,189 P-62m 0.7225,0.7225,0.4157,90,90,120 Fe2P family - 6.14 X 54842
Al-Cu-Pr CuPrAl3 BaNiSn3,tI10,107 I4mm 0.42357,0.42357,1.06308,90,90,90 - - 4.97 X 59275
Al-Cu-Pr Cu0.3 PrAl1.7 MgCu2,cF24,227 Fd-3m 0.7989,0.7989,0.7989,90,90,90 Friauf-Laves phase - 5.36 X 3595
Al-Cu-Pr Cu4PrAl CaCu5,hP6,191 P6/mmm 0.5186,0.5186,0.4185,90,90,120 - - 7.19 X 11684
Al-Cu-Pr Cu4.65PrAl7.35 CeMn4Al8,tI26,139 I4/mmm 0.8792,0.8792,0.5156,90,90,90 CaCu5-Zr4Al3 - 5.29 X 54672
Al-Cu-Pr Cu6.5 PrAl6.5 NaZn13,cF112,226 Fm-3c 1.186,1.186,1.186,90,90,90 - - 5.81 A 13328
Al-Cu-Pr Cu7Pr2Al10 Zn17 Th2,hR57,166 R-3m 0.894,0.894,1.302,90,90,120 CaCu5-Zr4Al3 - 5.51 A 11480
Al-Cu-Pr Cu7.6 PrAl3.4 BaCd11,tI48,141 I41/amd 1.029,1.029,0.657,90,90,90 - - 6.83 A 11480
Al-Cu-Pt Cu0.5 PtAl0.5 CuAu,tP2,123 P4/mmm 0.281,0.281,0.3503,90,90,90 close-packed structure - 14.43 X 6345
Al-Cu-Re CuReAl8 *,m**,* - 0.512,0.875,1.744,90,90.3,90 - - - N 12696
Al-Cu-Re Cu2Re 2Al Mo2 FeB2,tP10,127 P4/mbm 0.5716,0.5716,0.3176,90,90,90 - - 16.85 X 12696
Al-Cu-Rh Cu0.10 RhAl0.76 CsCl,cP2,221 Pm-3m 0.2971,0.2971,0.2971,90,90,90 b.c.c. family - 8.22 X 19111
Al-Cu-Rh Cu0.44 Rh0.85 Al2.41 RhAl2.63 ,cP54,195 P23 0.7678,0.7678,0.7678,90,90,90 - - 5.30 A 50661
Al-Cu-Rh Cu2RhAl7 Cu2FeAl7,tP40,128 P4/mnc 0.639,0.639,1.4798,90,90,90 - - 4.60 A 50661
Al-Cu-Rh Cu9Rh25.5 Al65.5 rt *,cF*,202 Fm-3 1.5376,1.5376,1.5376,90,90,90 - - - N 50661
Al-Cu-Ru Cu0.25 RuAl5.75 MnAl6,oS28,63 Cmcm 0.7502,0.6512,0.8904,90,90,90 - - 4.16 A 42934
Al-Cu-Ru Cu0.63 Ru0.37 Al CsCl,cP2,221 Pm-3m 0.297,0.297,0.297,90,90,90 b.c.c. family - 6.62 X 42934
Al-Cu-Ru Cu19.5 Ru7Al35.5 Cu19.5 Ru7Al35.5 ,cP148,200 Pm-3 1.23773,1.23773,1.23773,90,90,90 - - 5.09 X 37318
Al-Cu-Ru Cu2RuAl7 ht *,hR*,* - 1.60689,1.60689,7.28654,90,90,120 - - - N 26593
Al-Cu-Ru Cu2RuAl7 rt Cu2FeAl7,tP40,128 P4/mnc 0.6433,0.6433,1.489,90,90,90 - - 4.50 A 42934
Al-Cu-Ru Cu8.5 Ru21Al70.5 ht *,cF*,202 Fm-3 1.5511,1.5511,1.5511,90,90,90 - - - N 42934
Al-Cu-S CuAlS2 CuFeS2,tI16,122 I-42d 0.5334,0.5334,1.0435,90,90,90 adamantane structure blue green 3.46 X 47380
Al-Cu-S Cu0.5 Al2.5 S4 MgAl2O4,cF56,227 Fd-3m 0.9955,0.9955,0.9955,90,90,90 spinel family orange 3.06 X 15663
Al-Cu-Sc CuScAl MgZn2,hP12,194 P63/mmc 0.504,0.504,0.824,90,90,120 Friauf-Laves phase - 4.96 X 3237
Al-Cu-Sc CuSc 0.5 Al0.5 stab CsCl,cP2,221 Pm-3m 0.31,0.31,0.31,90,90,90 b.c.c. family - 5.55 X 3237
Al-Cu-Sc Cu0.6 ScAl1.4 MgNi2,hP24,194 P63/mmc 0.5252,0.5252,1.7113,90,90,120 Friauf-Laves phase - 3.93 X 32366
Al-Cu-Sc Cu16.4 Sc6Al13.9 *,hP44,194 P63/mmc 0.8493,0.8493,0.887,90,90,120 - - - N 30049
Al-Cu-Sc Cu2ScAl Cu2MnAl,cF16,225 Fm-3m 0.6203,0.6203,0.6203,90,90,90 b.c.c. family - 5.54 X 32366
Al-Cu-Sc Cu2ScAl2 *,o**,* - 0.846,0.886,1.465,90,90,90 - - - N 10213
Al-Cu-Sc Cu6ScAl6 ThMn12,tI26,139 I4/mmm 0.863,0.863,0.51,90,90,90 CaCu5-Zr4Al3 - 5.14 X 10213
Al-Cu-Sc Cu6.25 Sc2Al4.75 Cu2(Cu0.47 Al0.53)9Sc2 ,oS108,65 Cmmm 0.8337,2.202,0.8305,90,90,90 - - 5.36 X 57096
Al-Cu-Sc Cu7.5 Sc2Al3.5 *,hP24,191 P6/mmm 0.4913,0.4913,1.842,90,90,120 - - 2.85 N 30049
Al-Cu-Se CuAlSe 2 rt CuFeS2,tI16,122 I-42d 0.56049,0.56049,1.09638,90,90,90 adamantane structure green 4.79 X 30127
Al-Cu-Se Cu0.5 Al2.5 Se4 rt MgAl2O4,cF56,227 Fd-3m 1.053,1.053,1.053,90,90,90 spinel family - 4.72 X 8684
Al-Cu-Si Cu0.01 Al0.97 Si0.02 Cu,cF4,225 Fm-3m 0.4041,0.4041,0.4041,90,90,90 close-packed structure - 2.75 X 52215
Al-Cu-Si Cu0.77 Al0.13 Si0.10 Mg,hP2,194 P63/mmc 0.25952,0.25952,0.42011,90,90,120 close-packed structure - 7.49 X 51923
Al-Cu-Si Cu0.82 Al0.01 Si0.17 Mn,cP20,213 P4132 0.6214,0.6214,0.6214,90,90,90 - - 7.91 A 52215
Al-Cu-Si Cu0.84 Al0.1 Si0.06 Cu,cF4,225 Fm-3m 0.3643,0.3643,0.3643,90,90,90 close-packed structure - 7.94 X 52215
Al-Cu-Si Cu14.63 Al0.285 Si4.085 Cu15 Si4,cI76,220 I-43d 0.9708,0.9708,0.9708,90,90,90 - - 7.64 A 52215
Al-Cu-Si Cu9.1 Al3.12 Si0.78 Cu9Al4,cP52,215 P-43m 0.8671,0.8671,0.8671,90,90,90 γ-brass - 6.97 A 52215
Al-Cu-Si CuxAlxSi C,cF8,227 Fd-3m 0.54334,0.54334,0.54334,90,90,90 - - 2.33 X 51923
Al-Cu-Sm CuSmAl hp MgCu2,cF24,227 Fd-3m 0.7777,0.7777,0.7777,90,90,90 Friauf-Laves phase - 6.80 X 20231
Al-Cu-Sm CuSmAl ZrNiAl,hP9,189 P-62m 0.7091,0.7091,0.407,90,90,120 Fe2P family - 6.77 A 34409
Al-Cu-Sm CuSmAl3 BaAl4,tI10,139 I4/mmm 0.4173,0.4173,1.0602,90,90,90 - - 5.30 X 17461
Al-Cu-Sm Cu1.82 SmAl0.18 KHg2,oI12,74 Imma 0.438,0.691,0.745,90,90,90 AlB2 family - 7.98 A 16015
212 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Cu-Sm Cu4SmAl CaCu5,hP6,191 P6/mmm 0.5126,0.5126,0.4168,90,90,120 - - 7.56 X 11684


Al-Cu-Sm Cu4SmAl8 CeMn4Al8 ,tI26,139 I4/mmm 0.8774,0.8774,0.5149,90,90,90 CaCu5-Zr4Al3 - 5.20 X 17461
Al-Cu-Sm Cu4.75 SmAl7.25 ThMn12,tI26,139 I4/mmm 0.8749,0.8749,0.5146,90,90,90 CaCu5-Zr4Al3 - 5.46 X 54672
Al-Cu-Sm Cu7SmAl6 NaZn13,cF112,226 Fm-3c 1.1829,1.1829,1.1829,90,90,90 - - 6.08 X 17461
Al-Cu-Sm Cu7Sm2Al10 Zn17Th2,hR57,166 R-3m 0.8855,0.8855,1.2899,90,90,120 CaCu5-Zr4Al3 - 5.78 A 15545
Al-Cu-Sn Cu0.75 Al0.20 Sn0.05 ht W,cI2,229 Im-3m 0.2971,0.2971,0.2971,90,90,90 b.c.c. family - 7.47 X 637
Al-Cu-Sn Cu3Al0.75 Sn0.25 BiF3,cF16,225 Fm-3m 0.594,0.594,0.594,90,90,90 b.c.c. family - 7.62 X 637
Al-Cu-Sn Cu39Al7.5 Sn5.5 rt *,c**,* - 1.77827,1.77827,1.77827,90,90,90 - - - N 637
Al-Cu-Sr SrCu0.15 Al3.85 BaAl4,tI10,139 I4/mmm 0.4421,0.4421,1.1237,90,90,90 - - 3.04 A 26689
Al-Cu-Sr SrCu0.6 Al3.4 CeAl2Ga2,tI10,139 I4/mmm 0.431,0.431,1.1322,90,90,90 - - 3.43 X 23588
Al-Cu-Sr SrCu4.4 Al0.6 CaCu5,hP6,191 P6/mmm 0.5296,0.5296,0.4075,90,90,120 - - 6.43 X 26689
Al-Cu-Sr SrCu5.98 Al7.02 NaZn13,cF112,226 Fm-3c 1.198,1.198,1.198,90,90,90 - - 5.08 A 35768
Al-Cu-Sr Sr6Cu6.6 Al7.4 Sr6Cu5(Cu0.4 Al0.6)4Al5,tI80,140 I4/mcm 0.8427,0.8427,2.5995,90,90,90 - - 4.12 X 20954
Al-Cu-Ta CuTaAl MgZn2,hP12,194 P63 /mmc 0.499,0.499,0.81,90,90,120 Friauf-Laves phase - 10.32 A 2741
Al-Cu-Ta Cu3.25 Ta6.5 Al3.25 W6Fe7,hR39,166 R-3m 0.50126,0.50126,2.7527,90,90,120 Frank-Kasper phase - 12.23 A 57893
Al-Cu-Ta Cu311.01 Ta2265.75 Al3206.89 Cu311.01 Ta2265.75 Al3...,cF23704,216 F-43m 7.149,7.149,7.149,90,90,90 - - 9.39 X 51865
Al-Cu-Ta Cu57.99 Ta584 Al834.95 Cu57.99 Ta584 Al834.95 ,cF6400,216 F-43m 4.5376,4.5376,4.5376,90,90,90 - - 9.38 X 51865
Al-Cu-Tb CuTbAl3 Ce(Ni0.59 Sb0.41 )4,oI10,71 Immm 0.4154,0.4212,0.9824,90,90,90 - - 5.86 A 21120
Al-Cu-Tb Cu0.3 TbAl1.7 hp MgCu2,cF24,227 Fd-3m 0.784,0.784,0.784,90,90,90 Friauf-Laves phase - 6.17 X 30985
Al-Cu-Tb Cu0.7 TbAl0.3 CsCl,cP2,221 Pm-3m 0.354,0.354,0.354,90,90,90 b.c.c. family - 7.92 X 30985
Al-Cu-Tb Cu0.9 TbAl2.1 PuNi3,hR36,166 R-3m 0.5475,0.5475,2.5393,90,90,120 Laves-CaCu5 - 6.18 A 30985
Al-Cu-Tb Cu1.15 TbAl0.85 ZrNiAl,hP9,189 P-62m 0.701,0.701,0.405,90,90,120 Fe2P family - 7.37 A 30985
Al-Cu-Tb Cu1.2 Tb3Al9.8 La3Al11,oI28,71 Immm 0.42288,0.99398,1.15276,90,90,90 - - 5.60 X 30985
Al-Cu-Tb Cu1.85 TbAl0.15 KHg2,oI12,74 Imma 0.4332,0.683,0.7327,90,90,90 AlB2 family - 8.60 A 30985
Al-Cu-Tb Cu4TbAl CaCu5,hP6,191 P6/mmm 0.5073,0.5073,0.4149,90,90,120 - - 7.90 X 11684
Al-Cu-Tb Cu4.6 TbAl7.4 CeMn4Al8 ,tI26,139 I4/mmm 0.872,0.872,0.513,90,90,90 CaCu5-Zr4Al3 - 5.54 X 30985
Al-Cu-Tb Cu6.38 TbAl4.62 ht Cu6(Cu0.1 Al0.9 )4TbAl,oF96,70 Fddd 0.65644,1.42792,1.48916,90,90,90 - - 6.56 X 31720
Al-Cu-Tb Cu8Tb2Al9 Zn17Th2,hR57,166 R-3m 0.8767,0.8767,1.2824,90,90,120 CaCu5-Zr4Al3 - 6.24 X 31720
Al-Cu-Te CuAlTe2 CuFeS2,tI16,122 I-42d 0.6035,0.6035,1.194,90,90,90 adamantane structure brown 5.28 X 46270
Al-Cu-Th CuThAl3 BaAl4,tI10,139 I4/mmm 0.4251,0.4251,1.0412,90,90,90 - - 6.65 A 35715
Al-Cu-Th Cu4ThAl8 CeMn4Al8 ,tI26,139 I4/mmm 0.8818,0.8818,0.5165,90,90,90 CaCu5-Zr4Al3 - 5.81 A 9924
Al-Cu-Ti CuTiAl MgZn2,hP12,194 P63 /mmc 0.5026,0.5026,0.8084,90,90,120 Friauf-Laves phase gray 5.20 X 2182
Al-Cu-Ti Cu0.25 TiAl2.75 ht ZrAl3,tI16,139 I4/mmm 0.3901,0.3901,1.66,90,90,90 close-packed structure - 3.63 A 2865
Al-Cu-Ti Cu0.44 Ti1.08 Al2.48 Cu3Au,cP4,221 Pm-3m 0.3942,0.3942,0.3942,90,90,90 close-packed structure brown 3.97 X 29836
Al-Cu-Ti Cu0.64 Ti8Al23.36 *,t**,* - 0.3848,0.3848,3.361,90,90,90 - - 3.52 N 2320
Al-Cu-Ti Cu2TiAl Cu2MnAl,cF16,225 Fm-3m 0.601,0.601,0.601,90,90,90 b.c.c. family gray 6.18 X 6343
Al-Cu-Tm CuTmAl hp MgCu2,cF24,227 Fd-3m 0.76,0.76,0.76,90,90,90 Friauf-Laves phase - 7.85 X 20231
Al-Cu-Tm CuTmAl ZrNiAl,hP9,189 P-62m 0.691,0.691,0.398,90,90,120 Fe2P family - 7.85 X 40405
Al-Cu-Tm CuTmAl3 Ce(Ni0.59 Sb0.41 )4,oI10,71 Immm 0.4093,0.4176,0.9775,90,90,90 - - 6.23 A 21120
Al-Cu-Tm Cu0.9TmAl2.1 PuNi3,hR36,166 R-3m 0.5402,0.5402,2.524,90,90,120 Laves-CaCu5 - 6.63 A 26684
Al-Cu-Tm Cu10Tm2Al7 Zn17Th2,hR57,166 R-3m 0.8735,0.8735,1.2738,90,90,120 CaCu5-Zr4Al3 - 6.88 A 28070
Al-Cu-Tm Cu16Tm6Al7 Mg6Cu16Si7,cF116,225 Fm-3m 1.2215,1.2215,1.2215,90,90,90 - - 8.09 A 23310
Al-Cu-Tm Cu4TmAl CaCu5,hP6,191 P6/mmm 0.5026,0.5026,0.4138,90,90,120 - - 8.26 X 11684
Al-Cu-Tm Cu5TmAl7 CeMn4Al8 ,tI26,139 I4/mmm 0.86694,0.86694,0.51112,90,90,90 CaCu5-Zr4Al3 - 5.84 X 59155
Al-Cu-U CuUAl2 CuUAl2,tI8,139 I4/mmm 0.3857,0.3857,0.8736,90,90,90 - - 9.09 X 13861
Al-Cu-U Cu3UAl2 PrNi2Al3,hP6,191 P6/mmm 0.5129,0.5129,0.415,90,90,120 - - 8.48 X 30415
Al-Cu-U Cu4UAl8 CeMn4Al8 ,tI26,139 I4/mmm 0.8763,0.8763,0.5104,90,90,90 CaCu5-Zr4Al3 gray silver 6.00 X 18106
Al-Cu-U Cu4.5 UAl0.5 Mg2Cu3Si,hP12,194 P63 /mmc 0.49135,0.49135,0.90942,90,90,120 Friauf-Laves phase - 9.39 X 35984
Al-Cu-U Cu7U2Al10 Zn17Th2,hR57,166 R-3m 0.8751,0.8751,1.28,90,90,120 CaCu5-Zr4Al3 gray silver 6.99 X 18106
Al-Cu-V Cu0.4 V0.6 Al3 TiAl3,tI8,139 I4/mmm 0.3762,0.3762,0.8335,90,90,90 close-packed structure - 3.86 X 2741
Al-Cu-V Cu0.65 V4.35 Al8 ht Cu5Zn8,cI52,217 I-43m 0.9185,0.9185,0.9185,90,90,90 γ-brass - 4.10 A 2741
Al-Cu-W Cu0.5 WAl2.5 TiAl3,tI8,139 I4/mmm 0.3716,0.3716,0.8381,90,90,90 close-packed structure - 8.12 X 16525
Al-Cu-W Cu2.3 WAl7.7 (Cu0.23 Al0.77)10Mo,hP11,191 P6/mmm 0.49997,0.49997,0.76286,90,90,120 - - 5.41 X 37098
Al-Cu-Y CuYAl ZrNiAl,hP9,189 P-62m 0.70223,0.70223,0.40331,90,90,120 Fe2P family - 5.19 X 41633
Al-Cu-Y Cu0.3 YAl1.7 MgCu2,cF24,227 Fd-3m 0.7835,0.7835,0.7835,90,90,90 Friauf-Laves phase - 4.25 X 41633
Al-Cu-Y Cu0.9 YAl2.1 PuNi3,hR36,166 R-3m 0.5479,0.5479,2.5393,90,90,120 Laves-CaCu5 - 4.59 A 26684
Al-Cu-Y Cu1.8 YAl0.2 KHg2,oI12,74 Imma 0.4313,0.6881,0.7295,90,90,90 AlB2 family - 6.40 A 41633
Al-Cu-Y Cu11.6 Y2Al5.4 Zn17Th2,hR57,166 R-3m 0.86958,0.86958,1.26376,90,90,120 CaCu5-Zr4Al3 - 6.38 X 41633
Al-Cu-Y Cu2Y3 Al7 Ca3Cu2Al7 ,hR36,166 R-3m 0.54877,0.54877,2.54016,90,90,120 Laves-CaCu5 - 4.38 X 41633
Al-Cu-Y Cu2.5 Y3Al8.5 La3Al11,oI28,71 Immm 0.42115,0.98356,1.24378,90,90,90 - - 4.22 X 41633
Al-Cu-Y Cu2.94 YAl2.06 CaCu5,hP6,191 P6/mmm 0.5172,0.5172,0.4141,90,90,120 - gray 5.74 X 38411
Al-Cu-Y Cu4.4 YAl7.6 CeMn4Al8 ,tI26,139 I4/mmm 0.87154,0.87154,0.51349,90,90,90 CaCu5-Zr4Al3 - 4.88 X 41633
Al-Cu-Y Cu6.5 YAl4.5 BaCd11,tI48,141 I41/amd 1.02774,1.02774,0.65838,90,90,90 - - 5.95 X 41633
Al-Cu-Y Cu6.8 YAl4.2 Cu6(Cu0.1 Al0.9 )4TbAl,oF96,70 Fddd 0.65654,1.42755,1.48587,90,90,90 - - 6.05 X 41633
Al-Cu-Yb CuYbAl hp MgCu2,cF24,227 Fd-3m 0.766,0.766,0.766,90,90,90 Friauf-Laves phase - 7.79 X 20231
Al-Cu-Yb CuYbAl ZrNiAl,hP9,189 P-62m 0.6925,0.6925,0.399,90,90,120 Fe2P family - 7.92 A 27373
Al-Cu-Yb CuYbAl3 BaAl4,tI10,139 I4/mmm 0.4293,0.4293,1.0654,90,90,90 - - 5.37 X 21120
Al-Cu-Yb Cu0.3 YbAl1.7 MgCu2,cF24,227 Fd-3m 0.784,0.784,0.784,90,90,90 Friauf-Laves phase - 6.56 X 27373
Al-Cu-Yb Cu0.9 YbAl2.1 PuNi3,hR36,166 R-3m 0.5471,0.5471,2.5358,90,90,120 Laves-CaCu5 - 6.52 A 27373
Al-Cu-Yb Cu16Yb6 Al7 Mg6Cu16Si7,cF116,225 Fm-3m 1.2234,1.2234,1.2234,90,90,90 - - 8.14 A 23310
Al-Cu-Yb Cu3.5 YbAl1.5 PrNi2Al3,hP6,191 P6/mmm 0.50464,0.50464,0.41434,90,90,120 - - 7.92 X 27905
Al-Cu-Yb Cu4.7 YbAl0.3 Be5Au,cF24,216 F-43m 0.6987,0.6987,0.6987,90,90,90 Friauf-Laves phase - 9.34 A 34478
Al-Cu-Yb Cu4.77 YbAl7.23 CeMn4Al8 ,tI26,139 I4/mmm 0.8721,0.8721,0.5118,90,90,90 CaCu5-Zr4Al3 - 5.73 X 54672
Al-Cu-Yb Cu5.12 YbAl0.88 YbMo2Al4 ,tI14,139 I4/mmm 0.63866,0.63866,0.49266,90,90,90 - - 8.63 X 28070
Al-Cu-Yb Cu8.5 Yb4Al24.5 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.8565,0.8565,1.6255,90,90,90 - - 5.27 X 25440
Al-Cu-Yb Cu9.6 Yb2Al7.4 Zn17Th2,hR57,166 R-3m 0.86907,0.86907,1.26979,90,90,120 CaCu5-Zr4Al3 - 6.93 X 28070
Al-Cu-Zn Cu0.004 Zn0.017 Al0.979 Cu,cF4,225 Fm-3m 0.40457,0.40457,0.40457,90,90,90 close-packed structure - 2.79 X 1002
Al-Cu-Zn Cu0.680 Zn2.748 Al0.572 rt BiF3,cF16,225 Fm-3m 0.5842,0.5842,0.5842,90,90,90 b.c.c. family - 7.94 X 15404
Handbook of Inorganic Substances – Edition 2015 : Data 213

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Cu-Zn Cu0.8 Zn0.2 Al ht CsCl,cP2,221 Pm-3m 0.2904,0.2904,0.2904,90,90,90 b.c.c. family - 6.16 X 227
Al-Cu-Zn Cu2.75 Zn0.58 Al0.67 rt Cu2MnAl,cF16,225 Fm-3m 0.5859,0.5859,0.5859,90,90,90 b.c.c. family - 7.62 X 26216
Al-Cu-Zn Cu3.2 Zn0.7 Al4.2 rt Cu3.2 (Zn0.18 Al0.82)4Al0.9 ,hR27,166 R-3m 0.41111,0.41111,2.5035,90,90,120 - - 4.93 X 9205
Al-Cu-Zn Cu69.6 Zn17.4 Al13.0 mar *,m**,* - 0.445,0.53,3.83,90,90.8,90 - - - N 21239
Al-Cu-Zr CuZr0.5 Al0.5 CsCl,cP2,221 Pm-3m 0.311,0.311,0.311,90,90,90 b.c.c. family - 6.77 X 1720
Al-Cu-Zr Cu0.35 Zr4Al2.65 rt Zr4Al3,hP7,191 P6/mmm 0.5405,0.5405,0.539,90,90,120 Frank-Kasper phase - 5.58 A 5570
Al-Cu-Zr Cu0.5 ZrAl2.5 Cu3Au,cP4,221 Pm-3m 0.404,0.404,0.404,90,90,90 close-packed structure - 4.80 X 2865
Al-Cu-Zr Cu0.856 ZrAl4 Cu0.856 ZrAl4,tP12,129 P4/nmm 0.40275,0.40275,1.17688,90,90,90 - - 4.41 X 58049
Al-Cu-Zr Cu1.2 ZrAl0.8 MgCu2,cF24,227 Fd-3m 0.73883,0.73883,0.73883,90,90,90 Friauf-Laves phase - 6.23 X 26743
Al-Cu-Zr Cu2ZrAl Cu2MnAl,cF16,225 Fm-3m 0.619,0.619,0.619,90,90,90 b.c.c. family - 6.87 X 2865
Al-Cu-Zr Cu4Zr6Al3 W6Fe7,hR39,166 R-3m 0.52751,0.52751,2.9029,90,90,120 Frank-Kasper phase - 6.28 X 57893
Al-Cu-Zr Cu5.832 ZrAl6.168 ThMn12,tI26,139 I4/mmm 0.85243,0.85243,0.50862,90,90,90 CaCu5-Zr4Al3 - 5.65 X 58049
Al-D-K KAlD4 Ba[SO4],oP24,62 Pnma 0.88514,0.58119,0.73457,90,90,90 - - 1.30 X 44861
Al-D-Li LiAlD4 rt mon1 LiAlH4,mP24,14 P121/c1 0.48254,0.7804,0.78968,90,112.268,90 - - 1.01 X 40261
Al-D-Li LiAlD4 rt mon2 LaNbO4,mS24,15 C12/c1 0.60368,1.0006,0.4099,90,134.315,90 - - 1.57 X 45497
Al-D-Li Li3AlD6 hp Mg3 [TeO6],hR60,148 R-3 0.80712,0.80712,0.9513,90,90,120 - - 1.11 X 41674
Al-D-Na NaAlD4 NaAlH4,tI24,88 I41/a 0.50119,0.50119,1.13147,90,90,90 - - 1.36 X 41693
Al-D-Na Na3AlD6 Na3AlF6,mP20,14 P121/c1 0.5408,0.5538,0.94692,90,124.998,90 - gray light 1.54 X 37315
Al-D-Nb Nb3.16 Al0.84 D2.52 Nb3(Nb0.16 Al0.84 )H2.5 ,cP54,223 Pm-3n 0.53627,0.53627,0.53627,90,90,90 - - 6.92 X 37369
Al-D-O AlO[OD] FeO[OH],oS12,63 Cmcm 0.28614,1.2246,0.36918,90,90,90 böhmite-D - 3.13 X 10841
Al-D-O Al[OD]3 mon1 Al[OH]3-a,mP32,14 P121/c1 0.50626,0.86719,1.06787,90,118.039,90 - - 2.60 X 11992
Al-D-O Al[OD]3 mon2 Al[OH]3,mP16,14 P121/c1 0.4713,0.8671,0.5062,90,90.27,90 - - 2.60 X 3789
Al-D-O Al[OD]3 orth Al[OH]3,oP16,19 P212121 0.50635,0.51397,0.72556,90,90,90 - - 2.85 X 55793
Al-D-O Al11 O16[OD] Al11 O16[OH],hP60,194 P63/mmc 0.56037,0.56037,2.26169,90,90,120 β-alumina - 3.08 X 18275
Al-D-Sr SrAl2D2 SrAl2H2,hP5,164 P-3m1 0.45253,0.45253,0.47214,90,90,120 - gray dark 2.89 X 37364
Al-D-Sr Sr2AlD7 Ba2AlH7,mS80,15 C12/c1 1.36191,0.97826,0.79816,90,114.93,90 - gray dark 2.98 X 40079
Al-D-Th Th2AlD3.85 Th2AlH3.85 ,tI28,140 I4/mcm 0.764,0.764,0.6536,90,90,90 - - 8.68 X 1986
Al-D-Y Y3 Al2D2.33 Y3 Al2H2.33 ,tP32,136 P42/mnm 0.8285,0.8285,0.75832,90,90,90 - - 4.15 X 52515
Al-D-Zr Zr3AlD0.16 CaTiO3,cP5,221 Pm-3m 0.43974,0.43974,0.43974,90,90,90 perovskite family - 5.88 X 23450
Al-D-Zr Zr3Al2D2.26 Zr3Al2H2.26 ,tP44,136 P42/mnm 0.7597,0.7597,0.72613,90,90,90 - - 5.26 X 41691
Al-D-Zr Zr4Al3D2.68 Zr4Al3H2.68 ,hP80,182 P6322 1.10017,1.10017,1.11694,90,90,120 - - 5.12 X 41691
Al-Dy-Er Dy0.03 Er0.97 Al3 Cu3Au,cP4,221 Pm-3m 0.4217,0.4217,0.4217,90,90,90 close-packed structure - 5.49 X 4603
Al-Dy-Er Dy0.1 Er0.9Al3 ht HoAl3,hR60,166 R-3m 0.6036,0.6036,3.577,90,90,120 close-packed structure - 5.47 A 4603
Al-Dy-Er Dy0.25 Er0.75 Al2 MgCu2,cF24,227 Fd-3m 0.78138,0.78138,0.78138,90,90,90 Friauf-Laves phase - 6.13 X 49348
Al-Dy-Fe DyFe 0.2 Al2.8 ht-hp Cu3Au,cP4,221 Pm-3m 0.4253,0.4253,0.4253,90,90,90 close-packed structure - 5.38 X 10748
Al-Dy-Fe DyFe 0.4 Al1.6 rt MgCu2,cF24,227 Fd-3m 0.77547,0.77547,0.77547,90,90,90 Friauf-Laves phase - 6.50 X 57117
Al-Dy-Fe DyFe 0.95 Al1.05 MgZn2,hP12,194 P63/mmc 0.5392,0.5392,0.8711,90,90,120 Friauf-Laves phase - 7.39 X 7496
Al-Dy-Fe DyFe 1.4 Al0.6 rt MgCu2,cF24,227 Fd-3m 0.747,0.747,0.747,90,90,90 Friauf-Laves phase - 8.19 X 16205
Al-Dy-Fe DyFe 2Al CeNi3,hP24,194 P63/mmc 0.52183,0.52183,1.6732,90,90,120 Laves-CaCu5 - 7.61 X 55210
Al-Dy-Fe DyFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.8954,1.0141,0.9,90,90,90 - - 4.42 A 34696
Al-Dy-Fe DyFe 2.8 Al0.2 PuNi3,hR36,166 R-3m 0.51379,0.51379,2.46417,90,90,120 Laves-CaCu5 - 8.60 X 55210
Al-Dy-Fe DyFe 4Al8 CeMn4Al8,tI26,139 I4/mmm 0.8767,0.8767,0.5047,90,90,90 CaCu5-Zr4Al3 gray 5.15 X 16174
Al-Dy-Fe Dy2 Fe13.2 Al3.8 *,hP19,177 P622 0.8572,0.8572,0.4193,90,90,120 - - - N 10748
Al-Dy-Fe Dy2 Fe16Al Th2Ni17,hP38,194 P63/mmc 0.84901,0.84901,0.83109,90,90,120 CaCu5-Zr4Al3 - 7.97 X 36002
Al-Dy-Fe Dy2 Fe8.4 Al8.6 Zn17 Th2,hR57,166 R-3m 0.874,0.874,1.2664,90,90,120 CaCu5-Zr4Al3 - 6.10 X 32155
Al-Dy-Fe Dy6 Fe17.3 Al5.7 Th6Mn23,cF116,225 Fm-3m 1.21494,1.21494,1.21494,90,90,90 - - 7.76 A 10748
Al-Dy-Ga DyAlGa AlB2 ,hP3,191 P6/mmm 0.4432,0.4432,0.358,90,90,120 AlB2 family - 7.07 X 19616
Al-Dy-Gd Gd0.02 Dy0.98 Al3 rt TiNi3,hP16,194 P63/mmc 0.6091,0.6091,0.9532,90,90,120 close-packed structure - 5.28 A 5214
Al-Dy-Gd Gd0.1 Dy0.9 Al3 BaPb3,hR36,166 R-3m 0.6163,0.6163,2.116,90,90,120 close-packed structure - 5.22 A 5214
Al-Dy-Gd Gd0.5 Dy0.5 Al2 MgCu2,cF24,227 Fd-3m 0.7873,0.7873,0.7873,90,90,90 Friauf-Laves phase - 5.82 X 17291
Al-Dy-Gd Gd0.55 Dy0.45 Al3 Mg3 Cd,hP8,194 P63/mmc 0.6305,0.6305,0.4602,90,90,120 close-packed structure - 5.04 A 5214
Al-Dy-Ge DyAlGe YAlGe,oS12,63 Cmcm 0.4035,1.0396,0.5752,90,90,90 AlB2 family - 7.21 A 23178
Al-Dy-Ge DyAl0.15 Ge1.85 ZrSi2,oS12,63 Cmcm 0.40854,1.6206,0.39345,90,90,90 close-packed structure - 7.67 A 47548
Al-Dy-Ge DyAl0.33 Ge2 CeNiSi2,oS16,63 Cmcm 0.41018,1.62323,0.39463,90,90,90 - - 8.00 A 56511
Al-Dy-Ge DyAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4204,0.4204,0.6681,90,90,120 - - 5.87 A 56511
Al-Dy-Ge Dy11 Al2Ge8 Sc11 Al2Ge8,tI84,139 I4/mmm 1.0924,1.0924,1.62039,90,90,90 - - 8.32 A 58529
Al-Dy-Ge Dy2 AlGe2 Mo2 FeB2,tP10,127 P4/mbm 0.7019,0.7019,0.4291,90,90,90 - gray light 7.81 X 46028
Al-Dy-Ge Dy2 AlGe3 Y2 AlGe 3,oP24,62 Pnma 0.67907,0.41386,1.7695,90,90,90 - gray steel 7.61 A 56511
Al-Dy-Ge Dy2 AlGe6 CuCe2Ge6,oS18,38 Amm2 0.4144,0.3992,2.0576,90,90,90 - - 7.68 A 56511
Al-Dy-Ge Dy2 Al3Ge4 Ba2Cd3Bi4,oS36,64 Cmce 0.5881,1.48,0.769,90,90,90 - - 6.91 A 24387
Al-Dy-Ge Dy3 AlGe3 *,oP*,62 Pnma 0.5999,1.7266,0.8175,90,90,90 - - - N 56511
Al-Dy-Hf Dy0.7 Hf0.3 Al3 Cu3Au,cP4,221 Pm-3m 0.419,0.419,0.419,90,90,90 close-packed structure - 5.60 X 15104
Al-Dy-Ho Dy0.6 Ho0.4 Al2 MgCu2,cF24,227 Fd-3m 0.782,0.782,0.782,90,90,90 Friauf-Laves phase - 6.04 X 4155
Al-Dy-Ir DyIrAl TiNiSi,oP12,62 Pnma 0.68592,0.41947,0.78836,90,90,90 AlB2 family - 11.18 A 30303
Al-Dy-Ir Dy2 Ir3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3137,0.7532,0.941,90,90,90 - - 8.16 A 43418
Al-Dy-Ir Dy4 IrAl Gd4RhIn,cF96,216 F-43m 1.3459,1.3459,1.3459,90,90,90 - gray dark 9.47 A 57034
Al-Dy-Lu Dy0.31 Lu0.69 Al3 Cu3Au,cP4,221 Pm-3m 0.4207,0.4207,0.4207,90,90,90 close-packed structure - 5.62 X 7867
Al-Dy-Lu Dy0.38 Lu0.62 Al3 ht HoAl3,hR60,166 R-3m 0.604,0.604,3.577,90,90,120 close-packed structure - 5.54 A 7867
Al-Dy-Mn DyMnAl MgCu2,cF24,227 Fd-3m 0.778,0.778,0.778,90,90,90 Friauf-Laves phase - 6.90 X 1725
Al-Dy-Mn DyMn4Al8 CeMn4Al8,tI26,139 I4/mmm 0.88545,0.88545,0.50991,90,90,90 CaCu5-Zr4Al3 gray silver 4.97 X 23593
Al-Dy-Mo Dy6 Mo4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0981,1.0981,1.7697,90,90,120 - - 4.53 A 29673
Al-Dy-Nb Dy6 Nb4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1087,1.1087,1.7827,90,90,120 - - 4.39 A 30591
Al-Dy-Ni DyNiAl ht-hp MgZn2,hP12,194 P63/mmc 0.5383,0.5383,0.8549,90,90,120 Friauf-Laves phase - 7.68 A 20055
Al-Dy-Ni DyNiAl ZrNiAl,hP9,189 P-62m 0.70015,0.70015,0.38496,90,90,120 Fe2P family - 7.57 X 40239
Al-Dy-Ni DyNiAl2 MgCuAl2,oS16,63 Cmcm 0.405,0.995,0.711,90,90,90 - - 6.38 A 7033
Al-Dy-Ni DyNiAl3 YNiAl3,oP20,62 Pnma 0.8133,0.4035,1.0611,90,90,90 - - 5.76 A 53946
Al-Dy-Ni DyNiAl4 YNiAl4,oS24,63 Cmcm 0.4056,1.513,0.663,90,90,90 - - 5.37 A 7363
Al-Dy-Ni DyNi0.45 Al1.55 rt MgCu2,cF24,227 Fd-3m 0.773,0.773,0.773,90,90,90 Friauf-Laves phase - 6.64 X 13210
214 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Dy-Ni DyNi2Al3 YNi2Al3,hP18,191 P6/mmm 0.903,0.903,0.407,90,90,120 - - 6.25 A 14665


Al-Dy-Ni DyNi3Al9 DyNi3Al9,hR99,155 R32 0.72723,0.72723,2.7344,90,90,120 - - 4.63 X 27128
Al-Dy-Ni DyNi3.98 Al1.02 CaCu5,hP6,191 P6/mmm 0.49825,0.49825,0.40527,90,90,120 - - 8.07 X 44960
Al-Dy-Ni Dy0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.42008,0.42008,0.91262,90,90,120 - - 4.62 A 59682
Al-Dy-Ni Dy2Ni2Al W2CoB2,oI10,71 Immm 0.4173,0.5388,0.8338,90,90,90 - - 8.32 X 11393
Al-Dy-Ni Dy2Ni3Al7 *,hP*,* - 1.782,1.782,0.3988,90,90,120 - - - N 13210
Al-Dy-Ni Dy3Ni5Al19 Gd3Ni5Al19 ,oS108,63 Cmcm 0.40701,1.5923,2.7,90,90,90 - - 4.91 A 53475
Al-Dy-Ni Dy3Ni6Al2 Ce3Ni6Si2 ,cI44,229 Im-3m 0.8918,0.8918,0.8918,90,90,90 - - 8.37 X 26480
Al-Dy-Ni Dy3Ni8Al Ce3Co8Si,hP24,194 P63 /mmc 0.5037,0.5037,1.61,90,90,120 Laves-CaCu5 - 9.24 X 11393
Al-Dy-Ni Dy4Ni6Al23 Y4Ni6Al23 ,mS66,12 C12/m1 1.58023,0.40642,1.82723,90,112.95,90 - - 4.99 A 53475
Al-Dy-Ni Dy4Ni9Al24 Dy4Ni9Al24 ,aP39,2 P-1 0.73088,0.73093,1.27774,84.539,79.026,60.205 - - 5.21 X 54192
Al-Dy-O DyAlO3 orth GdFeO3,oP20,62 Pnma 0.5317,0.7395,0.5209,90,90,90 perovskite family colorless 7.70 A 46592
Al-Dy-O DyAlO3 rt YAlO3,hP10,194 P63 /mmc 0.37,0.37,1.05,90,90,120 - - 6.34 A 1881
Al-Dy-O Dy3Al5O12 Y3 Al5O12,cI160,230 Ia-3d 1.2042,1.2042,1.2042,90,90,90 garnet family yellow 6.20 A 20100
Al-Dy-O Dy4Al2O9 rt Eu4Al2O9,mP60,14 P121/c1 0.7435,1.05202,1.11271,90,108.746,90 - - 6.83 A 30149
Al-Dy-Os Dy3Os4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.8797,0.8797,0.9504,90,90,120 - gray dark 8.20 A 40923
Al-Dy-Os Dy3.5 Os6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63 /mcm 1.2992,1.2992,0.9023,90,90,120 - gray silver 6.38 A 42976
Al-Dy-Pd DyPdAl hex ZrNiAl,hP9,189 P-62m 0.7187,0.7187,0.3957,90,90,120 Fe2P family - 8.33 A 44830
Al-Dy-Pd DyPdAl orth TiNiSi,oP12,62 Pnma 0.6884,0.4415,0.7733,90,90,90 AlB2 family - 8.36 A 17109
Al-Dy-Pd Dy2Pd3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3127,0.7642,0.938,90,90,90 - - 6.26 A 43418
Al-Dy-Pd Dy4Pd9Al24 Er4Pt9Al24 ,aP37,2 P-1 0.752,0.752,1.3096,84.51,78.97,60. - - 5.95 A 36571
Al-Dy-Pr Pr0.6 Dy0.4Al2 MgCu2,cF24,227 Fd-3m 0.793,0.793,0.793,90,90,90 Friauf-Laves phase - 5.42 X 4155
Al-Dy-Pt DyPtAl TiNiSi,oP12,62 Pnma 0.6879,0.4386,0.7692,90,90,90 AlB2 family - 11.01 A 17109
Al-Dy-Pt Dy0.67Pt2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63 /mmc 0.4274,0.4274,1.6394,90,90,120 - gray silver 8.12 A 44004
Al-Dy-Pt Dy4Pt9Al24 Er4Pt9Al24 ,aP37,2 P-1 0.7483,0.7483,1.3072,84.53,79.01,60. - - 8.15 A 36571
Al-Dy-Re Dy2Re4Al20 Tb(Tb0.87 Al0.13 )Re4Al20,oS104,63 Cmcm 0.92877,1.0314,1.8011,90,90,90 - - 6.20 A 53203
Al-Dy-Re Dy3.75 Re6 Al30.59 Y3.64 Re6Al30.69 ,hP88,193 P63 /mcm 1.3108,1.3108,0.9143,90,90,120 - - 6.23 X 33271
Al-Dy-Rh Dy2Rh3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.322,0.7632,0.9351,90,90,90 - - 6.17 A 43418
Al-Dy-Rh Dy4RhAl Gd4RhIn,cF96,216 F-43m 1.3468,1.3468,1.3468,90,90,90 - gray dark 8.48 A 57034
Al-Dy-Ru Dy3Ru4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.8772,0.8772,0.952,90,90,120 - gray dark 6.36 A 40923
Al-Dy-Ru Dy4RuAl Gd4RhIn,cF96,216 F-43m 1.3413,1.3413,1.3413,90,90,90 - gray dark 8.57 A 57034
Al-Dy-S Dy3Al1.67 S7 Ce3Al1.67 S7,hP24,173 P63 0.966,0.966,0.606,90,90,120 - - 5.13 A 5866
Al-Dy-Sc Sc0.3 Dy0.7 Al3 ht HoAl3,hR60,166 R-3m 0.6056,0.6056,3.582,90,90,120 close-packed structure - 4.56 A 4603
Al-Dy-Sc Sc0.3 Dy0.7 Al3 rt TiNi3,hP16,194 P63 /mmc 0.6063,0.6063,0.9494,90,90,120 close-packed structure - 4.58 A 4603
Al-Dy-Sc Sc0.4 Dy0.6 Al3 Cu3Au,cP4,221 Pm-3m 0.419,0.419,0.419,90,90,90 close-packed structure - 4.43 X 4603
Al-Dy-Se Dy3Al1.67 Se7 Ce3Al1.67 S7,hP24,173 P63 0.998,0.998,0.618,90,90,120 - - 6.76 A 4521
Al-Dy-Si DyAlSi orth YAlGe,oS12,63 Cmcm 0.39947,1.0272,0.56997,90,90,90 AlB2 family - 6.18 A 43107
Al-Dy-Si DyAlSi tet ThSi2,tI12,141 I41/amd 0.41254,0.41254,1.44079,90,90,90 - - 5.89 X 46688
Al-Dy-Si DyAl0.07 Si0.93 TlI,oS8,63 Cmcm 0.4233,1.0559,0.3844,90,90,90 CrB(TlI)-FeB - 7.37 A 59024
Al-Dy-Si DyAl0.19 Si1.51 GdSi1.4 ,oI12,74 Imma 0.3915,0.4025,1.3356,90,90,90 - - 6.63 A 59024
Al-Dy-Si DyAl2Si2 Ce2SO2,hP5,164 P-3m1 0.4185,0.4185,0.6569,90,90,120 - gray 4.54 X 36596
Al-Dy-Si DyAl2.8 Si0.2 TiNi3,hP16,194 P63 /mmc 0.6093,0.6093,0.9518,90,90,120 close-packed structure - 5.29 A 59024
Al-Dy-Si Dy2AlSi2 W2CoB2,oI10,71 Immm 0.4053,0.5731,0.8665,90,90,90 - - 6.74 A 59024
Al-Dy-Si Dy2Al3Si2 Y2 Al3Si2,mS14,12 C12/m1 1.01228,0.40231,0.65746,90,100.956,90 - gray 5.84 X 45163
Al-Dy-Si Dy5Al0.4 Si2.6 Mn5Si3,hP16,193 P63 /mcm 0.8388,0.8388,0.6314,90,90,120 - - 7.74 A 59024
Al-Dy-Si Dy6Al3Si Tb6Al3Si,tI80,140 I4/mcm 1.153,1.153,1.5033,90,90,90 - - 7.21 A 59024
Al-Dy-Sm Sm0.01 Dy0.99 Al3 TiNi3,hP16,194 P63 /mmc 0.609,0.609,0.9529,90,90,120 close-packed structure - 5.28 A 7867
Al-Dy-Sm Sm0.32 Dy0.68 Al3 BaPb3,hR36,166 R-3m 0.6186,0.6186,2.117,90,90,120 close-packed structure - 5.10 A 7867
Al-Dy-Sm Sm0.38 Dy0.62 Al3 Mg3Cd,hP8,194 P63 /mmc 0.6298,0.6298,0.46,90,90,120 close-packed structure - 5.02 A 7867
Al-Dy-Ta Dy6Ta4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1083,1.1083,1.7834,90,90,120 - - 5.01 A 30591
Al-Dy-Tb Tb0.13 Dy0.87 Al3 rt TiNi3,hP16,194 P63 /mmc 0.6087,0.6087,0.9535,90,90,120 close-packed structure - 5.28 A 4603
Al-Dy-Tb Tb0.22 Dy0.78 Al3 BaPb3,hR36,166 R-3m 0.6156,0.6156,2.115,90,90,120 close-packed structure - 5.22 A 4603
Al-Dy-Tb Tb0.5 Dy0.5 Al2 MgCu2,cF24,227 Fd-3m 0.78576,0.78576,0.78576,90,90,90 Friauf-Laves phase - 5.88 X 51930
Al-Dy-Ti DyTi2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4672,1.4672,1.4672,90,90,90 - - 3.36 A 30512
Al-Dy-Ti Dy6Ti4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1046,1.1046,1.7877,90,90,120 - - 4.09 X 30591
Al-Dy-Tm Dy0.28 Tm0.72Al3 Cu3Au,cP4,221 Pm-3m 0.4214,0.4214,0.4214,90,90,90 close-packed structure - 5.51 X 7867
Al-Dy-Tm Dy0.32 Tm0.68 Al3 HoAl3,hR60,166 R-3m 0.603,0.603,3.574,90,90,120 close-packed structure - 5.48 A 7867
Al-Dy-U U0.5 Dy0.5 Al2 MgCu2,cF24,227 Fd-3m 0.7812,0.7812,0.7812,90,90,90 Friauf-Laves phase - 7.08 X 25455
Al-Dy-U U2Dy3Al15 *,h**,* - 0.605,0.605,1.435,90,90,120 - - - N 3638
Al-Dy-V DyVAl8 *,hP*,* - 1.086,1.086,1.771,90,90,120 - - - N 12791
Al-Dy-V DyV2 Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.454,1.454,1.454,90,90,90 - - 3.47 X 12791
Al-Dy-V Dy6V4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0954,1.0954,1.7709,90,90,120 - - 4.22 A 30591
Al-Dy-W Dy6W4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0994,1.0994,1.77,90,90,120 - - 5.15 A 29673
Al-Dy-Y Y0.1 Dy0.9 Al3 rt TiNi3,hP16,194 P63 /mmc 0.6083,0.6083,0.9529,90,90,120 close-packed structure - 5.14 A 4603
Al-Dy-Y Y0.2 Dy0.8 Al3 ht BaPb3,hR36,166 R-3m 0.6157,0.6157,2.115,90,90,120 close-packed structure - 4.92 A 4603
Al-Dy-Y Y0.5 Dy0.5 Al2 MgCu2,cF24,227 Fd-3m 0.784,0.784,0.784,90,90,90 Friauf-Laves phase - 4.95 X 26260
Al-Dy-Zn ZnDyAl CaIn2,hP6,194 P63 /mmc 0.449,0.449,0.7085,90,90,120 AlB2 family - 6.84 A 24841
Al-Dy-Zn Zn3.4 Dy3Al7.6 La3Al11,oI28,71 Immm 0.4216,0.99922,1.24407,90,90,90 - - 5.80 X 44889
Al-Dy-Zn Zn4.96 DyAl3.04 Zn3(Zn0.4 Al0.6)5Ho,tI72,139 I4/mmm 0.85888,0.85888,1.66011,90,90,90 - - 6.17 X 47795
Al-Dy-Zr Dy0.49 Zr0.51 Al2 MgCu2,cF24,227 Fd-3m 0.7687,0.7687,0.7687,90,90,90 Friauf-Laves phase - 5.27 X 58205
Al-Dy-Zr Dy0.7 Zr0.3 Al3 Cu3Au,cP4,221 Pm-3m 0.42,0.42,0.42,90,90,90 close-packed structure - 4.98 X 15104
Al-Er-Fe ErFeAl MgZn2,hP12,194 P63 /mmc 0.5332,0.5332,0.8683,90,90,120 Friauf-Laves phase - 7.77 A 54502
Al-Er-Fe ErFe0.6 Al1.4 MgCu2,cF24,227 Fd-3m 0.7651,0.7651,0.7651,90,90,90 Friauf-Laves phase - 7.08 X 5998
Al-Er-Fe ErFe1.6 Al0.4 MgCu2,cF24,227 Fd-3m 0.7308,0.7308,0.7308,90,90,90 Friauf-Laves phase - 9.10 X 54502
Al-Er-Fe ErFe2Al CeNi3,hP24,194 P63 /mmc 0.5156,0.5156,1.6522,90,90,120 Laves-CaCu5 - 8.01 A 54502
Al-Er-Fe ErFe2Al10 YbFe2Al10 ,oS52,63 Cmcm 0.8958,1.0136,0.8988,90,90,90 - - 4.47 A 34696
Al-Er-Fe ErFe2.5 Al0.5 PuNi3,hR36,166 R-3m 0.5123,0.5123,2.4691,90,90,120 Laves-CaCu5 - 8.53 A 54502
Al-Er-Fe ErFe4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.878,0.878,0.503,90,90,90 CaCu5-Zr4Al3 - 5.19 X 21651
Handbook of Inorganic Substances – Edition 2015 : Data 215

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Er-Fe Er0.67 Fe3.96 Al1.71 Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.496,0.496,0.4214,90,90,120 CaCu5-Zr4Al3 - 7.02 A 38848
Al-Er-Fe Er2Fe 10.35 Al6.65 Zn17 Th2,hR57,166 R-3m 0.866,0.866,1.2585,90,90,120 CaCu5-Zr4Al3 - 6.66 A 38848
Al-Er-Fe Er2Fe 15.1Al1.9 Th2Ni17,hP38,194 P63/mmc 0.8494,0.8494,0.832,90,90,120 CaCu5-Zr4Al3 - 7.85 A 38848
Al-Er-Fe Er6Fe 20.3Al2.7 Th6Mn23,cF116,225 Fm-3m 1.205,1.205,1.205,90,90,90 - - 8.39 A 7034
Al-Er-Ga ErAlGa AlB2 ,hP3,191 P6/mmm 0.445,0.445,0.355,90,90,120 AlB2 family - 7.20 X 16218
Al-Er-Ga ErAl0.5 Ga1.5 AlB2 ,hP3,191 P6/mmm 0.4369,0.4369,0.358,90,90,120 AlB2 family - 8.01 X 16219
Al-Er-Ga ErAl1.75 Ga0.25 MgCu2,cF24,227 Fd-3m 0.7731,0.7731,0.7731,90,90,90 Friauf-Laves phase - 6.67 X 16219
Al-Er-Gd Gd0.14 Er0.86 Al3 rhom HoAl3,hR60,166 R-3m 0.6045,0.6045,3.58,90,90,120 close-packed structure - 5.43 A 5214
Al-Er-Gd Gd0.17 Er0.83 Al3 cub Cu3Au,cP4,221 Pm-3m 0.415,0.415,0.415,90,90,90 close-packed structure - 5.73 X 14654
Al-Er-Gd Gd0.2 Er0.8Al3 TiNi3,hP16,194 P63/mmc 0.6079,0.6079,0.9519,90,90,120 close-packed structure - 5.37 A 5214
Al-Er-Gd Gd0.45 Er0.55 Al3 BaPb3,hR36,166 R-3m 0.6169,0.6169,2.117,90,90,120 close-packed structure - 5.22 A 5214
Al-Er-Gd Gd0.72 Er0.28 Al3 Mg3 Cd,hP8,194 P63/mmc 0.6306,0.6306,0.4602,90,90,120 close-packed structure - 5.05 A 5214
Al-Er-Gd Gd0.894 Er0.106 Al2 MgCu2,cF24,227 Fd-3m 0.7887,0.7887,0.7887,90,90,90 Friauf-Laves phase - 5.75 X 14280
Al-Er-Ge ErAlGe YAlGe,oS12,63 Cmcm 0.40145,1.02509,0.57019,90,90,90 AlB2 family - 7.55 A 55412
Al-Er-Ge ErAl0.15 Ge1.36 AlB2 ,hP3,191 P6/mmm 0.39102,0.39102,0.4098,90,90,120 AlB2 family - 8.26 X 43903
Al-Er-Ge ErAl0.15 Ge1.85 ZrSi2,oS12,63 Cmcm 0.4049,1.59791,0.39102,90,90,90 close-packed structure - 8.02 X 43903
Al-Er-Ge ErAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.41781,0.41781,0.66698,90,90,120 - - 6.03 X 51092
Al-Er-Ge Er11 Al2Ge8 Sc11 Al2Ge8,tI84,139 I4/mmm 1.08242,1.08242,1.60001,90,90,90 - - 8.77 X 58529
Al-Er-Ge Er2AlGe 3 Y2 AlGe 3,oP24,62 Pnma 0.6746,0.41401,1.7535,90,90,90 - gray steel 7.86 A 43903
Al-Er-Ge Er2Al3Ge4 Ba2Cd3Bi4,oS36,64 Cmce 0.5836,1.4751,0.7613,90,90,90 - - 7.15 A 55412
Al-Er-Ho Ho0.04 Er0.96 Al3 Cu3Au,cP4,221 Pm-3m 0.4217,0.4217,0.4217,90,90,90 close-packed structure - 5.49 X 4603
Al-Er-Ho Ho0.15 Er0.85 Al3 rt HoAl3,hR60,166 R-3m 0.6038,0.6038,3.563,90,90,120 close-packed structure - 5.49 A 4603
Al-Er-Ho Ho0.5 Er0.5Al2 MgCu2,cF24,227 Fd-3m 0.78083,0.78083,0.78083,90,90,90 Friauf-Laves phase - 6.14 X 58730
Al-Er-Ir ErIrAl TiNiSi,oP12,62 Pnma 0.68063,0.41784,0.78598,90,90,90 AlB2 family - 11.48 A 30303
Al-Er-Ir Er2Ir3Al9 Ho2Rh3Al9,oS84,63 Cmcm 1.3138,0.7585,0.9338,90,90,90 - - 8.24 X 43418
Al-Er-Ir Er4IrAl Gd4RhIn,cF96,216 F-43m 1.3305,1.3305,1.3305,90,90,90 - gray dark 10.02 A 57034
Al-Er-La La0.5 Er0.5 Al2 MgCu2,cF24,227 Fd-3m 0.8,0.8,0.8,90,90,90 Friauf-Laves phase - 5.37 X 18119
Al-Er-Mg Mg0.04 ErAl2.96 Cu3Au,cP4,221 Pm-3m 0.4214,0.4214,0.4214,90,90,90 close-packed structure - 5.51 X 40420
Al-Er-Mg Mg0.3 ErAl1.7 MgCu2,cF24,227 Fd-3m 0.7876,0.7876,0.7876,90,90,90 Friauf-Laves phase - 5.99 X 40420
Al-Er-Mg Mg0.36 ErAl0.64 CsCl,cP2,221 Pm-3m 0.3597,0.3597,0.3597,90,90,90 b.c.c. family - 6.90 X 40420
Al-Er-Mg Mg0.7 Er0.3 Al2 MgZn2,hP12,194 P63/mmc 0.5468,0.5468,0.8836,90,90,120 Friauf-Laves phase - 3.52 A 40420
Al-Er-Mn ErMn1.4 Al0.6 MgCu2,cF24,227 Fd-3m 0.7628,0.7628,0.7628,90,90,90 Friauf-Laves phase - 7.79 X 42204
Al-Er-Mn ErMn1.8 Al0.2 MgZn2,hP12,194 P63/mmc 0.5272,0.5272,0.8605,90,90,120 Friauf-Laves phase - 8.71 A 42204
Al-Er-Mn ErMn11.35 Al0.65 ThMn12,tI26,139 I4/mmm 0.86,0.86,0.478,90,90,90 CaCu5-Zr4Al3 - 7.59 A 38114
Al-Er-Mn ErMn7.4 Al4.6 CeMn4Al8,tI26,139 I4/mmm 0.87302,0.87302,0.5032,90,90,90 CaCu5-Zr4Al3 - 6.04 A 38114
Al-Er-Mn Er2Mn11.26 Al5.74 Th2Ni17,hP38,194 P63/mmc 0.8743,0.8743,0.8648,90,90,120 CaCu5-Zr4Al3 - 6.43 A 38114
Al-Er-Mn Er2Mn9Al8 Zn17 Th2,hR57,166 R-3m 0.8866,0.8866,1.2993,90,90,120 CaCu5-Zr4Al3 - 5.88 A 38114
Al-Er-Mn Er6Mn4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0766,1.0766,1.7552,90,90,120 - - 4.49 A 34455
Al-Er-Mo ErMo2Al4 YbMo 2Al4,tI14,139 I4/mmm 0.6722,0.6722,0.5317,90,90,90 - - 6.46 A 9904
Al-Er-Mo Er6Mo 4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0971,1.0971,1.7649,90,90,120 - - 4.60 A 29673
Al-Er-Nb Er6Nb4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1065,1.1065,1.777,90,90,120 - - 4.47 A 30591
Al-Er-Ni ErNiAl hp MgZn2,hP12,194 P63/mmc 0.5312,0.5312,0.8548,90,90,120 Friauf-Laves phase - 8.04 A 20055
Al-Er-Ni ErNiAl ZrNiAl,hP9,189 P-62m 0.697,0.697,0.38003,90,90,120 Fe2P family - 7.88 A 33169
Al-Er-Ni ErNiAl2 MgCuAl2,oS16,63 Cmcm 0.4064,1.006,0.6898,90,90,90 - - 6.59 A 7363
Al-Er-Ni ErNiAl4 YNiAl4,oS24,63 Cmcm 0.4044,1.508,0.663,90,90,90 - - 5.49 A 7363
Al-Er-Ni ErNi0.45 Al1.55 MgCu2,cF24,227 Fd-3m 0.7702,0.7702,0.7702,90,90,90 Friauf-Laves phase - 6.85 X 15111
Al-Er-Ni ErNi2Al3 YNi2Al3,hP18,191 P6/mmm 0.901,0.901,0.4049,90,90,120 - - 6.40 A 14665
Al-Er-Ni ErNi3Al9 ErNi3Al9,hR78,155 R32 0.72716,0.72716,2.7346,90,90,120 - - 4.66 X 27128
Al-Er-Ni ErNi4Al CaCu5,hP6,191 P6/mmm 0.491,0.491,0.4033,90,90,120 - - 8.46 X 11685
Al-Er-Ni Er0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.41939,0.41939,0.91071,90,90,120 - - 4.68 A 59682
Al-Er-Ni Er2Ni2Al W2CoB2,oI10,71 Immm 0.4157,0.5347,0.8374,90,90,90 - - 8.55 X 11393
Al-Er-Ni Er2Ni3Al7 *,hP*,* - 1.777,1.777,0.3971,90,90,120 - - - N 15111
Al-Er-Ni Er3Ni5Al19 Gd3Ni5Al19,oS108,63 Cmcm 0.40565,1.58906,2.69752,90,90,90 - - 5.00 A 53475
Al-Er-Ni Er3Ni6Al2 Ce3Ni6Si2,cI44,229 Im-3m 0.886,0.886,0.886,90,90,90 - - 8.67 X 26480
Al-Er-Ni Er3Ni8Al Ce3Co8Si,hP24,194 P63/mmc 0.5002,0.5002,1.599,90,90,120 Laves-CaCu5 - 9.57 X 11393
Al-Er-O ErAlO3 hex YAlO3,hP10,194 P63/mmc 0.366,0.366,1.05,90,90,120 - - 6.60 A 1881
Al-Er-O ErAlO3 orth GdFeO3,oP20,62 Pnma 0.53271,0.73539,0.51595,90,90,90 perovskite family pink 7.96 A 6182
Al-Er-O Er3Al5O12 Y3 Al5O12,cI160,230 Ia-3d 1.19928,1.19928,1.19928,90,90,90 garnet family red light 6.38 X 38483
Al-Er-O Er4Al2O9 rt *,mP60,14 P121/c1 0.73385,1.0421,1.10529,90,108.489,90 - - - N 30149
Al-Er-Os Er3Os4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.8782,0.8782,0.9501,90,90,120 - gray dark 8.30 A 40923
Al-Er-Os Er3.5 Os6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63/mcm 1.2976,1.2976,0.9014,90,90,120 - gray silver 6.44 A 42976
Al-Er-Pd ErPdAl TiNiSi,oP12,62 Pnma 0.6826,0.4408,0.7713,90,90,90 AlB2 family - 8.60 A 17109
Al-Er-Pd Er2Pd3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3121,0.7621,0.9352,90,90,90 - - 6.37 A 43418
Al-Er-Pd Er4Pd9Al24 Er4Pt9Al24,aP37,2 P-1 0.75,0.75,1.3057,84.501,78.96,60. - - 6.05 A 36571
Al-Er-Pt ErPtAl TiNiSi,oP12,62 Pnma 0.6812,0.4366,0.7675,90,90,90 AlB2 family - 11.33 A 17109
Al-Er-Pt Er0.67Pt2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63/mmc 0.4268,0.4268,1.6364,90,90,120 - gray silver 8.20 A 44004
Al-Er-Pt Er1.33Pt3Al8 mon Er1.33Pt3Al8,mS34,12 C12/m1 0.7462,0.4313,1.3044,90,100.94,90 - - 8.25 X 36571
Al-Er-Pt Er4Pt9Al24 tricl Er4Pt9Al24,aP37,2 P-1 0.7475,0.7475,1.3067,84.53,79.01,60. - - 8.22 X 36571
Al-Er-Re ErRe 2Al10 LuRe2Al10,oS156,63 Cmcm 0.92809,1.0283,2.686,90,90,90 - gray dark 6.29 A 53203
Al-Er-Re Er3.5 Re6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63/mcm 1.3079,1.3079,0.9137,90,90,120 - gray 6.20 A 33271
Al-Er-Rh Er2Rh3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3157,0.7596,0.9336,90,90,90 - - 6.31 A 43418
Al-Er-Rh Er4RhAl Gd4RhIn,cF96,216 F-43m 1.3323,1.3323,1.3323,90,90,90 - gray dark 8.98 A 57034
Al-Er-Ru ErRu2Al10 YbFe 2Al10,oS52,63 Cmcm 0.9091,1.0185,0.9083,90,90,90 - - 5.05 A 34696
Al-Er-Ru Er3Ru4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.8741,0.8741,0.9493,90,90,120 - gray dark 6.50 A 40923
Al-Er-S Er3Al1.67 S7 Ce3Al1.67 S7,hP24,173 P63 0.95,0.95,0.602,90,90,120 - gray 5.44 A 1232
Al-Er-Si ErAlSi orth YAlGe,oS12,63 Cmcm 0.39738,1.01616,0.56542,90,90,90 AlB2 family - 6.47 A 51924
Al-Er-Si ErAlSi tet ThSi2,tI12,141 I41/amd 0.42244,0.42244,1.45257,90,90,90 - - 5.70 X 50602
Al-Er-Si ErAl0.25 Si0.75 CsCl,cP2,221 Pm-3m 0.3388,0.3388,0.3388,90,90,90 b.c.c. family - 8.33 X 4039
216 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Er-Si ErAl0.5 Si0.5 ht FeB-b,oP8,62 Pnma 0.6865,0.4307,0.535,90,90,90 CrB(TlI)-FeB - 8.18 A 4039


Al-Er-Si ErAl0.5 Si0.5 rt TlI,oS8,63 Cmcm 0.425,1.064,0.39,90,90,90 CrB(TlI)-FeB - 7.34 A 51924
Al-Er-Si ErAl2Si2 Ce2SO2,hP5,164 P-3m1 0.417,0.417,0.648,90,90,120 - - 4.72 A 7031
Al-Er-Si ErAl2.8 Si0.2 PuAl3,hP24,194 P63 /mmc 0.60295,0.60295,1.42308,90,90,120 close-packed structure - 5.52 X 51924
Al-Er-Si Er2AlSi2 W2CoB2,oI10,71 Immm 0.4011,0.5719,0.8529,90,90,90 - gray 7.09 X 38143
Al-Er-Si Er2Al3Si2 Y2 Al3Si2,mS14,12 C12/m1 1.00443,0.40013,0.65432,90,100.668,90 - gray 6.06 X 45163
Al-Er-Si Er6Al3Si Tb6Al3Si,tI80,140 I4/mcm 1.1436,1.1436,1.4854,90,90,90 - - 7.61 X 51924
Al-Er-Sm Sm0.01 Er0.99 Al3 Cu3Au,cP4,221 Pm-3m 0.4215,0.4215,0.4215,90,90,90 close-packed structure - 5.50 X 7867
Al-Er-Sm Sm0.3 Er0.7 Al3 TiNi3,hP16,194 P63 /mmc 0.6085,0.6085,0.9511,90,90,120 close-packed structure - 5.30 A 7867
Al-Er-Sm Sm0.55 Er0.45 Al3 rt Mg3Cd,hP8,194 P63 /mmc 0.6308,0.6308,0.4591,90,90,120 close-packed structure - 5.02 A 7867
Al-Er-Ta Er6Ta4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1057,1.1057,1.7756,90,90,120 - - 5.10 A 30591
Al-Er-Tb Tb0.02 Er0.98 Al3 Cu3Au,cP4,221 Pm-3m 0.4216,0.4216,0.4216,90,90,90 close-packed structure - 5.50 X 4603
Al-Er-Tb Tb0.25 Er0.75 Al2 MgCu2,cF24,227 Fd-3m 0.78211,0.78211,0.78211,90,90,90 Friauf-Laves phase - 6.09 X 55272
Al-Er-Tb Tb0.4 Er0.6Al3 HoAl3,hR60,166 R-3m 0.6055,0.6055,3.58,90,90,120 close-packed structure - 5.37 A 4603
Al-Er-Tb Tb0.45 Er0.55 Al3 TiNi3,hP16,194 P63 /mmc 0.6076,0.6076,0.9517,90,90,120 close-packed structure - 5.34 A 4603
Al-Er-Tb Tb0.68 Er0.32 Al3 BaPb3,hR36,166 R-3m 0.6158,0.6158,2.114,90,90,120 close-packed structure - 5.22 A 4603
Al-Er-Ti ErTi2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4662,1.4662,1.4662,90,90,90 - - 3.38 A 30512
Al-Er-Ti Er6Ti4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1045,1.1045,1.7708,90,90,120 - - 4.18 A 38289
Al-Er-V Er6V4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0935,1.0935,1.7627,90,90,120 - - 4.31 A 30591
Al-Er-W Er6W4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0969,1.0969,1.7631,90,90,120 - - 5.24 A 29673
Al-Er-Y Y0.02 Er0.98 Al3 Cu3Au,cP4,221 Pm-3m 0.4215,0.4215,0.4215,90,90,90 close-packed structure - 5.47 X 4603
Al-Er-Y Y0.35 Er0.65 Al3 HoAl3,hR60,166 R-3m 0.6048,0.6048,3.578,90,90,120 close-packed structure - 4.85 A 4603
Al-Er-Y Y0.4 Er0.6 Al2 MgCu2,cF24,227 Fd-3m 0.782,0.782,0.782,90,90,90 Friauf-Laves phase - 5.27 X 12770
Al-Er-Y Y0.55 Er0.45 Al3 TiNi3,hP16,194 P63 /mmc 0.6086,0.6086,0.953,90,90,120 close-packed structure - 4.46 A 4603
Al-Er-Y Y0.6 Er0.4 Al3 ht BaPb3,hR36,166 R-3m 0.6156,0.6156,2.113,90,90,120 close-packed structure - 4.34 A 4603
Al-Er-Zn ZnErAl CaIn2,hP6,194 P63 /mmc 0.4475,0.4475,0.6998,90,90,120 AlB2 family - 7.10 X 24841
Al-Er-Zn Zn4Er3Al7 La3Al11,oI28,71 Immm 0.41973,0.99423,1.23304,90,90,90 - - 6.15 A 44889
Al-Er-Zn Zn5.37 ErAl2.63 Zn3(Zn0.4 Al0.6)5Ho,tI72,139 I4/mmm 0.85825,0.85825,1.63997,90,90,90 - - 6.48 X 47795
Al-Er-Zr Er0.66 Zr0.34 Al3 Cu3Au,cP4,221 Pm-3m 0.4172,0.4172,0.4172,90,90,90 close-packed structure - 5.08 X 56798
Al-Eu-F EuAlF5 SrAlF5,tI448,88 I41/a 1.99642,1.99642,1.43731,90,90,90 - white 5.08 X 40460
Al-Eu-F Eu0.7 Al0.3 F2.3 CeH3,cF44,225 Fm-3m 0.5787,0.5787,0.5787,90,90,90 fluorite family - 5.42 A 4578
Al-Eu-Fe EuFe2Al8 CeFe2Al8,oP44,55 Pbam 1.253,1.4503,0.4036,90,90,90 - - 4.34 X 16011
Al-Eu-Fe EuFe4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.8784,0.8784,0.5051,90,90,90 CaCu5-Zr4Al3 - 5.04 X 11676
Al-Eu-Ga EuAlGa KHg2,oI12,74 Imma 0.4678,0.7702,0.7706,90,90,90 AlB2 family - 5.95 A 20238
Al-Eu-Ga EuAl1.6 Ga0.4 MgCu2,cF24,227 Fd-3m 0.8106,0.8106,0.8106,90,90,90 Friauf-Laves phase - 5.56 X 20238
Al-Eu-Ga EuAl2Ga2 CeAl2Ga2,tI10,139 I4/mmm 0.4348,0.4348,1.0966,90,90,90 - - 5.53 A 13592
Al-Eu-Ge EuAlGe LaPtSi,tI12,109 I41md 0.42,0.42,1.4604,90,90,90 - - 6.49 A 23178
Al-Eu-Ge EuAl2Ge EuAl2Ge,oP16,62 Pnma 0.7294,0.4306,1.1237,90,90,90 - - 5.24 X 50108
Al-Eu-Ge EuAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4214,0.4214,0.732,90,90,120 - gray 5.18 X 38070
Al-Eu-Ge Eu3Al1.8 Ge 2.2 Ba3Al2Ge2 ,oI14,71 Immm 0.41768,0.4707,1.8972,90,90,90 - gray silver 5.91 X 57523
Al-Eu-Ge Eu3Al2Ge 4 Tb3Co2Ge4,mS18,12 C12/m1 1.2359,0.4168,0.8784,90,110.615,90 AlB2 family gray silver 6.28 X 57523
Al-Eu-H EuAlH5 GeS,oP8,62 Pnma 1.2481,0.50103,0.45887,90,90,90 - - 4.26 P 58302
Al-Eu-H EuAl2H8 *,oP6,59 Pmmn 0.42741,0.51912,0.91003,90,90,90 - - 3.52 P 58302
Al-Eu-La La0.5 Eu0.5 Al2 MgCu2,cF24,227 Fd-3m 0.813,0.813,0.813,90,90,90 Friauf-Laves phase - 4.93 X 18119
Al-Eu-Mg Mg4.68 EuAl0.52 Mg5.2 Eu,hP42,194 P63 /mmc 1.0212,1.0212,1.0509,90,90,120 - - 2.94 X 26094
Al-Eu-Mn EuMn3.6 Al8.4 ThMn12,tI26,139 I4/mmm 0.8973,0.8973,0.517,90,90,90 CaCu5-Zr4Al3 - 4.60 X 21789
Al-Eu-Mn Eu2Mn5Al12 Eu2Mn3(Mn0.33 Al0.67 )6Al8,hR114,167 R-3c 0.9108,0.9108,2.6496,90,90,120 CaCu5-Zr4Al3 - 4.72 X 22901
Al-Eu-Mo EuMo2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4629,1.4629,1.4629,90,90,90 - - 3.75 A 30512
Al-Eu-Nb EuNb2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4785,1.4785,1.4785,90,90,90 - - 3.61 A 34455
Al-Eu-O EuAlO3 hex YAlO3,hP10,194 P63 /mmc 0.376,0.376,1.052,90,90,120 - - 5.85 A 1881
Al-Eu-O EuAlO3 orth GdFeO3,oP20,62 Pnma 0.52926,0.74599,0.52716,90,90,90 perovskite family - 7.24 X 47113
Al-Eu-O EuAl12O19 BaAl12O19 ,hP64,186 P63 mc 0.5568,0.5568,2.2,90,90,120 magnetoplumbite family - 4.38 A 36139
Al-Eu-O Eu2AlO4 *,mS14,12 C12/m1 1.29002,0.3689,0.3712,90,106.022,90 - - - N 6588
Al-Eu-O Eu3AlO5 *,o*36,* - 0.668,0.675,1.091,90,90,90 - - 7.60 N 6588
Al-Eu-O Eu3Al2O7 Sr3Ti2O7,tI24,139 I4/mmm 0.371,0.371,1.991,90,90,90 Ruddlesden-Popper - 7.54 A 6588
Al-Eu-O Eu3Al5O12 Y3 Al5O12,cI160,230 Ia-3d 1.214,1.214,1.214,90,90,90 garnet family - 5.81 X 49660
Al-Eu-O Eu4Al2O9 rt Eu4Al2O9,mP60,14 P121/c1 0.7608,1.0616,1.1101,90,108.5,90 - - 6.30 X 4621
Al-Eu-P Eu14AlP 11 Sr14GaAs11 ,tI216,142 I41/acd 1.5913,1.5913,2.1343,90,90,90 - black 6.13 X 35345
Al-Eu-P Eu3Al2P 4 Ca3Al2As4 ,mS36,15 C12/c1 1.30304,1.00974,0.65857,90,89.393,90 - brown 4.86 X 58898
Al-Eu-Pd EuPd2Al3 YNi2Al3,hP18,191 P6/mmm 0.946,0.946,0.4275,90,90,120 - - 6.70 X 33901
Al-Eu-S EuAl2S4 orth1 *,o**,* - 0.606,1.0193,1.0374,90,90,90 - yellow - N 8313
Al-Eu-S EuAl2S4 orth2 EuGa2S4,oF224,70 Fddd 1.2102,2.038,2.074,90,90,90 - - 3.47 A 5200
Al-Eu-Sc Sc0.988 Eu0.012 Al3 Cu3Au,cP4,221 Pm-3m 0.4103,0.4103,0.4103,90,90,90 close-packed structure - 3.06 X 52216
Al-Eu-Se EuAl2Se4 EuGa2S4,oF224,70 Fddd 1.258,2.146,2.164,90,90,90 - - 4.75 A 5200
Al-Eu-Si EuAl2Si2 Ce2SO2,hP5,164 P-3m1 0.4181,0.4181,0.7259,90,90,120 - gray 3.96 X 38070
Al-Eu-Si EuAl2.96 Si1.04 BaAl4,tI10,139 I4/mmm 0.43826,0.43826,1.0785,90,90,90 - - 4.19 X 46656
Al-Eu-Ta EuTa2 Al19.74 CeCr2Al20 ,cF184,227 Fd-3m 1.4783,1.4783,1.4783,90,90,90 - - 4.30 X 34455
Al-Eu-Ti EuTi2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4732,1.4732,1.4732,90,90,90 - - 3.27 A 30512
Al-Eu-V EuV2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4575,1.4575,1.4575,90,90,90 - - 3.40 A 34455
Al-Eu-W EuW2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4631,1.4631,1.4631,90,90,90 - - 4.49 A 30512
Al-Eu-Y Y0.5 Eu0.5 Al2 MgCu2,cF24,227 Fd-3m 0.798,0.798,0.798,90,90,90 Friauf-Laves phase - 4.56 X 18119
Al-Eu-Zn Zn14.3 Eu2Al2.7 Zn17Th2,hR57,166 R-3m 0.91534,0.91534,1.3333,90,90,120 CaCu5-Zr4Al3 - 6.75 X 56230
Al-Eu-Zn Zn18Eu3Al4 Zn22Ce3,tI100,141 I41/amd 0.89999,0.89999,2.155,90,90,90 - - 6.62 X 56230
Al-Eu-Zn Zn2EuAl2 BaAl4,tI10,139 I4/mmm 0.4248,0.4248,1.1248,90,90,90 - - 5.51 X 56230
Al-F-Fe FeAlF5 rt FeAlF5,oI14,71 Immm 0.35574,0.6203,0.74289,90,90,90 - - 3.60 X 29019
Al-F-K KAlF4 lt KAlF4,mP24,11 P121/m1 0.6407,0.7237,0.73403,90,106.801,90 - - 2.90 X 18185
Al-F-K KAlF4 orth KAlF4,oP48,62 Pnma 0.83242,0.72502,1.18875,90,90,90 - - 2.63 X 53157
Al-F-K KAlF4 rt RbAlF4,tP12,127 P4/mbm 0.5043,0.5043,0.6164,90,90,90 - white 3.01 X 14017
Handbook of Inorganic Substances – Edition 2015 : Data 217

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-F-K K2AlF5 Rb2MnF5,tP8,123 P4/mmm 0.5965,0.5965,0.3699,90,90,90 - - 2.53 X 31856


Al-F-K K3AlF6 ht1 Rb2KGaF6,tI100,87 I4/m 1.33862,1.33862,0.85617,90,90,90 - - 2.80 X 56379
Al-F-K K3AlF6 ht3 [NH4]3FeF6,cF40,225 Fm-3m 0.85943,0.85943,0.85943,90,90,90 perovskite family white 2.70 X 56379
Al-F-K K3AlF6 rt orth K3AlF6,oF528,70 Fddd 1.20562,1.71133,3.61276,90,90,90 - - 2.76 X 56379
Al-F-K K3AlF6 rt tet K3AlF6,tI800,88 I41/a 1.88385,1.88385,3.39644,90,90,90 - - 2.85 X 52343
Al-F-Li Li3AlF6 ht Li3VF6,mS120,15 C12/c1 1.4201,0.8387,0.9861,90,94.07,90 - - 2.75 X 33591
Al-F-Li Li3AlF6 rt Li3AlF6,oP40,33 Pna21 0.951,0.82295,0.48762,90,90,90 - - 2.82 X 3826
Al-F-Mg MgAlF5 MgAlF5,oI14,71 Immm 0.3543,0.6123,0.7268,90,90,90 - - 3.08 X 39272
Al-F-Mn MnAlF5 MnAlF5,oS28,63 Cmcm 0.35837,0.9854,0.9537,90,90,90 - - 3.49 X 27653
Al-F-Na NaAlF4 Bi[ReO4],oS24,63 Cmcm 0.36121,1.4952,0.52692,90,90,90 - colorless 2.94 X 53162
Al-F-Na Na3AlF6 ht1 Na3AlF6,oI20,71 Immm 0.5627,0.56323,0.7958,90,90,90 - - 2.76 X 27900
Al-F-Na Na3AlF6 ht2 [NH4]3FeF6,cF40,225 Fm-3m 0.793,0.793,0.793,90,90,90 cryolite high - 2.80 X 43538
Al-F-Na Na3AlF6 rt Na3AlF6,mP20,14 P121/c1 0.54139,0.56012,0.94616,90,124.72,90 cryolite low colorless 2.96 X 27900
Al-F-Na Na5Al3F14 Na5Al3F14,tP44,128 P4/mnc 0.70138,0.70138,1.0402,90,90,90 chiolite - 3.00 X 14375
Al-F-O Al0.91 O0.73 F1.27 TiO2 ,tP6,136 P42/mnm 0.4627,0.4627,0.3005,90,90,90 - colorless 3.12 X 26897
Al-F-O Al3O3F3 Al3(O0.75 F0.25 )4F2,oP36,62 Pnma 0.8825,0.8408,0.4669,90,90,90 - colorless 3.57 X 51687
Al-F-Pb AlPbF5 BaFeF5,tI112,79 I4 1.425,1.425,0.723,90,90,90 - - 5.96 A 4578
Al-F-Pb Al0.06Pb0.94 F2.06 Th0.1 Pb0.9F2.2,cF124,225 Fm-3m 0.59042,0.59042,0.59042,90,90,90 fluorite family - 7.60 X 38046
Al-F-Pb Al2Pb3F12 Al2Pb3F12,mP68,14 P121/c1 0.9435,0.961,1.37502,90,132.735,90 - colorless 6.55 X 29512
Al-F-Pb Al3Pb5F19 ht Cr3Pb5F19,tI108,108 I4cm 1.407,1.407,0.73,90,90,90 - colorless 6.79 X 31437
Al-F-Pb Al3Pb5F19 ht1 Al3Pb5F19,aP54,2 P-1 0.7234,1.06984,1.06984,83.732,70.6,70.6 - - 6.66 X 41279
Al-F-Pb Al3Pb5F19 ht2 Al3Pb5F19,tI108,87 I4/m 1.4285,1.4285,0.7227,90,90,90 - colorless 6.66 X 29778
Al-F-Pb Al3Pb5F19 ht3 Al3Pb5F19,tI108,140 I4/mcm 1.429,1.429,0.723,90,90,90 - - 6.65 X 41279
Al-F-Pb Al3Pb5F19 lt Al3Pb5F19,tP216,85 P4/n 2.01738,2.01738,0.72205,90,90,90 - colorless 6.68 X 28508
Al-F-Rb RbAlF4 ht TlAlF4,tP6,123 P4/mmm 0.36586,0.36586,0.63061,90,90,90 - white 3.71 X 15321
Al-F-Rb RbAlF4 lt RbAlF4,oP24,59 Pmmn 0.72285,0.72252,0.62624,90,90,90 - - 3.83 X 15321
Al-F-Rb RbAlF4 rt RbAlF4,tP12,127 P4/mbm 0.51227,0.51227,0.62815,90,90,90 - - 3.80 X 15321
Al-F-Rb RbAlF4 tet RbAlF4,tI120,120 I-4c2 1.1666,1.1666,1.2551,90,90,90 - colorless 3.66 X 12989
Al-F-Sc Sc0.96 Al0.04 F3 ReO3,cP4,221 Pm-3m 0.401,0.401,0.401,90,90,90 - - 2.61 X 54183
Al-F-Sm SmAlF5 SmAlF5,tI132,87 I4/m 1.4144,1.4144,0.7222,90,90,90 - orange red 5.01 X 28154
Al-F-Sr SrAlF5 ht BaFeF5,tI112,79 I4 1.4089,1.4089,0.7167,90,90,90 - - 3.91 X 5688
Al-F-Sr SrAlF5 rt mon BaFeF5,mP56,14 P121/c1 0.89574,0.74614,1.3463,90,127.416,90 - colorless 3.90 X 39376
Al-F-Sr SrAlF5 rt tet SrAlF5,tI448,88 I41/a 1.98822,1.98822,1.43224,90,90,90 - yellow 3.93 X 35139
Al-F-Sr Sr5Al2F16 Sr5Al2F16,oS92,68 Ccce 0.74488,1.24714,1.41411,90,90,90 - colorless 4.03 X 39518
Al-F-Sr Sr5Al3F19 Al3Pb5F19,tI108,87 I4/m 1.4036,1.4036,0.7183,90,90,90 - - 4.13 A 24790
Al-F-Tl TlAlF4 mon TlMnF4,mS24,15 C12/c1 1.37661,0.51301,0.51376,90,111.794,90 - - 6.06 X 20318
Al-F-Tl TlAlF4 tet1 TlAlF4,tP6,123 P4/mmm 0.36587,0.36587,0.64378,90,90,90 - white 5.92 X 20318
Al-F-Tl TlAlF4 tet2 [NH4]AlF4,tI24,140 I4/mcm 0.51418,0.51418,1.2807,90,90,90 - - 6.03 X 20318
Al-F-Tl Tl2AlF5 Tl2AlF5,oS32,20 C222 1 0.824,1.006,0.746,90,90,90 - white 5.70 X 137
Al-F-Yb YbAlF5 SmAlF5,tI132,87 I4/m 1.3803,1.3803,0.7013,90,90,90 - green light 5.87 X 36523
Al-Fe-Gd GdFeAl MgZn2,hP12,194 P63/mmc 0.5442,0.5442,0.8831,90,90,120 Friauf-Laves phase - 7.04 A 51149
Al-Fe-Gd GdFe 0.75 Al1.25 rt MgCu2,cF24,227 Fd-3m 0.7753,0.7753,0.7753,90,90,90 Friauf-Laves phase - 6.64 X 3600
Al-Fe-Gd GdFe 1.5 Al0.5 rt MgCu2,cF24,227 Fd-3m 0.7521,0.7521,0.7521,90,90,90 Friauf-Laves phase - 7.95 X 3600
Al-Fe-Gd GdFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.897,1.0162,0.9023,90,90,90 - - 4.35 A 34696
Al-Fe-Gd GdFe 5Al7 CeMn4Al8,tI26,139 I4/mmm 0.8735,0.8735,0.5038,90,90,90 CaCu5-Zr4Al3 - 5.40 A 20250
Al-Fe-Gd Gd2 Fe14.5 Al2.5 hex Th2Ni17,hP38,194 P63/mmc 0.86,0.86,0.84,90,90,120 CaCu5-Zr4Al3 - 7.36 A 7361
Al-Fe-Gd Gd2 Fe7.5 Al9.5 rhom Zn17 Th2,hR57,166 R-3m 0.882,0.882,1.2794,90,90,120 CaCu5-Zr4Al3 - 5.72 A 9901
Al-Fe-Hf HfFeAl MgZn2,hP12,194 P63/mmc 0.5093,0.5093,0.8307,90,90,120 Friauf-Laves phase - 9.30 A 23647
Al-Fe-Hf HfFe 5Al7 CeMn4Al8,tI26,139 I4/mmm 0.85591,0.85591,0.49933,90,90,90 CaCu5-Zr4Al3 - 5.87 X 58575
Al-Fe-Hf Hf6FeAl2 *,hP9,182 P6322 0.783,0.783,0.329,90,90,120 Fe2P family - 11.22 N 4605
Al-Fe-Ho HoFe 0.6Al1.4 rt MgCu2,cF24,227 Fd-3m 0.767,0.767,0.767,90,90,90 Friauf-Laves phase - 6.95 X 9953
Al-Fe-Ho HoFe 1.2Al0.8 MgZn2,hP12,194 P63/mmc 0.53042,0.53042,0.86614,90,90,120 Friauf-Laves phase - 7.98 A 49535
Al-Fe-Ho HoFe 1.6Al0.4 rt MgCu2,cF24,227 Fd-3m 0.73853,0.73853,0.73853,90,90,90 Friauf-Laves phase - 8.74 X 49535
Al-Fe-Ho HoFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.8953,1.0137,0.8997,90,90,90 - - 4.45 A 34696
Al-Fe-Ho HoFe 4Al8 CeMn4Al8,tI26,139 I4/mmm 0.8749,0.8749,0.5049,90,90,90 CaCu5-Zr4Al3 - 5.19 X 16174
Al-Fe-Ho Ho0.60 Fe3.88 Al1.92 Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.4967,0.4967,0.4207,90,90,120 CaCu5-Zr4Al3 - 6.79 A 38848
Al-Fe-Ho Ho2 Fe15.1 Al1.9 Th2Ni17,hP38,194 P63/mmc 0.8515,0.8515,0.8324,90,90,120 CaCu5-Zr4Al3 - 7.78 A 38848
Al-Fe-Ho Ho2 Fe9Al8 Zn17 Th2,hR57,166 R-3m 0.87461,0.87461,1.26466,90,90,120 CaCu5-Zr4Al3 - 6.23 X 34683
Al-Fe-La LaFe 0.4 Al1.6 MgCu2,cF24,227 Fd-3m 0.8111,0.8111,0.8111,90,90,90 Friauf-Laves phase - 5.09 X 30168
Al-Fe-La LaFe 11.83 Al1.17 NaZn13,cF112,226 Fm-3c 1.15788,1.15788,1.15788,90,90,90 - - 7.11 X 19472
Al-Fe-La LaFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.9051,1.0249,0.9122,90,90,90 - - 4.09 A 34696
Al-Fe-La LaFe 2Al8 CeFe 2Al8,oP44,55 Pbam 1.265,1.436,0.427,90,90,90 - - 3.99 A 8059
Al-Fe-La LaFe 4Al8 CeMn4Al8,tI26,139 I4/mmm 0.8937,0.8937,0.5078,90,90,90 CaCu5-Zr4Al3 gray 4.73 X 33927
Al-Fe-La LaFe 7Al6 *,o**,* - 0.8206,0.8561,1.1812,90,90,90 - - - N 29340
Al-Fe-La La2Fe 7Al10 Zn17 Th2,hR57,166 R-3m 0.8962,0.8962,1.298,90,90,120 CaCu5-Zr4Al3 - 5.18 A 30168
Al-Fe-La La6Fe 10.4 Al3.6 La6Co 9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.82294,0.82294,2.3768,90,90,90 - - 6.24 X 52936
Al-Fe-Lu LuFeAl MgZn2,hP12,194 P63/mmc 0.53,0.53,0.86,90,90,120 Friauf-Laves phase - 8.19 A 9089
Al-Fe-Lu LuFe 0.4 Al1.6 MgCu2,cF24,227 Fd-3m 0.76333,0.76333,0.76333,90,90,90 Friauf-Laves phase - 7.18 X 22398
Al-Fe-Lu LuFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.8949,1.0114,0.898,90,90,90 - - 4.55 A 34696
Al-Fe-Lu LuFe 4Al8 ThMn12,tI26,139 I4/mmm 0.87072,0.87072,0.50353,90,90,90 CaCu5-Zr4Al3 gray 5.34 X 38818
Al-Fe-Mn MnFe 2Al Cu2MnAl,cF16,225 Fm-3m 0.5816,0.5816,0.5816,90,90,90 b.c.c. family - 6.54 X 14341
Al-Fe-Mn Mn0.005 Fe0.003 Al0.992 Cu,cF4,225 Fm-3m 0.4045,0.4045,0.4045,90,90,90 close-packed structure - 2.73 X 5293
Al-Fe-Mn Mn0.17 Fe0.59 Al0.24 m W,cI2,229 Im-3m 0.2921,0.2921,0.2921,90,90,90 b.c.c. family - 6.50 X 59198
Al-Fe-Mn Mn0.375 Fe0.375 Al0.25 ht1 Mn,cP20,213 P4132 0.634,0.634,0.634,90,90,90 - - 6.29 A 9982
Al-Fe-Mn Mn0.5 Fe0.5 Al6 MnAl6,oS28,63 Cmcm 0.7498,0.6495,0.8837,90,90,90 - - 3.35 A 9450
Al-Fe-Mn Mn0.6 Fe0.4 Al CsCl,cP2,221 Pm-3m 0.2955,0.2955,0.2955,90,90,90 b.c.c. family - 5.30 X 16223
Al-Fe-Mn Mn0.9 Fe2.1 Al rt BiF3 ,cF16,225 Fm-3m 0.5805,0.5805,0.5805,90,90,90 b.c.c. family - 6.58 X 9982
Al-Fe-Mo MoFe0.33 Al2.67 TiAl3,tI8,139 I4/mmm 0.3747,0.3747,0.841,90,90,90 close-packed structure - 5.24 X 50366
218 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Fe-Mo MoFe2Al Cu2MnAl,cF16,225 Fm-3m 0.5918,0.5918,0.5918,90,90,90 b.c.c. family - 7.52 X 14341


Al-Fe-Mo Mo0.058 Fe0.712 Al0.23 W,cI2,229 Im-3m 0.2913,0.2913,0.2913,90,90,90 b.c.c. family - 6.92 X 50364
Al-Fe-Mo Mo0.176 Fe0.424 Al0.4 ht W,cI2,229 Im-3m 0.3082,0.3082,0.3082,90,90,90 b.c.c. family - 5.83 X 50366
Al-Fe-Mo Mo0.2Fe3.8 Al13 Fe4Al13,mS102,12 C12/m1 1.5446,0.8103,1.255,90,107.74,90 - - 3.88 A 50364
Al-Fe-Mo Mo0.83 Fe0.125 Al0.045 W,cI2,229 Im-3m 0.31359,0.31359,0.31359,90,90,90 b.c.c. family - 9.46 X 50364
Al-Fe-Mo Mo0.9Fe0.1 Al4 WAl4,mS30,8 C1m1 0.5245,1.7759,0.522,90,100.19,90 - - 4.16 A 50364
Al-Fe-Mo Mo0.96 Fe0.04 Al3 MoAl3,mS32,12 C12/m1 1.6378,0.3589,0.8386,90,102.05,90 close-packed structure - 4.83 A 50364
Al-Fe-Mo Mo0.97 Fe0.03 Al5 MoAl5,hR36,167 R-3c 0.49433,0.49433,2.6243,90,90,120 close-packed structure - 4.12 A 50364
Al-Fe-Mo Mo2.89 Fe0.11 Al8 Mo3Al8,mS22,12 C12/m1 0.9165,0.3625,1.0047,90,100.67,90 close-packed structure - 5.06 A 50364
Al-Fe-Mo Mo2.98 Fe0.09 Al0.93 Cr3Si,cP8,223 Pm-3n 0.4947,0.4947,0.4947,90,90,90 Frank-Kasper phase - 8.67 X 50364
Al-Fe-Mo Mo4.95 Fe6.25 Al1.8 rt W6Fe7,hR39,166 R-3m 0.4798,0.4798,2.604,90,90,120 Frank-Kasper phase - 8.37 A 50364
Al-Fe-Mo Mo9Fe4.75 Al0.25 Nb9Co4Ge,tI56,140 I4/mcm 1.2683,1.2683,0.4838,90,90,90 - - 9.69 X 35793
Al-Fe-N Fe0.75 Al0.25 N0.25 NaCl,cF8,225 Fm-3m 0.37967,0.37967,0.37967,90,90,90 rocksalt family - 6.33 X 52021
Al-Fe-Nb NbFeAl MgZn2,hP12,194 P63 /mmc 0.498,0.498,0.81,90,90,120 Friauf-Laves phase - 6.71 A 27811
Al-Fe-Nb Nb0.01 Fe0.73 Al0.26 W,cI2,229 Im-3m 0.2917,0.2917,0.2917,90,90,90 b.c.c. family - 6.52 X 52462
Al-Fe-Nb Nb0.05 Fe1.15 Al0.8 CsCl,cP2,221 Pm-3m 0.2917,0.2917,0.2917,90,90,90 b.c.c. family - 6.05 X 52462
Al-Fe-Nd NdFe2Al10 YbFe2Al10 ,oS52,63 Cmcm 0.9006,1.0206,0.9069,90,90,90 - - 4.19 A 34696
Al-Fe-Nd NdFe4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.8804,0.8804,0.5054,90,90,90 CaCu5-Zr4Al3 - 4.95 A 11676
Al-Fe-Nd Nd2Fe7.6 Al9.4 Zn17Th2,hR57,166 R-3m 0.88678,0.88678,1.28707,90,90,120 CaCu5-Zr4Al3 - 5.49 X 27496
Al-Fe-Nd Nd6Fe10.5 Al3.5 La6Co9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.81513,0.81513,2.3141,90,90,90 - - 6.68 X 52936
Al-Fe-Ni Fe0.18 Ni1.02 Al0.8 CsCl,cP2,221 Pm-3m 0.28805,0.28805,0.28805,90,90,90 b.c.c. family - 6.36 X 49451
Al-Fe-Ni Fe0.4 Ni3Al0.6 Cu3Au,cP4,221 Pm-3m 0.3562,0.3562,0.3562,90,90,90 close-packed structure - 7.89 X 20899
Al-Fe-Ni Fe0.453 Ni0.449 Al0.098 Cu,cF4,225 Fm-3m 0.35992,0.35992,0.35992,90,90,90 close-packed structure - 7.74 X 50862
Al-Fe-Ni Fe0.684 Ni0.162 Al0.154 W,cI2,229 Im-3m 0.28853,0.28853,0.28853,90,90,90 b.c.c. family - 7.17 X 50862
Al-Fe-Ni Fe0.7 Ni1.3 Al9 Co2Al9,mP22,14 P121/c1 0.62406,0.62993,0.85992,90,95.129,90 - - 3.53 X 48365
Al-Fe-Ni Fe1.3 Ni0.7 Al5 Co2Al5,hP28,194 P63 /mmc 0.77094,0.77094,0.76795,90,90,120 - - 4.18 X 48365
Al-Fe-Ni Fe2NiAl Cu2MnAl,cF16,225 Fm-3m 0.5758,0.5758,0.5758,90,90,90 b.c.c. family - 6.87 X 14341
Al-Fe-Ni Fe2.4 Ni1.6 Al13 Fe4Al13,mS102,12 C12/m1 1.5437,0.8109,1.243,90,107.66,90 - - 3.89 A 15736
Al-Fe-Np NpFe4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.8748,0.8748,0.50372,90,90,90 CaCu5-Zr4Al3 - 5.83 X 45019
Al-Fe-O FeAlO3 FeGaO3,oP40,33 Pna21 0.49899,0.8567,0.92592,90,90,90 - - 4.39 X 50745
Al-Fe-O Fe1.09 Al1.91 O4 lt MgAl2O4,cF56,227 Fd-3m 0.81646,0.81646,0.81646,90,90,90 hercynite - 4.31 X 39829
Al-Fe-O Fe1.84 Al0.16 O3 Al2O3,hR30,167 R-3c 0.5011,0.5011,1.3669,90,90,120 - - 5.20 A 8583
Al-Fe-O Fe1.94 Al0.06 O3 Fe2O3,oP40,33 Pna21 0.50873,0.87768,0.94694,90,90,90 - - 4.96 X 52369
Al-Fe-Pd Fe11PdAl39 Fe10(Fe0.5Pd0.5 )2Al39,oS204,64 Cmce 0.813,1.5474,2.3868,90,90,90 - - 3.92 X 59146
Al-Fe-Pd Fe13.0Pd10.5 Al76.5 *,oS*,* - 1.6,2.31,4.7,90,90,90 - - - N 43161
Al-Fe-Pd Fe2Pd21Al39 Fe2Pd21Al39,cF296,202 Fm-3 1.5515,1.5515,1.5515,90,90,90 - - 6.04 X 34503
Al-Fe-Pr PrFe1.2 Al0.8 MgZn2,hP12,194 P63 /mmc 0.546,0.546,0.883,90,90,120 Friauf-Laves phase - 6.69 A 57233
Al-Fe-Pr PrFe1.6 Al0.4 MgCu2,cF24,227 Fd-3m 0.754,0.754,0.754,90,90,90 Friauf-Laves phase - 7.47 X 57233
Al-Fe-Pr PrFe2Al10 YbFe2Al10 ,oS52,63 Cmcm 0.9017,1.0214,0.908,90,90,90 - - 4.15 A 34696
Al-Fe-Pr PrFe2Al8 CeFe2Al8,oP44,55 Pbam 1.25216,1.44545,0.4044,90,90,90 - - 4.25 A 24975
Al-Fe-Pr PrFe4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.88578,0.88578,0.50688,90,90,90 CaCu5-Zr4Al3 - 4.84 A 24975
Al-Fe-Pr Pr2Fe8.7Al8.3 Zn17Th2,hR57,166 R-3m 0.88479,0.88479,1.28479,90,90,120 CaCu5-Zr4Al3 - 5.67 A 24975
Al-Fe-Pr Pr6Fe10Al4 La6Co9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.8188,0.8188,2.3139,90,90,90 - - 6.47 A 44815
Al-Fe-Pu PuFeAl MgZn2,hP12,194 P63 /mmc 0.5259,0.5259,0.8527,90,90,120 Friauf-Laves phase - 10.63 A 8280
Al-Fe-Re Re6Fe5.5 Al1.5 W6Fe7,hR39,166 R-3m 0.4726,0.4726,2.536,90,90,120 Frank-Kasper phase - 14.88 A 10953
Al-Fe-Rh FeRh0.2 Al0.8 CsCl,cP2,221 Pm-3m 0.2914,0.2914,0.2914,90,90,90 b.c.c. family - 6.58 X 28978
Al-Fe-Rh FeRh0.9 Al0.1 CsCl,cP2,221 Pm-3m 0.2982,0.2982,0.2982,90,90,90 b.c.c. family - 9.47 X 28978
Al-Fe-Ru Fe0.9 Ru0.1 Al CsCl,cP2,221 Pm-3m 0.2899,0.2899,0.2899,90,90,90 b.c.c. family - 5.95 X 13594
Al-Fe-S FeAl2S4 rhom ZnIn2S4,hR21,160 R3m 0.36366,0.36366,3.57189,90,90,120 - red violet 2.90 A 379
Al-Fe-S FeAl2S4 trig FeGa2S4,hP7,164 P-3m1 0.36825,0.36825,1.2192,90,90,120 - brown dark 2.76 X 55972
Al-Fe-Sc ScFe1.35 Al0.65 MgZn2,hP12,194 P63 /mmc 0.5108,0.5108,0.8319,90,90,120 Friauf-Laves phase - 4.87 A 5218
Al-Fe-Sc ScFe4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.8651,0.8651,0.5018,90,90,90 CaCu5-Zr4Al3 - 4.28 X 43076
Al-Fe-Si FeAl2Si Fe(Al0.67 Si0.33)3,oS128,67 Cmme 0.7995,1.5162,1.5221,90,90,90 - - 3.97 X 22874
Al-Fe-Si FeAl2.26 Si0.04 FeAl2.7 ,oS16,63 Cmcm 0.76464,0.64002,0.42223,90,90,90 - - 3.79 A 56221
Al-Fe-Si FeAl2.4 Si0.6 Na3As,hP8,194 P63 /mmc 0.406,0.406,0.7738,90,90,120 - - 4.13 X 25478
Al-Fe-Si FeAl3Si2 FeAl3Si2,oP24,60 Pbcn 0.6061,0.6061,0.9525,90,90,90 - gray 3.66 X 29784
Al-Fe-Si Fe0.7 Al0.14 Si0.16 W,cI2,229 Im-3m 0.2853,0.2853,0.2853,90,90,90 b.c.c. family - 6.77 X 56817
Al-Fe-Si Fe0.97 Al0.08 Si1.95 ht Fe0.92 Si2,tP3,123 P4/mmm 0.26792,0.26792,0.51676,90,90,90 - - 4.97 A 56221
Al-Fe-Si Fe1.01 Al0.02 Si0.97 FeSi,cP8,198 P213 0.44909,0.44909,0.44909,90,90,90 - - 6.17 A 56221
Al-Fe-Si Fe1.7 Al4Si Co2Al5,hP28,194 P63 /mmc 0.7509,0.7509,0.7594,90,90,120 - - 4.14 X 22873
Al-Fe-Si Fe2Al3Si ht Mn3Ni2Si,cF96,227 Fd-3m 1.0806,1.0806,1.0806,90,90,90 - - 4.65 X 56221
Al-Fe-Si Fe2Al3Si3 Fe2Al3Si3,mP64,14 P121/c1 0.7179,0.8354,1.57076,90,113.331,90 - gray 4.25 X 29804
Al-Fe-Si Fe2Al5Si *,oS48,* - 0.6184,0.625,2.069,90,90,90 - - 3.42 N 28076
Al-Fe-Si Fe2Al5Si2 *,mS*,* - 0.89,1.025,1.35662,90,102.821,90 - - - N 3620
Al-Fe-Si Fe2Al9Si2 Fe2(Al0.82 Si0.18 )11,mS52,15 C12/c1 2.0813,0.6175,0.6161,90,90.42,90 - - 3.45 X 28511
Al-Fe-Si Fe24Al85.2 Si12 Fe23Al81Si15,hP246,194 P63 /mmc 1.2346,1.2346,2.621,90,90,120 - gray silver 3.82 X 56827
Al-Fe-Si Fe3Al0.25 Si0.75 BiF3,cF16,225 Fm-3m 0.569,0.569,0.569,90,90,90 b.c.c. family - 7.04 X 12644
Al-Fe-Si Fe3Al2Si4 Fe3Al2Si4,oS36,63 Cmcm 0.36687,1.2385,1.0147,90,90,90 - gray 4.81 X 31376
Al-Fe-Si Fe3Al2.67 Si2.33 Fe3Al2Si3,aP16,2 P-1 0.4684,0.6325,0.7498,100.99,105.6,101.62 - gray 5.01 X 56221
Al-Fe-Si Fe4Al17.5 Si1.5 stab Mn4Al14(Al0.5 Si0.5 )4Si,cP138,200 Pm-3 1.2548,1.2548,1.2548,90,90,90 - - 3.72 A 347
Al-Fe-Si Fe4.23 Al12.02 Si0.75 Fe4Al13,mS102,12 C12/m1 1.5498,0.79627,1.25567,90,107.96,90 - - 3.93 A 56221
Al-Fe-Si Fe6.46 Al12.26 Si0.28 Fe5(Fe0.7 Al0.3)2Al12,aP19,2 P-1 0.48811,0.64472,0.87187,87.967,74.38,83.39 - - 4.42 A 56221
Al-Fe-Si Fe8Al17.4 Si7.6 Fe8Al16(Al0.15 Si0.85 )9,mP132,14 P121/c1 0.85743,1.52402,1.41749,90,94.841,90 b.c.c. family black 4.07 X 58212
Al-Fe-Si Fe8.57 Al25.83 Si6.6 Fe8.6 Al25.8 Si6.6 ,hR123,148 R-3 1.0222,1.0222,1.9667,90,90,120 - - 3.81 X 43119
Al-Fe-Sm SmFe0.6 Al1.4 MgCu2,cF24,227 Fd-3m 0.78,0.78,0.78,90,90,90 Friauf-Laves phase - 6.21 X 8177
Al-Fe-Sm SmFe1.1 Al0.9 MgZn2,hP12,194 P63 /mmc 0.54,0.54,0.875,90,90,120 Friauf-Laves phase - 7.10 A 8177
Al-Fe-Sm SmFe1.8 Al0.2 MgCu2,cF24,227 Fd-3m 0.748,0.748,0.748,90,90,90 Friauf-Laves phase - 8.14 X 8177
Al-Fe-Sm SmFe2Al10 YbFe2Al10 ,oS52,63 Cmcm 0.899,1.0186,0.9045,90,90,90 - - 4.27 X 34696
Handbook of Inorganic Substances – Edition 2015 : Data 219

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Fe-Sm SmFe 3.3 Al8.7 CeMn4Al8,tI26,139 I4/mmm 0.881,0.881,0.505,90,90,90 CaCu5-Zr4Al3 - 4.82 A 8177
Al-Fe-Sm Sm12 Fe14Al5 rt Sm12 Fe14Al5,hP31,164 P-3m1 0.90388,0.90388,0.81383,90,90,120 - - 7.85 X 54790
Al-Fe-Sm Sm2 Fe15Al2 rt Zn17 Th2,hR57,166 R-3m 0.8618,0.8618,1.2522,90,90,120 CaCu5-Zr4Al3 - 7.38 X 38834
Al-Fe-Sm Sm6 Fe11Al3 La6Co 9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.81143,0.81143,2.29949,90,90,90 - - 7.01 A 26296
Al-Fe-Ta Ta0.5 Fe2Al0.5 MgZn2,hP12,194 P63/mmc 0.4816,0.4816,0.7852,90,90,120 Friauf-Laves phase - 9.08 A 22428
Al-Fe-Ta Ta6Fe 3.5 Al3.5 W6Fe7,hR39,166 R-3m 0.4973,0.4973,2.731,90,90,120 Frank-Kasper phase - 11.72 A 4314
Al-Fe-Tb TbFeAl MgZn2,hP12,194 P63/mmc 0.5399,0.5399,0.8721,90,90,120 Friauf-Laves phase - 7.29 A 7537
Al-Fe-Tb TbFe 1.475 Al0.525 MgCu2,cF24,227 Fd-3m 0.7473,0.7473,0.7473,90,90,90 Friauf-Laves phase - 8.13 X 7537
Al-Fe-Tb TbFe 2Al CeNi3,hP24,194 P63/mmc 0.5226,0.5226,1.6794,90,90,120 Laves-CaCu5 - 7.46 A 9087
Al-Fe-Tb TbFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.89386,1.01161,0.89791,90,90,90 - - 4.42 X 41747
Al-Fe-Tb TbFe 2.8 Al0.2 PuNi3,hR36,166 R-3m 0.516,0.516,2.4781,90,90,120 Laves-CaCu5 - 8.39 A 9087
Al-Fe-Tb TbFe 4.28 Al7.72 CeMn4Al8,tI26,139 I4/mmm 0.8743,0.8743,0.5056,90,90,90 CaCu5-Zr4Al3 gray 5.21 X 33927
Al-Fe-Tb Tb0.67 Fe4.24 Al1.43 Cu5.44 Tb0.78 ,hP8,191 P6/mmm 0.497,0.497,0.4204,90,90,120 CaCu5-Zr4Al3 - 7.05 A 38848
Al-Fe-Tb Tb0.75 Fe0.9 Al1.35 MgCu2,cF24,227 Fd-3m 0.7758,0.7758,0.7758,90,90,90 Friauf-Laves phase - 5.86 X 9087
Al-Fe-Tb Tb2Fe 11Al6 Zn17 Th2,hR57,166 R-3m 0.8694,0.8694,1.26501,90,90,120 CaCu5-Zr4Al3 - 6.58 X 28878
Al-Fe-Tb Tb2Fe 14.15 Al2.85 Th2Ni17,hP38,194 P63/mmc 0.8532,0.8532,0.8349,90,90,120 CaCu5-Zr4Al3 - 7.48 X 7496
Al-Fe-Tb Tb4.86 Fe20.2 Al3.94 Th6Mn23,cF116,225 Fm-3m 1.2173,1.2173,1.2173,90,90,90 - - 7.39 X 6749
Al-Fe-Th ThFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.89806,1.0252,0.90881,90,90,90 - - 4.87 X 44644
Al-Fe-Th ThFe 2.67 Al0.33 PuNi3,hR36,166 R-3m 0.5251,0.5251,2.524,90,90,120 Laves-CaCu5 - 9.67 A 31919
Al-Fe-Th ThFe 3Al2 PrNi2Al3,hP6,191 P6/mmm 0.5184,0.5184,0.4091,90,90,120 - - 7.91 X 12437
Al-Fe-Th ThFe 4Al8 CeMn4Al8,tI26,139 I4/mmm 0.8827,0.8827,0.5095,90,90,90 CaCu5-Zr4Al3 - 5.62 X 22367
Al-Fe-Th Th4Fe 3Al32 Th4Fe3Al32,oS78,65 Cmmm 1.0029,1.6398,0.8201,90,90,90 - - 4.82 X 52456
Al-Fe-Ti TiFeAl MgZn2,hP12,194 P63/mmc 0.49661,0.49661,0.80628,90,90,120 Friauf-Laves phase - 5.04 X 46393
Al-Fe-Ti TiFe 0.048 Al2.952 TiAl3,tI8,139 I4/mmm 0.3847,0.3847,0.8602,90,90,90 close-packed structure - 3.40 X 30486
Al-Fe-Ti TiFe 0.95 Al0.05 CsCl,cP2,221 Pm-3m 0.2985,0.2985,0.2985,90,90,90 b.c.c. family - 6.39 X 35935
Al-Fe-Ti TiFe 2Al Cu2MnAl,cF16,225 Fm-3m 0.5879,0.5879,0.5879,90,90,90 b.c.c. family - 6.10 X 14341
Al-Fe-Ti Ti0.085 Fe0.685 Al0.23 W,cI2,229 Im-3m 0.293,0.293,0.293,90,90,90 b.c.c. family - 6.41 X 52756
Al-Fe-Ti Ti0.088 FeAl2.412 FeAl2.8 ,oS24,63 Cmcm 0.7656,0.6463,0.4229,90,90,90 - - 3.97 A 30486
Al-Fe-Ti Ti0.2 Fe0.8 Al CsCl,cP2,221 Pm-3m 0.2919,0.2919,0.2919,90,90,90 b.c.c. family - 5.42 X 34626
Al-Fe-Ti Ti0.324 Fe6Al11.676 rt Fe5(Fe 0.5 Al0.5)3Al10,aP18,1 P1 0.4872,0.6459,0.87475,87.94,74.401,83.11 - - 4.20 A 30486
Al-Fe-Ti Ti0.4 Fe0.1 Al0.5 m *,hR*,* - 0.3992,0.3992,0.4077,90,90,120 - - - N 34626
Al-Fe-Ti Ti0.93 Fe4Al12.07 CuFe4Al12,mS102,12 C12/m1 1.5653,0.8052,1.243,90,107.58,90 - - 3.96 X 30183
Al-Fe-Ti Ti1.12 Fe0.32 Al2.56 Cu3Au,cP4,221 Pm-3m 0.3951,0.3951,0.3951,90,90,90 close-packed structure - 3.79 X 29836
Al-Fe-Ti Ti6Fe 7Al17 (Ti0.42 Al0.58)15Pt7Al8 ,cF120,225 Fm-3m 1.18898,1.18898,1.18898,90,90,90 - - 4.49 X 41497
Al-Fe-Ti Ti6.18 Fe7.28 Al15.54 *,tP*,* - 1.1959,1.1959,1.27459,90,90,90 - - - N 30486
Al-Fe-Tm TmFeAl MgZn2,hP12,194 P63/mmc 0.5339,0.5339,0.8636,90,90,120 Friauf-Laves phase - 7.84 X 37327
Al-Fe-Tm TmFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.8955,1.0127,0.8982,90,90,90 - - 4.49 A 34696
Al-Fe-Tm TmFe 4Al8 ThMn12,tI26,139 I4/mmm 0.8716,0.8716,0.50367,90,90,90 CaCu5-Zr4Al3 - 5.28 X 38818
Al-Fe-Tm Tm2 Fe15Al2 Th2Ni17,hP38,194 P63/mmc 0.8429,0.8429,0.8328,90,90,120 CaCu5-Zr4Al3 - 7.97 A 23521
Al-Fe-U UFeAl ht hex2 ZrNiAl,hP9,189 P-62m 0.667,0.667,0.3992,90,90,120 Fe2P family - 10.39 A 19446
Al-Fe-U UFe 0.4 Al1.6 MgCu2,cF24,227 Fd-3m 0.757,0.757,0.757,90,90,90 Friauf-Laves phase - 9.30 X 1785
Al-Fe-U UFe 0.92 Al1.08 ht hex1 MgZn2,hP12,194 P63/mmc 0.523,0.523,0.818,90,90,120 Friauf-Laves phase - 10.92 A 2115
Al-Fe-U UFe 1.6 Al0.4 rt MgCu2,cF24,227 Fd-3m 0.717,0.717,0.717,90,90,90 Friauf-Laves phase - 12.19 X 1785
Al-Fe-U UFe 2Al10 rt YbFe 2Al10,oS52,63 Cmcm 0.89146,1.01986,0.90114,90,90,90 - - 5.02 X 42930
Al-Fe-U UFe 4Al8 rt CeMn4Al8,tI26,139 I4/mmm 0.87365,0.87365,0.50302,90,90,90 CaCu5-Zr4Al3 - 5.86 X 33325
Al-Fe-U U2FeAl20 U2FeAl20,tI92,121 I-42m 1.24138,1.24138,1.03014,90,90,90 - - 4.48 X 50637
Al-Fe-U U2Fe 12Al5 Th2Ni17,hP38,194 P63/mmc 0.85631,0.85631,0.8438,90,90,120 CaCu5-Zr4Al3 - 7.94 A 44640
Al-Fe-U U2Fe 3.6 Al13.4 Th2Ni17,hP38,194 P63/mmc 0.88589,0.88589,0.89824,90,90,120 CaCu5-Zr4Al3 - 5.65 A 44640
Al-Fe-U U2Fe 8Al9 Zn17 Th2,hR57,166 R-3m 0.8753,0.8753,1.2658,90,90,120 CaCu5-Zr4Al3 - 6.91 A 44640
Al-Fe-U U3Fe 4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.8735,0.8735,0.92478,90,90,120 - - 6.85 X 52218
Al-Fe-V V0.375 Fe0.375 Al0.25 W,cI2,229 Im-3m 0.294,0.294,0.294,90,90,90 b.c.c. family - 6.12 X 19196
Al-Fe-V V0.4 Fe2.6 Al rt BiF3 ,cF16,225 Fm-3m 0.5772,0.5772,0.5772,90,90,90 b.c.c. family - 6.65 X 26258
Al-Fe-V V0.45 Fe1.05 Al0.5 CsCl,cP2,221 Pm-3m 0.29,0.29,0.29,90,90,90 b.c.c. family - 6.47 X 19196
Al-Fe-V V0.9 Fe2.1 Al Cu2MnAl,cF16,225 Fm-3m 0.57528,0.57528,0.57528,90,90,90 b.c.c. family - 6.63 X 38943
Al-Fe-Y YFeAl hex MgZn2,hP12,194 P63/mmc 0.541,0.541,0.881,90,90,120 Friauf-Laves phase - 5.11 X 7030
Al-Fe-Y YFe 0.85 Al1.15 cub MgCu2,cF24,227 Fd-3m 0.767,0.767,0.767,90,90,90 Friauf-Laves phase - 4.93 X 9092
Al-Fe-Y YFe 1.35 Al0.65 MgCu2,cF24,227 Fd-3m 0.7515,0.7515,0.7515,90,90,90 Friauf-Laves phase - 5.69 X 9092
Al-Fe-Y YFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.89654,1.01578,0.9011,90,90,90 - - 3.81 X 59548
Al-Fe-Y YFe 4Al8 CeMn4Al8,tI26,139 I4/mmm 0.87561,0.87561,0.50446,90,90,90 CaCu5-Zr4Al3 - 4.54 X 37283
Al-Fe-Y Y2Fe 13Al4 rt Zn17 Th2,hR57,166 R-3m 0.8593,0.8593,1.2593,90,90,120 CaCu5-Zr4Al3 - 6.26 X 34683
Al-Fe-Y Y2Fe 15Al2 ht Th2Ni17,hP38,194 P63/mmc 0.8566,0.8566,0.8321,90,90,120 CaCu5-Zr4Al3 - 6.72 A 30437
Al-Fe-Y Y2Fe 15.3 Al1.7 Y2Fe17,hP56,194 P63/mmc 0.85261,0.85261,0.83344,90,90,120 CaCu5-Zr4Al3 - 6.82 X 38779
Al-Fe-Y Y6Fe 21.85 Al1.15 Th6Mn23,cF116,225 Fm-3m 1.2128,1.2128,1.2128,90,90,90 - - 6.65 X 17937
Al-Fe-Yb YbFe 2Al10 YbFe 2Al10,oS52,63 Cmcm 0.8966,1.0153,0.9003,90,90,90 - gray 4.49 X 31134
Al-Fe-Yb YbFe 4.56 Al7.44 CeMn4Al8,tI26,139 I4/mmm 0.8674,0.8674,0.5034,90,90,90 CaCu5-Zr4Al3 - 5.51 X 32519
Al-Fe-Yb Yb0.7 Fe4.8 Al0.7 Cu5.36 Yb0.82 ,hP14,191 P6/mmm 0.4983,0.4983,0.42229,90,90,120 CaCu5-Zr4Al3 - 7.46 X 42434
Al-Fe-Yb Yb2Fe 16Al Yb1.85 Fe17.30 ,hP68,194 P63/mmc 0.856,0.856,0.8415,90,90,120 CaCu5-Zr4Al3 - 7.88 X 42434
Al-Fe-Yb Yb2.03 Fe13.21 Al3.73 Yb2.03 Fe13.21 Al3.73 ,hR78,166 R-3m 0.8679,0.8679,1.257,90,90,120 CaCu5-Zr4Al3 - 7.23 X 42434
Al-Fe-Yb Yb2.14 Fe14.88 Al1.84 Yb2.14 Fe14.87 Al1.85 ,hR126,166 R-3m 0.8623,0.8623,1.259,90,90,120 CaCu5-Zr4Al3 - 7.69 X 42434
Al-Fe-Zn ZnxFeAl2.5 FeAl2.8 ,oS24,63 Cmcm 0.7656,0.6407,0.4241,90,90,90 - - 3.94 A 23830
Al-Fe-Zr ZrFeAl MgZn2,hP12,194 P63/mmc 0.51446,0.51446,0.83636,90,90,120 Friauf-Laves phase - 6.03 X 33161
Al-Fe-Zr ZrFe 0.2Al1.8 MgCu2,cF24,227 Fd-3m 0.7461,0.7461,0.7461,90,90,90 Friauf-Laves phase - 4.83 X 8419
Al-Fe-Zr ZrFe 0.3Al2.7 Cu3Au,cP4,221 Pm-3m 0.4069,0.4069,0.4069,90,90,90 close-packed structure - 4.46 X 44059
Al-Fe-Zr ZrFe 1.834 Al0.166 MgCu2,cF24,227 Fd-3m 0.70899,0.70899,0.70899,90,90,90 Friauf-Laves phase - 7.39 X 33161
Al-Fe-Zr ZrFe 3.3Al1.3 *,tI*,140 I4/mcm 0.837,0.837,0.998,90,90,90 - - - N 7336
Al-Fe-Zr ZrFe 5Al7 CeMn4Al8,tI26,139 I4/mmm 0.85779,0.85779,0.5002,90,90,90 CaCu5-Zr4Al3 - 5.05 X 58575
Al-Fe-Zr Zr6FeAl2 K2UF6,hP9,189 P-62m 0.7921,0.7921,0.33603,90,90,120 Fe2P family gray 5.98 X 33926
Al-Ga-Gd GdAl0.6 Ga1.4 AlB2 ,hP3,191 P6/mmm 0.425,0.425,0.41,90,90,120 AlB2 family - 7.02 X 19166
220 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ga-Gd GdAl1.8 Ga0.2 MgCu2,cF24,227 Fd-3m 0.79,0.79,0.79,90,90,90 Friauf-Laves phase - 5.92 X 19166
Al-Ga-Hf HfAl0.6 Ga0.4 TlI,oS8,63 Cmcm 0.3287,1.0731,0.4208,90,90,90 CrB(TlI)-FeB - 9.96 A 20677
Al-Ga-Hf Hf5Al2Ga stab Mn5Si3,hP16,193 P63 /mcm 0.8025,0.8025,0.5692,90,90,120 - - 10.63 A 20677
Al-Ga-Ho HoAlGa AlB2,hP3,191 P6/mmm 0.4444,0.4444,0.3555,90,90,120 AlB2 family - 7.15 X 24968
Al-Ga-La LaAl1.7 Ga0.3 ht AlB2,hP3,191 P6/mmm 0.444,0.444,0.439,90,90,120 AlB2 family - 4.56 X 4888
Al-Ga-La LaAl2Ga2 CeAl2Ga2,tI10,139 I4/mmm 0.4276,0.4276,1.116,90,90,90 - - 5.41 A 4888
Al-Ga-La La4.81 Al1.62 Ga1.38 La4.81 (Al0.54 Ga0.46)3,tI40,140 I4/mcm 1.279,1.279,0.5546,90,90,90 - - 5.92 X 45199
Al-Ga-Li LiAl0.5 Ga0.5 NaTl,cF16,227 Fd-3m 0.626,0.626,0.626,90,90,90 b.c.c. family blue gray 2.99 X 2394
Al-Ga-Mn Mn1.39 Al0.37 Ga0.24 CuAu,tP2,123 P4/mmm 0.2755,0.2755,0.362,90,90,90 close-packed structure - 6.23 X 21265
Al-Ga-N Al0.072 GaN Al0.072 GaN,hP6,186 P63 mc 0.31945,0.31945,0.51983,90,90,120 - - 6.19 X 47724
Al-Ga-N Al0.86 Ga0.14 N hex ZnO,hP4,186 P63 mc 0.31126,0.31126,0.50033,90,90,120 adamantane structure colorless 3.72 X 54708
Al-Ga-Na NaAl2Ga2 CeAl2Ga2,tI10,139 I4/mmm 0.41817,0.41817,1.1388,90,90,90 - - 3.61 X 52484
Al-Ga-Nb NbAl1.5 Ga1.5 TiAl3,tI8,139 I4/mmm 0.3819,0.3819,0.8668,90,90,90 close-packed structure - 6.25 X 5499
Al-Ga-Nb Nb2.76 Al0.33 Ga0.91 Cr3Si,cP8,223 Pm-3n 0.5189,0.5189,0.5189,90,90,90 Frank-Kasper phase - 7.82 X 9885
Al-Ga-Nd NdAl0.5 Ga1.5 AlB2,hP3,191 P6/mmm 0.4297,0.4297,0.4238,90,90,120 AlB2 family - 6.43 X 16219
Al-Ga-Nd NdAl1.25 Ga0.75 AlB2,hP3,191 P6/mmm 0.4447,0.4447,0.3802,90,90,120 AlB2 family - 5.87 X 16219
Al-Ga-Nd NdAl1.75 Ga0.25 MgCu2,cF24,227 Fd-3m 0.7986,0.7986,0.7986,90,90,90 Friauf-Laves phase - 5.45 X 16219
Al-Ga-Nd NdAl2Ga2 CeAl2Ga2,tI10,139 I4/mmm 0.4222,0.4222,1.1081,90,90,90 - - 5.68 A 13592
Al-Ga-Ni Ni3Al0.5 Ga0.5 Cu3Au,cP4,221 Pm-3m 0.3577,0.3577,0.3577,90,90,90 close-packed structure - 8.14 X 17833
Al-Ga-P Al0.8 Ga0.2P ZnS,cF8,216 F-43m 0.5461,0.5461,0.5461,90,90,90 adamantane structure - 2.71 X 16940
Al-Ga-Pr PrAl2Ga2 CeAl2Ga2,tI10,139 I4/mmm 0.4229,0.4229,1.1152,90,90,90 - - 5.57 A 13592
Al-Ga-Pu PuAl0.5 Ga1.5 AlB2,hP3,191 P6/mmm 0.4448,0.4448,0.3629,90,90,120 AlB2 family - 9.67 X 9494
Al-Ga-Pu PuAl2Ga2 UAl4,oI20,74 Imma 0.4358,0.628,1.369,90,90,90 - - 7.75 A 9494
Al-Ga-Pu PuAl2.4 Ga0.6 ht2 PuAl3,hP24,194 P63 /mmc 0.6092,0.6092,1.4389,90,90,120 close-packed structure - 7.55 A 9494
Al-Ga-Sb Al0.05 Ga0.95 Sb ZnS,cF8,216 F-43m 0.6098,0.6098,0.6098,90,90,90 adamantane structure - 5.55 X 52809
Al-Ga-Sc ScAl0.6 Ga0.4 DyAl,oP16,57 Pbcm 0.5494,1.0674,0.5343,90,90,90 - - 3.77 X 20021
Al-Ga-Sc ScAl0.66 Ga1.34 KHg2,oI12,74 Imma 0.4143,0.6618,0.7922,90,90,90 AlB2 family - 4.78 A 20021
Al-Ga-Sc ScAl1.25 Ga0.75 Hg2U,hP3,191 P6/mmm 0.4362,0.4362,0.323,90,90,120 AlB2 family - 4.09 X 20021
Al-Ga-Sc ScAl1.55 Ga0.45 MgCu2,cF24,227 Fd-3m 0.7552,0.7552,0.7552,90,90,90 Friauf-Laves phase - 3.64 X 20021
Al-Ga-Sc Sc3Al0.65 Ga1.35 Gd3Ga2,tI80,140 I4/mcm 1.0781,1.0781,1.4131,90,90,90 - - 3.99 A 20021
Al-Ga-Sc Sc5Al1.08 Ga2.92 *,t**,* - 1.0395,1.0395,1.5305,90,90,90 - - - N 20021
Al-Ga-Sc Sc5Al1.6 Ga1.4 Mn5Si3,hP16,193 P63 /mcm 0.8162,0.8162,0.5923,90,90,120 - - 3.55 A 20021
Al-Ga-Sm SmAl0.3 Ga1.7 AlB2,hP3,191 P6/mmm 0.42589,0.42589,0.41736,90,90,120 AlB2 family - 7.02 X 55918
Al-Ga-Sm SmAl1.85 Ga0.15 MgCu2,cF24,227 Fd-3m 0.79329,0.79329,0.79329,90,90,90 Friauf-Laves phase - 5.61 X 55918
Al-Ga-Sr SrAl0.3Ga1.7 AlB2,hP3,191 P6/mmm 0.4358,0.4358,0.4751,90,90,120 AlB2 family gray silver 4.55 X 49752
Al-Ga-Sr SrAl1.3 Ga0.7 KHg2,oI12,74 Imma 0.4757,0.7557,0.7882,90,90,90 AlB2 family - 4.02 A 20238
Al-Ga-Sr SrAl2Ga2 BaAl4,tI10,139 I4/mmm 0.4455,0.4455,1.098,90,90,90 - - 4.28 A 4888
Al-Ga-Sr Sr3Al2.62 Ga2.38 Hf3Ni2Si3,oS32,63 Cmcm 0.46839,1.1325,1.57,90,90,90 - gray silver 3.98 X 47577
Al-Ga-Tb TbAlGa AlB2,hP3,191 P6/mmm 0.4434,0.4434,0.3637,90,90,120 AlB2 family - 6.85 X 4342
Al-Ga-Ti TiAl0.6 Ga0.4 CuAu,tP2,123 P4/mmm 0.28207,0.28207,0.4031,90,90,90 close-packed structure - 4.76 X 34400
Al-Ga-Ti Ti5Al0.8 Ga3.2 Ti5Ga4,hP18,193 P63 /mcm 0.7868,0.7868,0.5339,90,90,120 AlB2 family - 5.62 A 34400
Al-Ga-Tm TmAlGa hex AlB2,hP3,191 P6/mmm 0.4427,0.4427,0.3476,90,90,120 AlB2 family - 7.48 X 4342
Al-Ga-Tm TmAl0.5 Ga1.5 orth KHg2,oI12,74 Imma 0.42375,0.69047,0.80556,90,90,90 AlB2 family - 8.09 A 23511
Al-Ga-Tm TmAl1.76 Ga0.24 MgCu2,cF24,227 Fd-3m 0.77585,0.77585,0.77585,90,90,90 Friauf-Laves phase - 6.63 X 22379
Al-Ga-V V0.75 Al0.01 Ga0.24 Cu,cF4,225 Fm-3m 0.4124,0.4124,0.4124,90,90,90 close-packed structure - 5.23 X 4225
Al-Ga-V V0.75 Al0.225 Ga0.025 W,cI2,229 Im-3m 0.3044,0.3044,0.3044,90,90,90 b.c.c. family - 5.42 X 6919
Al-Ga-V V3 Al0.04 Ga0.96 rt Cr3Si,cP8,223 Pm-3n 0.48,0.48,0.48,90,90,90 Frank-Kasper phase - 6.63 X 4225
Al-Ga-Y YAl0.40 Ga2.60 Mg3Cd,hP8,194 P63 /mmc 0.6273,0.6273,0.452,90,90,120 close-packed structure - 6.06 X 41619
Al-Ga-Y YAl0.90 Ga1.10 AlB2,hP3,191 P6/mmm 0.444,0.444,0.3624,90,90,120 AlB2 family - 5.10 X 41619
Al-Ga-Y YAl2.80 Ga1.20 ht YAl2.80 Ga1.20 ,oP115,16 P222 0.9726,1.251,1.693,90,90,90 - - 4.80 X 41619
Al-Ga-Y Y12Al19.8 Ga25.2 Y12Al19.8 Ga25.2 ,oP57,16 P222 0.8368,0.975,1.2557,90,90,90 - - 5.44 X 41619
Al-Ga-Y Y15.7 Al39.2 Ga21.1 Y15.7 Al39.2 Ga21.1,oP76,16 P222 0.8343,0.9785,1.688,90,90,90 - - 4.73 X 41619
Al-Ga-Y Y3.8 Al6.7 Ga8.5 ht Y3.8 Al6.7 Ga8.5 ,oP19,16 P222 0.4185,0.8403,0.9754,90,90,90 - - 5.38 X 41619
Al-Ga-Yb YbAlGa CaIn2,hP6,194 P63 /mmc 0.4512,0.4512,0.7146,90,90,120 AlB2 family - 7.11 A 20238
Al-Ga-Yb YbAl1.5 Ga0.5 MgCu2,cF24,227 Fd-3m 0.7868,0.7868,0.7868,90,90,90 Friauf-Laves phase - 6.77 X 18090
Al-Ga-Yb YbAl2Ga2 CeAl2Ga2,tI10,139 I4/mmm 0.4258,0.4258,1.0984,90,90,90 - - 6.11 A 13592
Al-Ga-Zr ZrAl0.3 Ga0.7 ThIn,oP24,57 Pbcm 0.9355,0.8644,0.5696,90,90,90 - - 6.41 X 20677
Al-Ga-Zr Zr3Al0.65 Ga1.35 U3Si2,tP10,127 P4/mbm 0.745,0.745,0.36,90,90,90 - - 6.40 A 20677
Al-Ga-Zr Zr3Al0.85 Ga1.15 Zr3Al2,tP20,136 P42 /mnm 0.7544,0.7544,0.7047,90,90,90 - - 6.24 A 20677
Al-Ga-Zr Zr5Al0.88 Ga2.12 ht W5Si3,tI32,140 I4/mcm 1.0918,1.0918,0.5377,90,90,90 - - 6.50 A 20677
Al-Ga-Zr Zr5Al1.35 Ga2.65 ht Ti5Ga4,hP18,193 P63 /mcm 0.838,0.838,0.572,90,90,120 AlB2 family - 6.47 A 20677
Al-Gd-Ge GdAlGe ht LaPtSi,tI12,109 I41md 0.41521,0.41521,1.4415,90,90,90 - - 6.86 A 23178
Al-Gd-Ge GdAlGe rt YAlGe,oS12,63 Cmcm 0.4063,1.0513,0.5801,90,90,90 AlB2 family - 6.88 A 23178
Al-Gd-Ge GdAl0.22 Ge1.33 AlB2,hP3,191 P6/mmm 0.40176,0.40176,0.41685,90,90,120 AlB2 family - 7.40 X 48325
Al-Gd-Ge GdAl0.35 Ge2 CeNiSi2,oS16,63 Cmcm 0.40874,1.61499,0.39372,90,90,90 - - 7.97 X 51212
Al-Gd-Ge GdAl1.75 Ge0.25 MgCu2,cF24,227 Fd-3m 0.786,0.786,0.786,90,90,90 Friauf-Laves phase - 6.09 X 3532
Al-Gd-Ge GdAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4253,0.4253,0.6716,90,90,120 - - 5.63 X 40777
Al-Gd-Ge GdAl2.90 Ge0.10 Mg3Cd,hP8,194 P63 /mmc 0.63115,0.63115,0.46052,90,90,120 close-packed structure gray silver 5.07 X 38782
Al-Gd-Ge Gd11Al2Ge 8 Sc11Al2Ge8,tI84,139 I4/mmm 1.09924,1.09924,1.63026,90,90,90 - - 7.97 A 58529
Al-Gd-Ge Gd2AlGe2 Ca2Ir2Si,mS20,15 C12/c1 1.0126,0.56837,0.77683,90,104.729,90 - - 7.48 X 40868
Al-Gd-Ge Gd2AlGe6 La2AlGe6,mS36,12 C12/m1 0.8041,0.8351,1.0546,90,100.81,90 - - 7.42 A 24386
Al-Gd-Ge Gd2Al3Ge 4 Ba2Cd3Bi4 ,oS36,64 Cmce 0.5948,1.4875,0.7762,90,90,90 - - 6.63 A 24387
Al-Gd-Ge Gd2Al3.05 Ge 3 Tb2Al3.15 Ge3,hR234,167 R-3c 0.72764,0.72764,8.8587,90,90,120 - - 6.03 X 53400
Al-Gd-Ho Gd0.03 Ho0.97 Al3 rt HoAl3,hR60,166 R-3m 0.6059,0.6059,3.582,90,90,120 close-packed structure - 5.37 A 5214
Al-Gd-Ho Gd0.23 Ho0.77 Al3 TiNi3,hP16,194 P63 /mmc 0.6088,0.6088,0.9529,90,90,120 close-packed structure - 5.30 A 5214
Al-Gd-Ho Gd0.4 Ho0.6 Al2 MgCu2,cF24,227 Fd-3m 0.785,0.785,0.785,90,90,90 Friauf-Laves phase - 5.93 X 4155
Al-Gd-Ho Gd0.54 Ho0.46 Al3 BaPb3,hR36,166 R-3m 0.6178,0.6178,2.117,90,90,120 close-packed structure - 5.16 A 5214
Al-Gd-Ho Gd0.65 Ho0.35 Al3 Mg3Cd,hP8,194 P63 /mmc 0.6304,0.6304,0.4603,90,90,120 close-packed structure - 5.05 A 5214
Handbook of Inorganic Substances – Edition 2015 : Data 221

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Gd-Ir GdIrAl TiNiSi,oP12,62 Pnma 0.69337,0.42177,0.7934,90,90,90 AlB2 family - 10.78 A 30303


Al-Gd-Ir Gd2 Ir3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3007,0.7593,0.9466,90,90,90 - - 8.06 X 28215
Al-Gd-Ir Gd4 IrAl Gd4RhIn,cF96,216 F-43m 1.3597,1.3597,1.3597,90,90,90 - gray dark 8.97 A 57034
Al-Gd-La LaGdAl TiNiSi,oP12,62 Pnma 0.673,0.524,0.968,90,90,90 AlB2 family - 6.29 A 19492
Al-Gd-La La0.5 Gd0.5 Al2 MgCu2,cF24,227 Fd-3m 0.802,0.802,0.802,90,90,90 Friauf-Laves phase - 5.20 X 15303
Al-Gd-La La2.82 Gd0.18 Al Mg3 Cd,hP8,194 P63/mmc 0.726,0.726,0.553,90,90,120 close-packed structure - 5.88 A 4781
Al-Gd-Lu Gd0.13 Lu0.87 Al3 Cu3Au,cP4,221 Pm-3m 0.4202,0.4202,0.4202,90,90,90 close-packed structure - 5.68 X 7867
Al-Gd-Lu Gd0.5 Lu0.5 Al2 MgCu2,cF24,227 Fd-3m 0.783,0.783,0.783,90,90,90 Friauf-Laves phase - 6.09 X 15303
Al-Gd-Lu Gd0.5 Lu0.5 Al3 TiNi3,hP16,194 P63/mmc 0.607,0.607,0.9508,90,90,120 close-packed structure - 5.41 A 7867
Al-Gd-Lu Gd0.57 Lu0.43 Al3 BaPb3,hR36,166 R-3m 0.6169,0.6169,2.1144,90,90,120 close-packed structure - 5.27 A 7867
Al-Gd-Lu Gd0.77 Lu0.23 Al3 Mg3 Cd,hP8,194 P63/mmc 0.6293,0.6293,0.4603,90,90,120 close-packed structure - 5.10 A 7867
Al-Gd-Mg MgGdAl MgCu2,cF24,227 Fd-3m 0.8224,0.8224,0.8224,90,90,90 Friauf-Laves phase - 4.98 X 37417
Al-Gd-Mg Mg0.5 Gd0.5 Al2 MgZn2,hP12,194 P63/mmc 0.552,0.552,0.888,90,90,120 Friauf-Laves phase - 4.10 A 31947
Al-Gd-Mg Mg29 Gd4Al3 mon Mg29 Gd4Al3,mS144,12 C12/m1 1.119,1.938,1.624,90,103.27,90 - - 2.74 X 55650
Al-Gd-Mg Mg29 Gd4Al3 trig Mg29 Gd4Al3,hP216,151 P3112 1.119,1.119,4.743,90,90,120 - - 2.74 X 55650
Al-Gd-Mn GdMn0.2 Al1.8 MgCu2,cF24,227 Fd-3m 0.78992,0.78992,0.78992,90,90,90 Friauf-Laves phase - 5.84 X 11594
Al-Gd-Mn GdMn2.21 Al9.79 CaCr2Al10,tP52,129 P4/nmm 1.2773,1.2773,0.5128,90,90,90 CaCu5-Zr4Al3 gray silver 4.31 X 58961
Al-Gd-Mn GdMn3.76 Al8.24 CeMn4Al8,tI26,139 I4/mmm 0.8878,0.8878,0.5119,90,90,90 CaCu5-Zr4Al3 - 4.82 X 58961
Al-Gd-Mn Gd2 Mn10.3 Al6.7 Zn17 Th2,hR57,166 R-3m 0.89145,0.89145,1.30415,90,90,120 CaCu5-Zr4Al3 - 5.89 X 38955
Al-Gd-Mn Gd2 Mn13Al4 Th2Ni17,hP38,194 P63/mmc 0.8778,0.8778,0.8627,90,90,120 CaCu5-Zr4Al3 - 6.56 A 39406
Al-Gd-Mo GdMo 2Al4 YbMo 2Al4,tI14,139 I4/mmm 0.678,0.678,0.5331,90,90,90 - - 6.19 A 9904
Al-Gd-Mo Gd6 Mo4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.10189,1.10189,1.77799,90,90,120 - - 4.42 X 59675
Al-Gd-Nb Gd6 Nb4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1104,1.1104,1.7917,90,90,120 - - 4.30 A 30591
Al-Gd-Nd Nd0.5 Gd0.5 Al2 MgCu2,cF24,227 Fd-3m 0.795,0.795,0.795,90,90,90 Friauf-Laves phase - 5.41 X 1725
Al-Gd-Ni GdNiAl hp MgZn2,hP12,194 P63/mmc 0.5405,0.5405,0.8643,90,90,120 Friauf-Laves phase - 7.38 A 20055
Al-Gd-Ni GdNiAl ZrNiAl,hP9,189 P-62m 0.70254,0.70254,0.39181,90,90,120 Fe2P family - 7.23 X 40239
Al-Gd-Ni GdNiAl2 MgCuAl2,oS16,63 Cmcm 0.408,1.014,0.693,90,90,90 - - 6.25 A 11484
Al-Gd-Ni GdNiAl3 YNiAl3,oP20,62 Pnma 0.8164,0.4068,1.0666,90,90,90 - - 5.57 A 53946
Al-Gd-Ni GdNiAl4 YNiAl4,oS24,63 Cmcm 0.40863,1.552,0.6612,90,90,90 - - 5.13 A 26335
Al-Gd-Ni GdNi0.4 Al1.6 rt MgCu2,cF24,227 Fd-3m 0.779,0.779,0.779,90,90,90 Friauf-Laves phase - 6.29 X 18165
Al-Gd-Ni GdNi2.5 Al2.5 rt YNi2Al3,hP18,191 P6/mmm 0.8908,0.8908,0.4104,90,90,120 - - 6.56 X 30203
Al-Gd-Ni GdNi3Al2 PrNi2Al3,hP6,191 P6/mmm 0.5067,0.5067,0.4083,90,90,120 - - 7.08 X 30203
Al-Gd-Ni GdNi3Al9 ErNi3Al9,hR78,155 R32 0.73006,0.73006,2.7478,90,90,120 - - 4.53 X 27128
Al-Gd-Ni Gd0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.42088,0.42088,0.91494,90,90,120 - - 4.55 A 59682
Al-Gd-Ni Gd2 Ni2Al W2CoB2,oI10,71 Immm 0.4186,0.5408,0.8416,90,90,90 - - 8.00 X 11393
Al-Gd-Ni Gd2 Ni8Al9 Th2Ni17,hP38,194 P63/mmc 0.8541,0.8541,0.8654,90,90,120 CaCu5-Zr4Al3 - 6.24 A 12441
Al-Gd-Ni Gd3 Ni5Al19 Gd3Ni5Al19,oS108,63 Cmcm 0.40893,1.5993,2.7092,90,90,90 - - 4.79 X 26335
Al-Gd-Ni Gd3 Ni6Al2 Ce3Ni6Si2,cI44,229 Im-3m 0.8974,0.8974,0.8974,90,90,90 - - 8.07 X 26480
Al-Gd-Ni Gd3 Ni7Al14 Gd3Ni7Al14,hP72,189 P-62m 1.7966,1.7966,0.40448,90,90,120 - - 5.55 X 54193
Al-Gd-Ni Gd3 Ni8Al Ce3Co8Si,hP24,194 P63/mmc 0.5076,0.5076,1.623,90,90,120 Laves-CaCu5 - 8.88 X 11393
Al-Gd-Ni Gd4 Ni6Al23 Y4Ni6Al23,mS66,12 C12/m1 1.5856,0.4078,1.8286,90,113.01,90 - - 4.89 X 26879
Al-Gd-O GdAlO3 hex YAlO3,hP10,194 P63/mmc 0.373,0.373,1.051,90,90,120 - - 6.09 A 1881
Al-Gd-O GdAlO3 orth GdFeO3,oP20,62 Pnma 0.53049,0.74485,0.52537,90,90,90 perovskite family colorless 7.43 X 42571
Al-Gd-O GdAl11O18 *,hP*,* - 0.94758,0.94758,0.6895,90,90,120 - pink - N 18489
Al-Gd-O Gd3 Al5O12 Y3 Al5O12,cI160,230 Ia-3d 1.2113,1.2113,1.2113,90,90,90 garnet family colorless 5.97 X 2506
Al-Gd-O Gd4 Al2O9 rt Eu4Al2O9,mP60,14 P121/c1 0.7563,1.0679,1.1246,90,109.2,90 - - 6.40 A 49016
Al-Gd-Os Gd3 Os4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.8822,0.8822,0.9527,90,90,120 - gray dark 8.05 X 40923
Al-Gd-Os Gd3.5 Os6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63/mcm 1.3025,1.3025,0.9043,90,90,120 - gray silver 6.29 A 42976
Al-Gd-Pd GdPdAl lt ZrNiAl,hP9,189 P-62m 0.71992,0.71992,0.40398,90,90,120 Fe2P family - 7.98 X 41629
Al-Gd-Pd GdPdAl rt TiNiSi,oP12,62 Pnma 0.6975,0.4446,0.7754,90,90,90 AlB2 family - 8.03 A 17109
Al-Gd-Pd GdPd2Al3 PrNi2Al3,hP6,191 P6/mmm 0.53924,0.53924,0.41941,90,90,120 - - 7.09 X 29469
Al-Gd-Pd Gd2 Pd3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3166,0.7665,0.9434,90,90,90 - - 6.12 A 43418
Al-Gd-Pd Gd4 Pd9Al24 Er4Pt9Al24,aP37,2 P-1 0.7534,0.7534,1.3127,84.5,78.97,60. - - 5.86 A 36571
Al-Gd-Pr Pr0.5 Gd0.5Al2 MgCu2,cF24,227 Fd-3m 0.7967,0.7967,0.7967,90,90,90 Friauf-Laves phase - 5.33 X 1725
Al-Gd-Pt GdPtAl TiNiSi,oP12,62 Pnma 0.6963,0.4415,0.7713,90,90,90 AlB2 family - 10.63 A 17109
Al-Gd-Pt Gd0.67Pt2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63/mmc 0.42907,0.42907,1.6388,90,90,120 - gray silver 8.01 X 40063
Al-Gd-Pt Gd1.33Pt3Al8 Gd1.33Pt3Al8,hR51,166 R-3m 0.4309,0.4309,3.854,90,90,120 - gray silver 8.12 X 50105
Al-Gd-Pt Gd4 Pt9Al24 Er4Pt9Al24,aP37,2 P-1 0.7496,0.7496,1.3109,84.53,79.01,60. - - 8.04 A 36571
Al-Gd-Re Gd2 Re4Al20 Tb(Tb0.87 Al0.13 )Re4Al20,oS104,63 Cmcm 0.93014,1.0321,1.8048,90,90,90 - gray dark 6.13 A 53203
Al-Gd-Re Gd3.62 Re6Al30.85 Y3.64 Re6Al30.69 ,hP88,193 P63/mcm 1.3132,1.3132,0.9165,90,90,120 - - 6.11 X 33271
Al-Gd-Rh GdRhAl lt TiNiSi,oP12,62 Pnma 0.69204,0.41928,0.79911,90,90,90 AlB2 family - 8.23 A 33246
Al-Gd-Rh Gd2 Rh3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3274,0.7664,0.939,90,90,90 - - 6.02 A 43418
Al-Gd-Rh Gd4 Rh1.09 Al0.91 Gd4RhIn,cF96,216 F-43m 1.3572,1.3572,1.3572,90,90,90 - - 8.14 X 57034
Al-Gd-Ru GdRu2Al10 YbFe 2Al10,oS52,63 Cmcm 0.9093,1.0218,0.9137,90,90,90 - - 4.92 X 58634
Al-Gd-Ru Gd3 Ru4.13 Al11.87 Gd3Ru4Al12,hP38,194 P63/mmc 0.88142,0.88142,0.95692,90,90,120 - gray dark 6.24 X 27129
Al-Gd-Ru Gd4 RuAl Gd4RhIn,cF96,216 F-43m 1.3559,1.3559,1.3559,90,90,90 - gray dark 8.07 A 57034
Al-Gd-S Gd3 Al1.67 S7 Ce3Al1.67 S7,hP24,173 P63 0.973,0.973,0.606,90,90,120 - gray 4.95 A 5866
Al-Gd-Sc Sc0.02 Gd0.98 Al3 Mg3 Cd,hP8,194 P63/mmc 0.6321,0.6321,0.4598,90,90,120 close-packed structure - 4.93 A 5214
Al-Gd-Sc Sc0.85 Gd0.15 Al3 Cu3Au,cP4,221 Pm-3m 0.4118,0.4118,0.4118,90,90,90 close-packed structure - 3.39 X 5214
Al-Gd-Se Gd3 Al1.67 Se7 Ce3Al1.67 S7,hP24,173 P63 1.005,1.005,0.619,90,90,120 - - 6.56 A 4521
Al-Gd-Si GdAl0.06 Si0.94 FeB-b,oP8,62 Pnma 0.7985,0.38599,0.5747,90,90,90 CrB(TlI)-FeB gray 6.95 X 56179
Al-Gd-Si GdAl0.2 Si0.8 TlI,oS8,63 Cmcm 0.43222,1.06998,0.38886,90,90,90 CrB(TlI)-FeB - 6.84 X 56179
Al-Gd-Si GdAl0.3 Si1.7 rt GdSi1.4 ,oI12,74 Imma 0.4032,0.4093,1.35,90,90,90 - - 6.35 A 14670
Al-Gd-Si GdAl0.98 Si1.02 ThSi2,tI12,141 I41/amd 0.41255,0.41255,1.4432,90,90,90 - - 5.74 X 45163
Al-Gd-Si GdAl1.75 Si0.25 MgCu2,cF24,227 Fd-3m 0.786,0.786,0.786,90,90,90 Friauf-Laves phase - 5.79 X 3532
Al-Gd-Si GdAl2Si2 Ce2SO2,hP5,164 P-3m1 0.4194,0.4194,0.6651,90,90,120 - gray dark 4.38 X 15758
Al-Gd-Si Gd6 Al3Si Tb6Al3Si,tI80,140 I4/mcm 1.167,1.167,1.516,90,90,90 - - 6.77 A 18465
Al-Gd-Ta Gd6 Ta4 Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.11047,1.11047,1.7885,90,90,120 - gray silver 4.92 X 41207
222 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Gd-Tb Gd0.27 Tb0.73 Al3 BaPb3,hR36,166 R-3m 0.6194,0.6194,2.117,90,90,120 close-packed structure - 5.09 A 5214
Al-Gd-Tb Gd0.33 Tb0.67 Al3 Mg3Cd,hP8,194 P63 /mmc 0.6298,0.6298,0.4608,90,90,120 close-packed structure - 5.02 A 5214
Al-Gd-Tb Gd0.4 Tb0.6 Al2 MgCu2,cF24,227 Fd-3m 0.788,0.788,0.788,90,90,90 Friauf-Laves phase - 5.76 X 4155
Al-Gd-Ti GdTi2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4684,1.4684,1.4684,90,90,90 - - 3.33 A 30512
Al-Gd-Ti Gd6Ti4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1072,1.1072,1.7942,90,90,120 - - 4.00 A 30591
Al-Gd-Tm Gd0.08 Tm0.92 Al3 Cu3Au,cP4,221 Pm-3m 0.4207,0.4207,0.4207,90,90,90 close-packed structure - 5.55 X 7867
Al-Gd-Tm Gd0.16Tm0.84 Al3 HoAl3,hR60,166 R-3m 0.6032,0.6032,3.575,90,90,120 close-packed structure - 5.48 A 7867
Al-Gd-Tm Gd0.46 Tm0.54Al3 TiNi3,hP16,194 P63 /mmc 0.6081,0.6081,0.9522,90,90,120 close-packed structure - 5.33 A 7867
Al-Gd-Tm Gd0.5 Tm0.5 Al3 BaPb3,hR36,166 R-3m 0.6172,0.6172,2.114,90,90,120 close-packed structure - 5.23 A 7867
Al-Gd-Tm Gd0.75 Tm0.25 Al3 Mg3Cd,hP8,194 P63 /mmc 0.6302,0.6302,0.4597,90,90,120 close-packed structure - 5.06 A 7867
Al-Gd-U U0.5 Gd0.5 Al2 MgCu2,cF24,227 Fd-3m 0.7835,0.7835,0.7835,90,90,90 Friauf-Laves phase - 6.95 X 25455
Al-Gd-V GdV2 Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.45385,1.45385,1.45385,90,90,90 - - 3.45 X 48675
Al-Gd-V Gd6V4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0984,1.0984,1.7795,90,90,120 - - 4.12 A 30591
Al-Gd-W Gd6W4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.10243,1.10243,1.77782,90,90,120 - - 5.04 X 59675
Al-Gd-Y Y0.5 Gd0.5 Al2 MgCu2,cF24,227 Fd-3m 0.788,0.788,0.788,90,90,90 Friauf-Laves phase - 4.81 X 15303
Al-Gd-Y Y0.88 Gd0.12 Al3 Mg3Cd,hP8,194 P63 /mmc 0.6259,0.6259,0.4605,90,90,120 close-packed structure - 3.79 A 5214
Al-Gd-Y Y0.95 Gd0.05 Al3 ht BaPb3,hR36,166 R-3m 0.6198,0.6198,2.113,90,90,120 close-packed structure - 3.68 A 5214
Al-Gd-Zn ZnGdAl CaIn2,hP6,194 P63 /mmc 0.4514,0.4514,0.7199,90,90,120 AlB2 family - 6.53 X 24841
Al-Gd-Zn Zn4.7 Gd3Al6.3 La3Al11,oI28,71 Immm 0.42523,0.9988,1.2541,90,90,90 - - 5.92 X 53135
Al-Gd-Zr Gd0.05 Zr0.95 Al2 MgZn2,hP12,194 P63 /mmc 0.5303,0.5303,0.8768,90,90,120 Friauf-Laves phase - 4.62 A 23649
Al-Gd-Zr Gd0.8 Zr0.2 Al2 rt MgCu2,cF24,227 Fd-3m 0.7883,0.7883,0.7883,90,90,90 Friauf-Laves phase - 5.37 X 23649
Al-Ge-Hf HfAl0.33 Ge 1.67 ZrSi2,oS12,63 Cmcm 0.37935,1.4879,0.37558,90,90,90 close-packed structure - 9.67 X 23577
Al-Ge-Ho HoAlGe YAlGe,oS12,63 Cmcm 0.4031,1.0357,0.5729,90,90,90 AlB2 family - 7.35 A 23178
Al-Ge-Ho HoAl0.15 Ge1.85 ZrSi2,oS12,63 Cmcm 0.40767,1.6119,0.39307,90,90,90 close-packed structure - 7.80 A 47548
Al-Ge-Ho HoAl0.34 Ge2 CeNiSi2,oS16,63 Cmcm 0.40905,1.61575,0.39395,90,90,90 - - 8.15 X 51097
Al-Ge-Ho HoAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4196,0.4196,0.6668,90,90,120 - - 5.95 A 5215
Al-Ge-Ho HoAl2.8 Ge 0.2 BaPb3,hR36,166 R-3m 0.61579,0.61579,2.1062,90,90,120 close-packed structure gray silver 5.51 X 38782
Al-Ge-Ho Ho11Al2Ge 8 Sc11Al2Ge8,tI84,139 I4/mmm 1.08536,1.08536,1.61136,90,90,90 - - 8.57 A 58529
Al-Ge-Ho Ho2AlGe3 Y2 AlGe3,oP24,62 Pnma 0.6753,0.4158,1.758,90,90,90 - gray steel 7.73 A 32470
Al-Ge-Ho Ho2Al3Ge4 Ba2Cd3Bi4 ,oS36,64 Cmce 0.5865,1.4765,0.7657,90,90,90 - - 7.02 A 24387
Al-Ge-K K4Al11.5 Ge 11.5 Ge19P4I4,cP54,218 P-43n 1.0804,1.0804,1.0804,90,90,90 clathrate blue gray 3.43 X 11105
Al-Ge-K K4Al4Ge19 Na4Si23,cP54,223 Pm-3n 1.0785,1.0785,1.0785,90,90,90 clathrate gray 4.35 X 35331
Al-Ge-La LaAlGe LaPtSi,tI12,109 I41md 0.4336,0.4336,1.4828,90,90,90 - - 5.68 X 24656
Al-Ge-La LaAl0.15 Ge 0.85 FeB-b,oP8,62 Pnma 0.8454,0.41408,0.61408,90,90,90 CrB(TlI)-FeB gray silver 6.32 X 57496
Al-Ge-La LaAl0.3 Ge1.7 rt GdSi1.4 ,oI12,74 Imma 0.435,0.448,1.419,90,90,90 - - 6.50 A 5286
Al-Ge-La LaAl0.5 Ge1.5 *,tI*,* - 0.4403,0.4403,1.46,90,90,90 - - - N 24656
Al-Ge-La LaAl0.54 Ge 0.46 TlI,oS8,63 Cmcm 0.4498,1.1784,0.42102,90,90,90 CrB(TlI)-FeB gray silver 5.56 X 57496
Al-Ge-La LaAl1.5 Ge0.5 AlB2,hP3,191 P6/mmm 0.4361,0.4361,0.4397,90,90,120 AlB2 family - 4.95 X 24656
Al-Ge-La LaAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4297,0.4297,0.7013,90,90,120 - - 5.01 X 40777
Al-Ge-La La2Al1.6 Ge 5.4 La2AlGe6,mS36,12 C12/m1 0.8373,0.8833,1.0887,90,101.34,90 - - 6.00 X 24386
Al-Ge-La La2Al2Ge Pr2Al(Al0.5 Ge0.5 )Ge,oS20,63 Cmcm 0.41669,2.7197,0.45046,90,90,90 - gray silver 5.26 X 57496
Al-Ge-La La2Al3Ge 4 Ba2Cd3Bi4 ,oS36,64 Cmce 0.6146,1.5194,0.8037,90,90,90 - - 5.74 X 24387
Al-Ge-Li LiAlGe cub2 CaF2,cF12,225 Fm-3m 0.6137,0.6137,0.6137,90,90,90 fluorite family gray dark 3.06 X 44205
Al-Ge-Li LiAlGe MgAgAs,cF12,216 F-43m 0.59784,0.59784,0.59784,90,90,90 - gray dark 3.31 X 44205
Al-Ge-Li LiAl0.938 Ge0.066 NaTl,cF16,227 Fd-3m 0.63567,0.63567,0.63567,90,90,90 b.c.c. family - 1.92 X 14500
Al-Ge-Li LiAl2Ge Cu2MnAl,cF16,225 Fm-3m 0.5998,0.5998,0.5998,90,90,90 b.c.c. family - 4.11 X 25960
Al-Ge-Li Li2AlGe Li2AgSb,cF16,216 F-43m 0.5975,0.5975,0.5975,90,90,90 b.c.c. family - 3.53 X 25960
Al-Ge-Li Li4AlGe1.75 Li4AlGe1.75 ,tI32,141 I41/amd 0.6193,0.6193,1.2267,90,90,90 - gray dark 2.57 X 41051
Al-Ge-Lu LuAlGe YAlGe,oS12,63 Cmcm 0.3999,1.0227,0.5659,90,90,90 AlB2 family - 7.88 A 23178
Al-Ge-Lu LuAl0.15 Ge 1.85 ZrSi2,oS12,63 Cmcm 0.40172,1.5712,0.3882,90,90,90 close-packed structure - 8.49 A 47548
Al-Ge-Lu LuAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.416,0.416,0.6615,90,90,120 - - 6.27 X 40777
Al-Ge-Mg MgAl2Ge 2 Ce2SO2,hP5,164 P-3m1 0.41169,0.41169,0.67873,90,90,120 - - 3.72 X 57900
Al-Ge-Mn MnAlGe MnAlGe,tP6,129 P4/nmm 0.3914,0.3914,0.5933,90,90,90 - - 5.65 X 4683
Al-Ge-Mn Mn0.370 Al0.462 Ge0.168 (Cu0.074 Cr0.172 Fe0.1 ...,oP156,62 Pnma 1.4516,1.2484,1.2405,90,90,90 - black 5.18 X 49714
Al-Ge-Mn Mn14Al56Ge 3 Mn14Al56Ge3,hP73,147 P-3 1.1098,1.1098,1.035,90,90,120 - - 3.76 X 43059
Al-Ge-Mo MoAlGe CrSi2,hP9,180 P6222 0.4835,0.4835,0.6724,90,90,120 - - 7.15 X 12351
Al-Ge-Mo MoAl1.7 Ge 0.3 TiSi2,oF24,70 Fddd 0.4893,0.8337,0.8867,90,90,90 - - 6.01 X 12351
Al-Ge-Mo Mo0.7Al3.1 Ge0.2 Cr3Si,cP8,223 Pm-3n 0.5035,0.5035,0.5035,90,90,90 Frank-Kasper phase - 4.30 X 12386
Al-Ge-Na NaAlGe PbClF,tP6,129 P4/nmm 0.4164,0.4164,0.7427,90,90,90 - gray dark 3.16 X 12884
Al-Ge-Na Na4Al9Ge 14 Ge19P4I4,cP54,218 P-43n 1.0704,1.0704,1.0704,90,90,90 clathrate blue gray 3.66 X 11105
Al-Ge-Nb Nb2.80 Al0.55 Ge0.65 Cr3Si,cP8,223 Pm-3n 0.5171,0.5171,0.5171,90,90,90 Frank-Kasper phase - 7.74 X 9885
Al-Ge-Nd NdAlGe LaPtSi,tI12,109 I41md 0.4233,0.4233,1.4638,90,90,90 - - 6.17 A 23178
Al-Ge-Nd NdAl1.5 Ge 0.5 AlB2,hP3,191 P6/mmm 0.4298,0.4298,0.421,90,90,120 AlB2 family - 5.45 X 3532
Al-Ge-Nd NdAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4269,0.4269,0.6832,90,90,120 - - 5.29 X 40777
Al-Ge-Nd Nd2AlGe6 La2AlGe6,mS36,12 C12/m1 0.822,0.8623,1.0671,90,101.05,90 - - 6.72 A 24386
Al-Ge-Nd Nd2Al1.5 Ge1.5 Pr2Al(Al0.5 Ge0.5 )Ge,oS20,63 Cmcm 0.41432,2.6132,0.43544,90,90,90 - - 6.17 A 50109
Al-Ge-Nd Nd2Al3Ge 4 Ba2Cd3Bi4 ,oS36,64 Cmce 0.6042,1.4965,0.7897,90,90,90 - - 6.14 A 24387
Al-Ge-Ni NiAl0.016 Ge0.984 FeAs,oP8,62 Pnma 0.53891,0.34381,0.58173,90,90,90 AlB2 family - 8.05 A 58183
Al-Ge-Ni NiAl0.44 Ge 1.56 CoGe2,oS24,64 Cmce 1.076,0.5715,0.5713,90,90,90 - - 6.95 X 58183
Al-Ge-Ni NiAl0.8 Ge1.2 CaF2,cF12,225 Fm-3m 0.56462,0.56462,0.56462,90,90,90 fluorite family - 6.18 X 58183
Al-Ge-Ni NiAl0.83 Ge 0.17 CsCl,cP2,221 Pm-3m 0.2889,0.2889,0.2889,90,90,90 b.c.c. family - 6.43 X 58183
Al-Ge-Ni Ni0.004 Al0.978 Ge0.018 Cu,cF4,225 Fm-3m 0.40509,0.40509,0.40509,90,90,90 close-packed structure - 2.79 X 58183
Al-Ge-Ni Ni1.004 Al2.992Ge0.004 Fe3C-b,oP16,62 Pnma 0.66167,0.73708,0.48152,90,90,90 - - 3.96 A 58183
Al-Ge-Ni Ni2Al2.3 Ge 0.7 Ni2Al3,hP5,164 P-3m1 0.40525,0.40525,0.48354,90,90,120 - - 5.56 A 58183
Al-Ge-Ni Ni3Al0.8 Ge 0.2 Cu3Au,cP4,221 Pm-3m 0.3567,0.3567,0.3567,90,90,90 close-packed structure - 7.76 X 19208
Al-Ge-Ni Ni4.2 Al19.6 Ge5.2 *,cI*,217 I-43m 1.14025,1.14025,1.14025,90,90,90 - - - N 58183
Al-Ge-O Al10Ge2O19 Al4(Al0.75 Si0.25 )8O19,oS124,36 Cmc21 0.5836,3.064,0.776,90,90,90 - - 3.44 X 24993
Al-Ge-O Al2GeO5 ht *,oP16,55 Pbam 0.764,0.778,0.2929,90,90,90 - - - N 24993
Handbook of Inorganic Substances – Edition 2015 : Data 223

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ge-O Al2GeO5 rt *,aP24,2 P-1 0.5673,0.7213,0.801,74.2,89.87,78.8 - - - N 3028


Al-Ge-O Al2[Ge 2O7] Al2[Ge2O7],mS44,15 C12/c1 0.7132,0.7741,0.9702,90,110.62,90 - - 4.12 X 19269
Al-Ge-O Al2.38 Ge0.62 O4.81 Al(Al0.7 Si0.3)2O4.8 ,oP24,55 Pbam 0.7644,0.7779,0.2925,90,90,90 - - 3.56 X 25608
Al-Ge-Pd PdAl0.84 Ge0.16 rt Al+ FeSi,cP8,198 P213 0.487,0.487,0.487,90,90,90 - - 8.09 A 923
Al-Ge-Pd Pd12 Al3Ge4 Th7S12,hP20,176 P63/m 0.9339,0.9339,0.366,90,90,120 - - 9.90 A 14776
Al-Ge-Pr PrAlGe LaPtSi,tI12,109 I41md 0.42534,0.42534,1.4641,90,90,90 - - 6.03 X 37269
Al-Ge-Pr PrAl0.15 Ge1.76 *,oS36,65 Cmmm 0.4269,3.068,0.4144,90,90,90 - - 10.01 N 55404
Al-Ge-Pr PrAl1.476 Ge0.524 AlB2 ,hP3,191 P6/mmm 0.43223,0.43223,0.42585,90,90,120 AlB2 family - 5.27 X 37269
Al-Ge-Pr PrAl1.7Ge0.3 MgCu2,cF24,227 Fd-3m 0.8027,0.8027,0.8027,90,90,90 Friauf-Laves phase - 5.36 X 37269
Al-Ge-Pr PrAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4264,0.4264,0.6896,90,90,120 - - 5.20 A 5215
Al-Ge-Pr Pr2AlGe 6 La2AlGe 6,mS36,12 C12/m1 0.8244,0.863,1.0711,90,101.09,90 - - 6.61 A 24386
Al-Ge-Pr Pr2Al1.5 Ge1.5 Pr2Al(Al0.5 Ge0.5 )Ge,oS20,63 Cmcm 0.4161,2.6261,0.4373,90,90,90 - - 5.99 X 50109
Al-Ge-Pr Pr2Al3Ge4 Ba2Cd3Bi4,oS36,64 Cmce 0.6056,1.5,0.792,90,90,90 - - 6.03 A 24387
Al-Ge-Rb Rb4Al4Ge19 Na4Si23,cP54,223 Pm-3n 1.0822,1.0822,1.0822,90,90,90 clathrate gray 4.79 X 35328
Al-Ge-Re ReAl1.25 Ge0.75 MoSi2,tI6,139 I4/mmm 0.3259,0.3259,0.8013,90,90,90 b.c.c. family - 10.71 X 10690
Al-Ge-Sc ScAlGe YAlGe,oS12,63 Cmcm 0.3934,0.9928,0.5519,90,90,90 AlB2 family - 4.45 A 23178
Al-Ge-Sc Sc11 Al2Ge8 Sc11 Al2Ge8,tI84,139 I4/mmm 1.0419,1.0419,1.4974,90,90,90 - - 4.61 X 24426
Al-Ge-Sm SmAlGe LaPtSi,tI12,109 I41md 0.41934,0.41934,1.45571,90,90,90 - - 6.49 X 43731
Al-Ge-Sm SmAl0.15 Ge1.56 GdSi1.4 ,oI12,74 Imma 0.41355,0.41734,1.40026,90,90,90 - - 7.36 X 44899
Al-Ge-Sm SmAl0.15 Ge1.76 *,oS36,65 Cmmm 0.41923,3.0351,0.40839,90,90,90 - - 10.82 N 54182
Al-Ge-Sm SmAl1.22 Ge0.78 ThSi2,tI12,141 I41/amd 0.42015,0.42015,1.4641,90,90,90 - - 6.17 A 55418
Al-Ge-Sm SmAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4233,0.4233,0.6805,90,90,120 - - 5.50 A 5215
Al-Ge-Sm SmAl2.64 Ge0.36 Mg3 Cd,hP8,194 P63/mmc 0.6318,0.6318,0.4583,90,90,120 close-packed structure gray 5.19 X 45950
Al-Ge-Sm Sm2 AlGe3 Y2 AlGe 3,oP24,62 Pnma 0.68153,0.42723,1.79491,90,90,90 - - 6.93 X 44899
Al-Ge-Sm Sm2 AlGe6 La2AlGe 6,mS36,12 C12/m1 0.8105,0.8458,1.0613,90,101.,90 - - 7.10 A 24386
Al-Ge-Sm Sm2 Al1.5 Ge1.5 Pr2Al(Al0.5 Ge0.5 )Ge,oS20,63 Cmcm 0.40988,2.5899,0.43037,90,90,90 - - 6.54 A 50109
Al-Ge-Sm Sm2 Al3Ge4 Ba2Cd3Bi4,oS36,64 Cmce 0.6007,1.4921,0.782,90,90,90 - - 6.37 A 24387
Al-Ge-Sr SrAlGe LiBaSi,hP3,187 P-6m2 0.4294,0.4294,0.4744,90,90,120 AlB2 family gray 4.10 X 51491
Al-Ge-Sr SrAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4225,0.4225,0.7448,90,90,120 - - 4.14 A 3755
Al-Ge-Sr SrAl3.75 Ge0.25 BaAl4,tI10,139 I4/mmm 0.4464,0.4464,1.1156,90,90,90 - - 3.09 A 20675
Al-Ge-Sr Sr14 Al8Ge3 Sr14Al8Ge3,hR150,148 R-3 1.19658,1.19658,4.01033,90,90,120 - gray silver 3.33 X 49731
Al-Ge-Sr Sr3Al2Ge2 Ba3Al2Ge2,oI14,71 Immm 0.422,0.486,1.921,90,90,90 - white silver3.89 X 10301
Al-Ge-Sr Sr3Al2Ge4 Tb3Co 2Ge4,mS18,12 C12/m1 1.2676,0.4162,0.8874,90,110.37,90 AlB2 family gray silver 4.59 X 49727
Al-Ge-Tb TbAlGe YAlGe,oS12,63 Cmcm 0.4048,1.0452,0.5774,90,90,90 AlB2 family - 7.03 A 39416
Al-Ge-Tb TbAl0.15 Ge1.85 ZrSi2,oS12,63 Cmcm 0.41402,1.6312,0.39657,90,90,90 close-packed structure - 7.37 X 47548
Al-Ge-Tb TbAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4238,0.4238,0.6661,90,90,120 - - 5.74 X 40777
Al-Ge-Tb TbAl2.7 Ge0.3 BaPb3,hR36,166 R-3m 0.61956,0.61956,2.1025,90,90,120 close-packed structure gray silver 5.42 X 38782
Al-Ge-Tb Tb11 Al2Ge8 Sc11 Al2Ge8,tI84,139 I4/mmm 1.09371,1.09371,1.62855,90,90,90 - - 8.12 A 58529
Al-Ge-Tb Tb2AlGe 3 Y2 AlGe 3,oP24,62 Pnma 0.67749,0.4198,1.77222,90,90,90 - - 7.41 X 44899
Al-Ge-Tb Tb2AlGe 6 La2AlGe 6,mS36,12 C12/m1 0.8008,0.8324,1.052,90,100.81,90 - - 7.53 A 39416
Al-Ge-Tb Tb2Al3.15 Ge3 Tb2Al3.15 Ge3,hR234,167 R-3c 0.72432,0.72432,8.7998,90,90,120 - - 6.19 X 44608
Al-Ge-Tb Tb2Al3.31 Ge3.69 Ba2Cd3Bi4,oS36,64 Cmce 0.59087,1.4782,0.77185,90,90,90 - - 6.65 X 40016
Al-Ge-Th ThAl0.63 Ge1.11 ThSi2,tI12,141 I41/amd 0.41928,0.41928,1.44115,90,90,90 - - 8.64 X 43087
Al-Ge-Th Th2Al0.5 Ge0.5 CuAl2,tI12,140 I4/mcm 0.746,0.746,0.604,90,90,90 - - 10.15 A 6743
Al-Ge-Tm TmAlGe YAlGe,oS12,63 Cmcm 0.4004,1.0276,0.5685,90,90,90 AlB2 family - 7.62 A 23178
Al-Ge-Tm TmAl0.15 Ge1.85 ZrSi2,oS12,63 Cmcm 0.40482,1.589,0.39036,90,90,90 close-packed structure - 8.13 A 47548
Al-Ge-Tm TmAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4179,0.4179,0.6651,90,90,120 - - 6.08 A 5215
Al-Ge-Tm Tm2 AlGe3 Y2 AlGe 3,oP24,62 Pnma 0.6706,0.4061,1.755,90,90,90 - gray steel 8.10 A 32470
Al-Ge-U UAl2.5 Ge0.5 Cu3Au,cP4,221 Pm-3m 0.421,0.421,0.421,90,90,90 close-packed structure - 7.61 X 18398
Al-Ge-U U3Al2Ge3 tet1 Tl4PbTe 3,tI32,140 I4/mcm 0.77579,0.77579,1.10357,90,90,90 - - 9.86 X 29110
Al-Ge-U U3Al2Ge3 tet2 U3Al2Ge3,tI32,79 I4 0.7758,0.7758,1.1036,90,90,90 - - 9.86 X 33465
Al-Ge-V V3 Al0.25 Ge0.75 Cr3Si,cP8,223 Pm-3n 0.48,0.48,0.48,90,90,90 Frank-Kasper phase - 6.43 X 1965
Al-Ge-W WAl0.7 Ge1.3 CrSi2,hP9,180 P6222 0.482,0.482,0.6678,90,90,120 - - 11.02 A 13682
Al-Ge-W W1.4 Al5.6 Ge W(W0.07Al0.93)6Ge,cP8,200 Pm-3 0.50293,0.50293,0.50293,90,90,90 - - 6.28 X 19547
Al-Ge-Y YAlGe YAlGe,oS12,63 Cmcm 0.40504,1.044,0.57646,90,90,90 AlB2 family - 5.14 X 23178
Al-Ge-Y YAl0.27 Ge2 CeNiSi2,oS16,63 Cmcm 0.41149,1.62979,0.39522,90,90,90 - - 6.05 X 50320
Al-Ge-Y YAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.4205,0.4205,0.6699,90,90,120 - gray 4.66 X 40777
Al-Ge-Y Y11Al2Ge8 Sc11 Al2Ge8,tI84,139 I4/mmm 1.0958,1.0958,1.62653,90,90,90 - - 5.48 A 58529
Al-Ge-Y Y2 AlGe 3 Y2 AlGe 3,oP24,62 Pnma 0.6785,0.4189,1.7676,90,90,90 - gray steel 5.59 X 32470
Al-Ge-Y Y2 Al3.05 Ge3 Tb2Al3.15 Ge3,hR234,167 R-3c 0.72383,0.72383,8.7979,90,90,120 - - 4.77 X 53400
Al-Ge-Yb YbAl2Ge2 Ce2SO2,hP5,164 P-3m1 0.41789,0.41789,0.7055,90,90,120 - - 5.79 X 38298
Al-Ge-Yb YbAl2.95 Ge0.05 Cu3Au,cP4,221 Pm-3m 0.4203,0.4203,0.4203,90,90,90 close-packed structure - 5.73 X 40424
Al-Ge-Yb Yb0.965 Al2.8 Ge0.2 Yb0.98 Al2.8 Si0.2 ,hP30,194 P63/mmc 0.6015,0.6015,1.4241,90,90,120 - - 5.74 X 40424
Al-Ge-Yb Yb17 Al8Ge19 Yb17 Al8Ge19,tP90,129 P4/nmm 1.5425,1.5425,0.78829,90,90,90 - gray silver 8.03 X 57523
Al-Ge-Yb Yb2 AlGe3 Y2 AlGe 3,oP24,62 Pnma 0.6822,0.41787,1.8139,90,90,90 - gray silver 7.59 X 57523
Al-Ge-Yb Yb7 Al5Ge8 Yb7 Al5Ge8,mS40,12 C12/m1 1.5958,0.42871,1.2611,90,95.78,90 - - 7.46 X 24348
Al-H-Li LiAlH4 ht-hp1 *,tP36,* - 0.675,0.675,0.8081,90,90,90 - - 1.03 N 10921
Al-H-Li LiAlH4 ht-hp2 *,oP24,62 Pnma 0.511,0.951,0.429,90,90,90 - - 1.21 N 10921
Al-H-Li LiAlH4 rt LiAlH4,mP24,14 P121/c1 0.4845,0.7826,0.7917,90,112.5,90 - - 0.91 X 3539
Al-H-Li LiAl2H7 *,mP*,* - 0.749,1.557,0.7775,90,108.8,90 - - - N 7264
Al-H-Li Li3AlH6 hp *,cI*,206 Ia-3 0.7368,0.7368,0.7368,90,90,90 - - - N 50119
Al-H-Li Li3AlH6 rhom Mg3 [TeO6],hR60,148 R-3 0.81238,0.81238,0.95765,90,90,120 - - 0.98 X 50119
Al-H-Mg MgAl2H8 MgAl2H8,hP11,164 P-3m1 0.51949,0.51949,0.58537,90,90,120 - - 1.05 X 44811
Al-H-Na NaAlH4 rt NaAlH4,tI24,88 I41/a 0.502,0.502,1.133,90,90,90 - gray 1.26 X 12093
Al-H-Na Na3AlH6 ht [NH4]3FeF6,cF40,225 Fm-3m 0.779,0.779,0.779,90,90,90 perovskite family - 1.43 A 3718
Al-H-Na Na3AlH6 rt Na3AlF6,mP20,14 P121/c1 0.54145,0.55402,0.9474,90,124.985,90 - - 1.45 X 46913
Al-H-O AlO[OH] böh FeO[OH],oS12,63 Cmcm 0.28678,1.22188,0.36941,90,90,90 böhmite - 3.08 X 39150
Al-H-O AlO[OH] dia AlO[OH],oP12,62 Pnma 0.939,0.2833,0.4374,90,90,90 diaspore - 3.42 X 49242
224 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-H-O AlO[OH] hp InO[OH],oP6,31 Pmn21 0.28315,0.42221,0.47128,90,90,90 - colorless 3.54 X 45994


Al-H-O Al[OH]3 bay Al[OH]3,mP16,14 P121/c1 0.4713,0.8671,0.5062,90,90.27,90 bayerite - 2.50 X 3789
Al-H-O Al[OH]3 doy Al[OH]3-b,aP8,2 P-1 0.49832,0.49997,0.51681,104.66,97.44,118.69 doyleite colorless 2.48 X 35265
Al-H-O Al[OH]3 gib Al[OH]3-b,mP32,14 P121/c1 0.8675,0.5069,1.25086,90,129.186,90 gibbsite colorless 2.43 X 49661
Al-H-O Al[OH]3 hp mon Al[OH]3-c,mP32,14 P121/c1 0.9194,0.8612,0.5013,90,90.34,90 - colorless 2.61 X 49661
Al-H-O Al[OH]3 hp orth Al[OH]3,oP32,61 Pbca 0.50521,0.94954,0.86857,90,90,90 - - 2.49 X 45089
Al-H-O Al[OH]3 nor Al[OH]3-a,aP8,2 P-1 0.498,0.5082,0.5127,70.27,86.33,61.08 nordstrandite - 2.44 X 5018
Al-H-O Al2O3[H2O]0.2 *,t**,* - 0.795,0.795,0.779,90,90,90 - - - N 1493
Al-H-O Al2O3[H2O]0.7 *,hP*,* P63 /mcm 0.963,0.963,1.344,90,90,120 - - - N 1493
Al-H-O Al5O7.5 [H2O]0.5 Al5O7[OH],hP26,186 P63 mc 0.5575,0.5575,0.8761,90,90,120 - - 3.72 X 4486
Al-H-O [H3O]Al11 O17 [H3O]Al11 O17,hP66,194 P63 /mmc 0.5614,0.5614,2.262,90,90,120 β-alumina - 3.16 X 11787
Al-H-Pd Pd2AlHx Co2Si-b,oP12,62 Pnma 0.54295,0.40605,0.77757,90,90,90 - - 9.29 F 55007
Al-H-Pd Pd3AlHx *,oP24,26 Pmc21 0.40287,1.5852,0.54174,90,90,90 - - 9.97 N 55007
Al-H-Sr SrAl2H2 SrAl2H2,hP5,164 P-3m1 0.45283,0.45283,0.47215,90,90,120 - gray dark 2.84 A 37364
Al-H-Sr SrAl2H8 *,oP6,59 Pmmn 0.43346,0.52164,0.91165,90,90,90 - - 2.41 P 58302
Al-H-Sr Sr2AlH7 Ba2AlH7,mS80,15 C12/c1 1.36439,0.9799,0.79911,90,114.921,90 - gray dark 2.87 A 40079
Al-H-Th Th2AlH3.85 Th2AlH3.85 ,tI28,140 I4/mcm 0.76324,0.76324,0.65305,90,90,90 - - 8.64 A 1985
Al-H-Ti Ti0.75 Al0.25 H0.2 rt Mg,hP2,194 P63 /mmc 0.289,0.289,0.466,90,90,120 close-packed structure - 4.22 F 11608
Al-H-Ti Ti0.75 Al0.25 H0.49 ht W,cI2,229 Im-3m 0.328,0.328,0.328,90,90,90 b.c.c. family - 4.06 F 11608
Al-H-Ti Ti0.75 Al0.25 H1.26 Cu,cF4,225 Fm-3m 0.435,0.435,0.435,90,90,90 close-packed structure - 3.55 F 11608
Al-H-Y Y3 Al2H2.2 *,tP20,136 P42 /mnm 0.82974,0.82974,0.75886,90,90,90 - - 4.11 P 52515
Al-H-Y Y3 Al2H5.5 *,oP20,58 Pnnm 0.83268,0.85043,0.75913,90,90,90 - - 4.03 P 52515
Al-H-Y Y3 Al2H6.5 *,oI80,72 Ibam 1.21332,1.22544,1.48268,90,90,90 - - 3.94 P 52515
Al-Hf-Ho Ho0.8 Hf0.2 Al3 Cu3Au,cP4,221 Pm-3m 0.42,0.42,0.42,90,90,90 close-packed structure - 5.57 X 15104
Al-Hf-Ir HfIrAl MgZn2,hP12,194 P63 /mmc 0.523,0.523,0.829,90,90,120 Friauf-Laves phase - 13.45 A 8294
Al-Hf-Ir Hf6Ir7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.2291,1.2291,1.2291,90,90,90 - - 10.19 A 3206
Al-Hf-Mn HfMnAl MgZn2,hP12,194 P63 /mmc 0.516,0.516,0.8422,90,90,120 Friauf-Laves phase - 8.91 A 8280
Al-Hf-Mo Hf0.23 Mo0.67 Al0.1 ht W,cI2,229 Im-3m 0.3201,0.3201,0.3201,90,90,90 b.c.c. family - 10.94 X 16165
Al-Hf-Mo Hf0.8 Mo2Al0.2 MgZn2,hP12,194 P63 /mmc 0.5358,0.5358,0.8667,90,90,120 Friauf-Laves phase - 10.48 A 16165
Al-Hf-Mo Hf0.95 Mo2 Al0.05 ht MgNi2,hP24,194 P63 /mmc 0.5364,0.5364,1.7401,90,90,120 Friauf-Laves phase - 11.12 A 16165
Al-Hf-Mo Hf0.95 Mo2 Al0.05 rt MgCu2,cF24,227 Fd-3m 0.7553,0.7553,0.7553,90,90,90 Friauf-Laves phase - 11.19 X 16165
Al-Hf-N Hf3AlN Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.3298,1.135,0.8842,90,90,90 - - 11.57 X 52420
Al-Hf-N Hf5Al3N ht CuHf5Sn3,hP18,193 P63 /mcm 0.8062,0.8062,0.5603,90,90,120 AlB2 family - 10.40 A 18499
Al-Hf-Ni HfNiAl ZrNiAl,hP9,189 P-62m 0.6873,0.6873,0.3437,90,90,120 Fe2P family - 9.36 A 8646
Al-Hf-Ni HfNi0.35 Al1.65 MgCu2,cF24,227 Fd-3m 0.7347,0.7347,0.7347,90,90,90 Friauf-Laves phase - 8.16 X 2957
Al-Hf-Ni HfNi0.6 Al1.4 MgZn2,hP12,194 P63 /mmc 0.518,0.518,0.841,90,90,120 Friauf-Laves phase - 8.55 A 4837
Al-Hf-Ni HfNi1.5 Al4.8 ZrNi2Al5,tI16,139 I4/mmm 0.40073,0.40073,1.42909,90,90,90 - - 5.73 X 56211
Al-Hf-Ni HfNi1.9 Al0.1 MgCu2,cF24,227 Fd-3m 0.6905,0.6905,0.6905,90,90,90 Friauf-Laves phase - 11.81 X 4837
Al-Hf-Ni HfNi2Al Cu2MnAl,cF16,225 Fm-3m 0.6069,0.6069,0.6069,90,90,90 b.c.c. family - 9.59 X 16356
Al-Hf-Ni Hf0.01 Ni3Al0.99 Cu3Au,cP4,221 Pm-3m 0.35724,0.35724,0.35724,90,90,90 close-packed structure - 7.45 X 26629
Al-Hf-Ni Hf5Ni4Al Zr5Ni4Al,tP20,84 P42 /m 0.71308,0.71308,0.65176,90,90,90 - - 11.57 X 57901
Al-Hf-Ni Hf6NiAl2 K2UF6,hP9,189 P-62m 0.783,0.783,0.329,90,90,120 Fe2P family - 11.25 A 4605
Al-Hf-Ni Hf6Ni8Al15 Mg6Cu16Si7,cF116,225 Fm-3m 1.2,1.2,1.2,90,90,90 - - 7.48 A 3198
Al-Hf-O Hf5Al3O Mn5Si3,hP16,193 P63 /mcm 0.8066,0.8066,0.5678,90,90,120 AlB2 family - 10.27 P 1207
Al-Hf-Os Hf6Os7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.2278,1.2278,1.2278,90,90,90 - - 10.17 A 3206
Al-Hf-Pd HfPd0.33 Al1.67 MgNi2,hP24,194 P63 /mmc 0.52527,0.52527,1.71126,90,90,120 Friauf-Laves phase - 8.40 X 48632
Al-Hf-Pd HfPd0.33 Al1.67 MgZn2,hP12,194 P63 /mmc 0.525,0.525,0.859,90,90,120 Friauf-Laves phase - 8.38 A 8294
Al-Hf-Pd HfPd2Al Cu2MnAl,cF16,225 Fm-3m 0.6376,0.6376,0.6376,90,90,90 b.c.c. family - 10.72 X 53178
Al-Hf-Pd Hf6Pd1.37 Al5.63 W6Fe7,hR39,166 R-3m 0.53047,0.53047,2.90416,90,90,120 Frank-Kasper phase - 9.63 X 57901
Al-Hf-Pd Hf6Pd7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.2314,1.2314,1.2314,90,90,90 - - 7.99 A 3206
Al-Hf-Pt HfPtAl HfRhSn,hP18,190 P-62c 0.7092,0.7092,0.71152,90,90,120 - - 12.88 X 50101
Al-Hf-Pt HfPt0.36 Al1.64 MgNi2,hP24,194 P63 /mmc 0.52396,0.52396,1.70717,90,90,120 Friauf-Laves phase - 9.59 X 48632
Al-Hf-Pt HfPt2Al hex Li2CuAs,hP8,194 P63 /mmc 0.425,0.425,0.857,90,90,120 - - 14.76 X 17101
Al-Hf-Pt Hf0.655Pt2Al5.065 Sc0.6 Fe2Si4.9 ,hP20,194 P63 /mmc 0.42423,0.42423,1.61521,90,90,120 - - 8.49 X 57901
Al-Hf-Pt Hf6PtAl2 K2UF6,hP9,189 P-62m 0.79054,0.79054,0.33438,90,90,120 Fe2P family - 12.11 X 50101
Al-Hf-Pt Hf6Pt1.42Al5.58 W6Fe7,hR39,166 R-3m 0.52998,0.52998,2.9065,90,90,120 Frank-Kasper phase - 10.56 X 57901
Al-Hf-Pt Hf6Pt7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.2286,1.2286,1.2286,90,90,90 - - 10.27 A 3206
Al-Hf-Rh HfRhAl MgZn2,hP12,194 P63 /mmc 0.523,0.523,0.833,90,90,120 Friauf-Laves phase - 10.38 A 8294
Al-Hf-Rh Hf6Rh7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.2278,1.2278,1.2278,90,90,90 - - 7.98 A 3206
Al-Hf-Si HfAl0.3 Si1.7 ZrSi2,oS12,63 Cmcm 0.3711,1.4456,0.3667,90,90,90 close-packed structure - 7.91 A 1732
Al-Hf-Si HfAl0.5 Si0.5 TlI,oS8,63 Cmcm 0.3714,0.989,0.3754,90,90,90 CrB(TlI)-FeB - 9.92 A 1476
Al-Hf-Si HfAl2.55 Si0.45 ht TiAl3,tI8,139 I4/mmm 0.38948,0.38948,0.8939,90,90,90 close-packed structure - 6.37 X 1732
Al-Hf-Si Hf1.95 Al0.9 Si0.15 CuAl2,tI12,140 I4/mcm 0.6587,0.6587,0.5198,90,90,90 - - 11.09 A 1477
Al-Hf-Si Hf3Al0.5 Si1.5 U3Si2,tP10,127 P4/mbm 0.7072,0.7072,0.3636,90,90,90 - - 10.80 A 1732
Al-Hf-Si Hf5Al1.5 Si1.5 Mn5Si3,hP16,193 P63 /mcm 0.7957,0.7957,0.5599,90,90,120 - - 10.55 A 1732
Al-Hf-Tb TbHf4Al3 Mn5Si3,hP16,193 P63 /mcm 0.80798,0.80798,0.57166,90,90,120 - - 9.81 X 44623
Al-Hf-Tb Tb0.65 Hf0.35 Al3 Cu3Au,cP4,221 Pm-3m 0.42,0.42,0.42,90,90,90 close-packed structure - 5.53 X 15104
Al-Hf-Tb Tb0.8 Hf0.2 Al3 HoAl3,hR60,166 R-3m 0.604,0.604,3.569,90,90,120 close-packed structure - 5.39 A 15104
Al-Hf-W Hf0.17 W0.66 Al0.17 ht W,cI2,229 Im-3m 0.3179,0.3179,0.3179,90,90,90 b.c.c. family - 16.15 X 16140
Al-Hf-W Hf0.5 W2Al0.5 rt MgCu2,cF24,227 Fd-3m 0.7576,0.7576,0.7576,90,90,90 Friauf-Laves phase - 14.37 X 16140
Al-Hf-Zn ZnHfAl2 Cu3Au,cP4,221 Pm-3m 0.403,0.403,0.403,90,90,90 close-packed structure - 7.56 X 2856
Al-Hf-Zn Zn0.5 HfAl1.5 MgCu2,cF24,227 Fd-3m 0.7414,0.7414,0.7414,90,90,90 Friauf-Laves phase - 8.20 X 14794
Al-Hg-O Hg0.91 Al11 O17.4 Ba0.75 Al11 O17.25 ,hP76,194 P63 /mmc 0.558,0.558,2.268,90,90,120 β-alumina - 4.11 A 3038
Al-Hg-S HgAl2S4 hp MgAl2O4,cF56,227 Fd-3m 1.028,1.028,1.028,90,90,90 spinel family - 4.68 A 4320
Al-Hg-S HgAl2S4 tet1 CdGa2S4,tI14,82 I-4 0.5488,0.5488,1.026,90,90,90 - black 4.11 X 710
Al-Hg-S HgAl2S4 tet2 Cu3SbS4,tI16,121 I-42m 0.55059,0.55059,1.01918,90,90,90 adamantane structure yellow 4.11 X 24238
Al-Hg-Se HgAl2Se4 hp MgAl2O4,cF56,227 Fd-3m 1.078,1.078,1.078,90,90,90 spinel family - 6.05 A 4320
Al-Hg-Se HgAl2Se4 rt CdGa2S4,tI14,82 I-4 0.57183,0.57183,1.07643,90,90,90 - orange 5.38 X 25575
Handbook of Inorganic Substances – Edition 2015 : Data 225

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Hg-Se Hg5 Al2Se8 Hg5In2Se8,cF64,216 F-43m 1.1704,1.1704,1.1704,90,90,90 - gray dark 7.00 X 39646
Al-Hg-Te HgAl2 Te4 tet1 CdGa2S4,tI14,82 I-4 0.6004,0.6004,1.211,90,90,90 - black 5.82 X 710
Al-Hg-Te HgAl2 Te4 tet2 CdIn2Se4,tP7,111 P-42m 0.6004,0.6004,0.6057,90,90,90 - - 5.82 X 710
Al-Ho-Ir HoIrAl TiNiSi,oP12,62 Pnma 0.68344,0.41878,0.78754,90,90,90 AlB2 family - 11.32 A 30303
Al-Ho-Ir Ho2 Ir3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3135,0.7525,0.9397,90,90,90 - - 8.22 A 43418
Al-Ho-Ir Ho4 IrAl Gd4RhIn,cF96,216 F-43m 1.3387,1.3387,1.3387,90,90,90 - gray dark 9.73 A 57034
Al-Ho-Lu Ho0.45 Lu0.55 Al3 Cu3Au,cP4,221 Pm-3m 0.4205,0.4205,0.4205,90,90,90 close-packed structure - 5.61 X 7867
Al-Ho-Lu Ho0.5 Lu0.5 Al3 rt HoAl3,hR60,166 R-3m 0.6042,0.6042,3.577,90,90,120 close-packed structure - 5.53 A 7867
Al-Ho-Mn HoMnAl MgCu2,cF24,227 Fd-3m 0.775,0.775,0.775,90,90,90 Friauf-Laves phase - 7.05 X 1725
Al-Ho-Mn HoMn4Al8 CeMn4Al8,tI26,139 I4/mmm 0.88503,0.88503,0.50968,90,90,90 CaCu5-Zr4Al3 - 5.00 X 23593
Al-Ho-Mn Ho6 Mn4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0777,1.0777,1.7595,90,90,120 - - 4.45 A 34455
Al-Ho-Mo Ho6 Mo4.11 Al42.89 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0968,1.0968,1.7666,90,90,120 - - 4.59 X 29673
Al-Ho-Nb Ho6 Nb4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1079,1.1079,1.7815,90,90,120 - - 4.42 A 30591
Al-Ho-Nd Nd0.5 Ho0.5 Al2 MgCu2,cF24,227 Fd-3m 0.79,0.79,0.79,90,90,90 Friauf-Laves phase - 5.62 X 4155
Al-Ho-Ni HoNiAl hp MgZn2,hP12,194 P63/mmc 0.5349,0.5349,0.8568,90,90,120 Friauf-Laves phase - 7.84 A 20055
Al-Ho-Ni HoNiAl ZrNiAl,hP9,189 P-62m 0.69896,0.69896,0.38261,90,90,120 Fe2P family - 7.71 X 38878
Al-Ho-Ni HoNiAl2 MgCuAl2,oS16,63 Cmcm 0.407,1.007,0.696,90,90,90 - - 6.46 A 7363
Al-Ho-Ni HoNiAl4 YNiAl4,oS24,63 Cmcm 0.4037,1.527,0.66,90,90,90 - - 5.41 A 7363
Al-Ho-Ni HoNi0.45Al1.55 rt MgCu2,cF24,227 Fd-3m 0.7702,0.7702,0.7702,90,90,90 Friauf-Laves phase - 6.78 X 15111
Al-Ho-Ni HoNi2Al3 YNi2Al3,hP18,191 P6/mmm 0.902,0.902,0.4052,90,90,120 - - 6.34 A 14665
Al-Ho-Ni HoNi3.94Al1.06 CaCu5,hP6,191 P6/mmm 0.49614,0.49614,0.40474,90,90,120 - - 8.18 X 44960
Al-Ho-Ni Ho0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.4198,0.4198,0.91171,90,90,120 - - 4.65 A 59682
Al-Ho-Ni Ho2 Ni2Al W2CoB2,oI10,71 Immm 0.4172,0.5382,0.8337,90,90,90 - - 8.41 X 11393
Al-Ho-Ni Ho2 Ni3Al7 *,hP*,* - 1.78,1.78,0.3974,90,90,120 - - - N 15111
Al-Ho-Ni Ho3 Ni5Al19 Gd3Ni5Al19,oS108,63 Cmcm 0.3991,1.575,2.692,90,90,90 - - 5.11 A 15111
Al-Ho-Ni Ho3 Ni6Al2 Ce3Ni6Si2,cI44,229 Im-3m 0.8888,0.8888,0.8888,90,90,90 - - 8.52 X 26480
Al-Ho-Ni Ho3 Ni8Al Ce3Co8Si,hP24,194 P63/mmc 0.5028,0.5028,1.607,90,90,120 Laves-CaCu5 - 9.36 X 11393
Al-Ho-Ni Ho4 Ni6Al23 Y4Ni6Al23,mS66,12 C12/m1 1.578,0.40582,1.827,90,112.93,90 - - 5.03 A 53475
Al-Ho-O HoAlO3 ht GdFeO3,oP20,62 Pnma 0.5322,0.7374,0.518,90,90,90 perovskite family yellow 7.84 X 26714
Al-Ho-O HoAlO3 rt YAlO3,hP10,194 P63/mmc 0.367,0.367,1.051,90,90,120 - - 6.50 A 1881
Al-Ho-O Ho3 Al5O12 Y3 Al5O12,cI160,230 Ia-3d 1.2,1.2,1.2,90,90,90 garnet family yellow 6.32 X 4389
Al-Ho-O Ho4 Al2O9 Eu4Al2O9,mP60,14 P121/c1 0.737,1.05,1.099,90,108.1,90 - - 7.05 A 4621
Al-Ho-Os Ho3 Os4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.8789,0.8789,0.9502,90,90,120 - gray dark 8.25 A 40923
Al-Ho-Os Ho3.5 Os6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63/mcm 1.2984,1.2984,0.9015,90,90,120 - gray silver 6.41 A 42976
Al-Ho-Pd HoPdAl TiNiSi,oP12,62 Pnma 0.6851,0.4405,0.7729,90,90,90 AlB2 family - 8.50 A 17109
Al-Ho-Pd Ho2Pd3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3137,0.7635,0.9358,90,90,90 - - 6.31 A 43418
Al-Ho-Pd Ho4Pd9Al24 Er4Pt9Al24,aP37,2 P-1 0.7504,0.7504,1.3079,84.51,78.97,60. - - 6.01 A 36571
Al-Ho-Pr Pr0.5 Ho0.5Al2 MgCu2,cF24,227 Fd-3m 0.793,0.793,0.793,90,90,90 Friauf-Laves phase - 5.51 X 4155
Al-Ho-Pt HoPtAl TiNiSi,oP12,62 Pnma 0.685,0.4382,0.7687,90,90,90 AlB2 family - 11.14 A 17109
Al-Ho-Pt Ho0.67Pt2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63/mmc 0.4271,0.4271,1.6373,90,90,120 - gray silver 8.16 A 44004
Al-Ho-Pt Ho4Pt9Al24 Er4Pt9Al24,aP37,2 P-1 0.7477,0.7477,1.3065,84.521,79.,60. - - 8.19 A 36571
Al-Ho-Re HoRe2Al10 LuRe2Al10,oS156,63 Cmcm 0.92822,1.0298,2.6887,90,90,90 - gray dark 6.26 A 53203
Al-Ho-Re Ho3.66 Re6Al30.74 Y3.64 Re6Al30.69 ,hP88,193 P63/mcm 1.3095,1.3095,0.914,90,90,120 - gray 6.24 X 30205
Al-Ho-Rh HoRhAl TiNiSi,oP12,62 Pnma 0.683,0.41546,0.79341,90,90,90 AlB2 family - 8.70 A 33246
Al-Ho-Rh Ho2 Rh3Al9 Ho2Rh3Al9,oS84,63 Cmcm 1.3168,0.7602,0.9337,90,90,90 - - 6.26 X 43418
Al-Ho-Rh Ho4 RhAl Gd4RhIn,cF96,216 F-43m 1.3415,1.3415,1.3415,90,90,90 - gray dark 8.69 A 57034
Al-Ho-Ru HoRu2Al10 YbFe 2Al10,oS52,63 Cmcm 0.9112,1.0194,0.9083,90,90,90 - - 5.01 A 34696
Al-Ho-Ru Ho3 Ru4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.8769,0.8769,0.9523,90,90,120 - gray dark 6.40 A 40923
Al-Ho-Ru Ho4 RuAl Gd4RhIn,cF96,216 F-43m 1.3351,1.3351,1.3351,90,90,90 - gray dark 8.80 A 57034
Al-Ho-S Ho3 Al1.67 S7 Ce3Al1.67 S7,hP24,173 P63 0.955,0.955,0.607,90,90,120 - - 5.29 A 4521
Al-Ho-Sc Sc0.22 Ho0.78 Al3 rt HoAl3,hR60,166 R-3m 0.6039,0.6039,3.577,90,90,120 close-packed structure - 4.84 A 4603
Al-Ho-Sc Sc0.28 Ho0.72 Al3 Cu3Au,cP4,221 Pm-3m 0.4199,0.4199,0.4199,90,90,90 close-packed structure - 4.76 X 4603
Al-Ho-Se Ho3 Al1.67 Se7 Ce3Al1.67 S7,hP24,173 P63 0.99,0.99,0.618,90,90,120 - - 6.92 A 4521
Al-Ho-Si HoAlSi YAlGe,oS12,63 Cmcm 0.3988,1.0229,0.56829,90,90,90 AlB2 family - 6.30 A 43107
Al-Ho-Si HoAl2Si2 Ce2SO2,hP5,164 P-3m1 0.419,0.419,0.649,90,90,120 - - 4.63 A 7031
Al-Ho-Si Ho15 Al13Si12 *,t**,* - 0.79,0.79,0.4255,90,90,90 - - - N 23497
Al-Ho-Si Ho2 AlSi2 W2CoB2,oI10,71 Immm 0.4022,0.5732,0.8578,90,90,90 - gray 6.94 X 38143
Al-Ho-Si Ho2 Al3Si2 Y2 Al3Si2,mS14,12 C12/m1 1.00851,0.40126,0.65597,90,100.814,90 - gray 5.95 X 45163
Al-Ho-Si Ho5 Al14Si *,hR*,* - 0.61169,0.61169,2.09784,90,90,120 - - - N 23497
Al-Ho-Si Ho6 Al3Si Tb6Al3Si,tI80,140 I4/mcm 1.149,1.149,1.49,90,90,90 - - 7.42 A 18465
Al-Ho-Si Ho7 Al6Si7 *,t**,* - 1.2123,1.2123,1.5138,90,90,90 - - - N 23497
Al-Ho-Sm Sm0.01 Ho0.99Al3 rt HoAl3,hR60,166 R-3m 0.6052,0.6052,3.58,90,90,120 close-packed structure - 5.39 A 7867
Al-Ho-Sm Sm0.2 Ho0.8 Al3 TiNi3,hP16,194 P63/mmc 0.6087,0.6087,0.9525,90,90,120 close-packed structure - 5.28 A 7867
Al-Ho-Sm Sm0.4 Ho0.6 Al3 BaPb3,hR36,166 R-3m 0.6187,0.6187,2.1176,90,90,120 close-packed structure - 5.11 A 7867
Al-Ho-Sm Sm0.47 Ho0.53Al3 rt Mg3 Cd,hP8,194 P63/mmc 0.6303,0.6303,0.4592,90,90,120 close-packed structure - 5.03 A 7867
Al-Ho-Ta Ho6 Ta4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1071,1.1071,1.7796,90,90,120 - - 5.05 A 30591
Al-Ho-Tb Tb0.35 Ho0.65 Al3 rt HoAl3,hR60,166 R-3m 0.6064,0.6064,3.583,90,90,120 close-packed structure - 5.32 A 4603
Al-Ho-Tb Tb0.51 Ho0.49 Al3 TiNi3,hP16,194 P63/mmc 0.6087,0.6087,0.9536,90,90,120 close-packed structure - 5.27 A 4603
Al-Ho-Tb Tb0.57 Ho0.43 Al3 BaPb3,hR36,166 R-3m 0.6157,0.6157,2.115,90,90,120 close-packed structure - 5.22 A 4603
Al-Ho-Tb Tb0.6 Ho0.4 Al2 MgCu2,cF24,227 Fd-3m 0.7837,0.7837,0.7837,90,90,90 Friauf-Laves phase - 5.94 X 21781
Al-Ho-Ti HoTi2Al20 CeCr2Al20,cF184,227 Fd-3m 1.467,1.467,1.467,90,90,90 - - 3.37 A 30512
Al-Ho-Ti Ho6 Ti4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1035,1.1035,1.7839,90,90,120 - - 4.13 A 30591
Al-Ho-Tm Ho0.38 Tm0.62 Al3 Cu3Au,cP4,221 Pm-3m 0.4212,0.4212,0.4212,90,90,90 close-packed structure - 5.52 X 7867
Al-Ho-Tm Ho0.42 Tm0.58 Al3 rt HoAl3,hR60,166 R-3m 0.6025,0.6025,3.572,90,90,120 close-packed structure - 5.51 A 7867
Al-Ho-V Ho6 V4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0947,1.0947,1.7679,90,90,120 - - 4.26 A 30591
Al-Ho-W Ho6 W4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.099,1.099,1.7674,90,90,120 - - 5.18 A 29673
Al-Ho-Y Y0.3 Ho0.7 Al3 rt HoAl3,hR60,166 R-3m 0.6064,0.6064,3.583,90,90,120 close-packed structure - 4.87 A 4603
Al-Ho-Y Y0.43 Ho0.57 Al3 TiNi3,hP16,194 P63/mmc 0.6084,0.6084,0.9523,90,90,120 close-packed structure - 4.64 A 4603
226 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ho-Y Y0.48 Ho0.52 Al3 ht BaPb3,hR36,166 R-3m 0.615,0.615,2.112,90,90,120 close-packed structure - 4.52 A 4603
Al-Ho-Zn Zn4.4 Ho3Al6.6 La3Al11,oI28,71 Immm 0.42107,0.99514,1.23881,90,90,90 - - 6.15 X 44889
Al-Ho-Zn Zn5HoAl3 Zn3(Zn0.4 Al0.6)5Ho,tI72,139 I4/mmm 0.8586,0.8586,1.6538,90,90,90 - - 6.24 X 47795
Al-Ho-Zr Ho0.4 Zr0.6 Al2 MgCu2,cF24,227 Fd-3m 0.765,0.765,0.765,90,90,90 Friauf-Laves phase - 5.18 X 54606
Al-Ho-Zr Ho0.8 Zr0.2 Al3 Cu3Au,cP4,221 Pm-3m 0.421,0.421,0.421,90,90,90 close-packed structure - 5.14 X 15104
Al-Ho-Zr Ho0.94 Zr0.06 Al DyAl,oP16,57 Pbcm 0.5739,1.1325,0.5576,90,90,90 - - 6.87 A 54606
Al-I-In AlInI4 AlInI4,mP24,11 P121/m1 0.7135,1.1822,1.2083,90,96.32,90 - yellow 4.26 X 51563
Al-I-La La0.7 Al0.14 I0.86 La0.7 Al0.14 I0.86 ,cF52,225 Fm-3m 0.6323,0.6323,0.6323,90,90,90 - - 5.52 X 44167
Al-I-La La10Al5I8 La10Al5I8,mS46,12 C12/m1 1.9649,0.4296,1.8029,90,96.67,90 - golden 5.58 X 47581
Al-I-La La2Al2I Gd2Fe2I,hP10,194 P63 /mmc 0.43718,0.43718,1.7605,90,90,120 - gray silver 5.23 X 39455
Al-I-La La2.76 Al0.48 I3.52 La2.76 (Al0.48 I0.52)I3,cI64,214 I4132 1.2689,1.2689,1.2689,90,90,90 - - 5.48 X 48288
Al-I-La La3Al2I2 La3Al2I2,mS28,12 C12/m1 1.9729,0.43181,1.2348,90,121.49,90 - gray silver 5.36 X 39455
Al-I-La La8Al4I7 La8Al4I7,mS114,12 C12/m1 3.5753,0.4327,2.7442,90,116.62,90 - golden 5.53 X 47581
Al-I-Na NaAlI4 NaGaBr4,oP24,62 Pnma 1.5051,0.813,0.8098,90,90,90 - colorless 3.74 X 29638
Al-I-O AlIO GaClO,oP12,29 Pca21 0.686,1.103,0.492,90,90,90 - colorless 3.03 A 2033
Al-I-O Al[IO3]3 Fe[IO3]3,hP26,173 P63 0.9003,0.9003,0.52406,90,90,120 - colorless 4.98 X 44905
Al-I-P AlPI8 AlPI8,oP40,33 Pna21 1.1094,1.0485,1.5293,90,90,90 - red dark 4.01 X 16648
Al-I-P AlP 2I9 AlP 2I9,oP96,61 Pbca 1.0883,1.8273,2.0316,90,90,90 - - 4.05 X 16650
Al-I-Pd Pd5AlI2 Pd5AlI2,tI16,139 I4/mmm 0.4052,0.4052,1.9559,90,90,90 - - 8.41 X 13774
Al-I-Sb AlSbI6 AlSbI6,mS32,12 C12/m1 1.5748,1.3183,0.7289,90,114.478,90 - - 4.39 X 16755
Al-I-Se AlSeI *,mP120,11 P121/m1 1.811,1.287,1.9973,90,94.,90 - - - N 3448
Al-I-Te AlTeI7 AlSCl7,mP18,7 P1c1 0.7319,0.7308,1.5655,90,102.01,90 - red dark 4.23 X 31018
Al-I-Te Al3Te3I Al3Te3I,oP28,62 Pnma 1.1254,0.41,1.9826,90,90,90 - yellow 4.29 X 24326
Al-I-Tl TlAlI4 KGaI4,mP24,14 P121/c1 0.8225,0.7844,1.5973,90,96.02,90 - colorless 4.79 X 53503
Al-In-Li LiAl0.942 In0.058 NaTl,cF16,227 Fd-3m 0.63922,0.63922,0.63922,90,90,90 b.c.c. family - 1.98 X 14500
Al-In-Nb Nb3Al0.9 In0.1 Cr3Si,cP8,223 Pm-3n 0.5193,0.5193,0.5193,90,90,90 Frank-Kasper phase - 7.46 X 4326
Al-In-Ni Ni3Al0.96 In0.04 Cu3Au,cP4,221 Pm-3m 0.3579,0.3579,0.3579,90,90,90 close-packed structure - 7.48 X 17833
Al-In-O Al11In1.23 O17 TlAl11O17 ,hP72,194 P63 /mmc 0.5599,0.5599,2.2901,90,90,120 β-alumina bronze 3.79 X 15358
Al-In-S AlInS3 AlInS3,hP30,169 P61 0.66712,0.66712,1.7835,90,90,120 - yellow 3.45 X 12188
Al-In-S Al0.06 In1.94 S3 In2S3,tI80,141 I41/amd 0.76038,0.76038,3.226,90,90,90 - - 4.57 X 55992
Al-In-S Al0.33 In2.33 S4 Fe3O4,cF56,227 Fd-3m 1.0699,1.0699,1.0699,90,90,90 spinel family - 4.39 X 55992
Al-In-S Al2In4S9 ht *,hP*,164 P-3m1 0.7532,0.7532,3.654,90,90,120 - orange - N 15763
Al-In-Sb Al0.5 In0.5 Sb ZnS,cF8,216 F-43m 0.6305,0.6305,0.6305,90,90,90 adamantane structure - 5.11 X 14235
Al-In-Sr SrAlIn KHg2,oI12,74 Imma 0.49334,0.8021,0.82796,90,90,90 AlB2 family gray silver 4.65 X 49752
Al-In-Sr SrAl0.4 In1.6 CaIn2,hP6,194 P63 /mmc 0.49698,0.49698,0.8033,90,90,120 AlB2 family gray silver 5.45 X 49752
Al-In-Sr Sr11Al4In3 Ca11Ga7,cF144,225 Fm-3m 1.7506,1.7506,1.7506,90,90,90 - - 3.51 X 50550
Al-In-Sr Sr3Al0.12 In2.88 Sr3(Al0.12 In0.88 )In2,oP72,52 Pnna 1.2801,1.482,1.3087,90,90,90 - gray silver 4.79 X 51659
Al-In-Sr Sr3Al1.82 In3.18 Hf3Ni2Si3,oS32,63 Cmcm 0.48636,1.1751,1.6399,90,90,90 - gray silver 4.80 X 47577
Al-In-Te AlInTe 2 TlGaTe2,tI16,140 I4/mcm 0.8439,0.8439,0.6799,90,90,90 - black 5.45 X 31175
Al-Ir-La LaIrAl TiNiSi,oP12,62 Pnma 0.71662,0.4301,0.81686,90,90,90 AlB2 family - 9.45 A 30303
Al-Ir-La La2Ir3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3327,0.7694,0.954,90,90,90 - - 7.45 A 43418
Al-Ir-La La4IrAl Gd4RhIn,cF96,216 F-43m 1.4177,1.4177,1.4177,90,90,90 - gray dark 7.22 A 57034
Al-Ir-Li LiIrAl2 Cu2MnAl,cF16,225 Fm-3m 0.6006,0.6006,0.6006,90,90,90 b.c.c. family red violet 7.76 X 23551
Al-Ir-Lu LuIrAl TiNiSi,oP12,62 Pnma 0.67398,0.4159,0.7835,90,90,90 AlB2 family - 11.92 A 30303
Al-Ir-Lu Lu2Ir3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.2914,0.753,0.9352,90,90,90 - - 8.54 A 43418
Al-Ir-Mn MnIrAl CaF2,cF12,225 Fm-3m 0.5992,0.5992,0.5992,90,90,90 fluorite family - 8.46 X 6860
Al-Ir-Mn MnIr2Al Cu2MnAl,cF16,225 Fm-3m 0.6025,0.6025,0.6025,90,90,90 b.c.c. family - 14.16 X 6860
Al-Ir-Nb NbIr0.45 Al1.55 MgZn2,hP12,194 P63 /mmc 0.5098,0.5098,0.8306,90,90,120 Friauf-Laves phase - 7.86 X 9932
Al-Ir-Nb Nb0.33 Ir0.39 Al0.28 (Cr0.18Mo0.42 Ni0.40 ),oP56,62 Pnma 1.7498,0.4862,0.9154,90,90,90 Frank-Kasper phase - 13.51 A 9907
Al-Ir-Nb Nb0.48 Ir0.295 Al0.225 (Cr0.16Mo0.38 Co0.46 ),hR159,148 R-3 1.18,1.18,2.0808,90,90,120 Frank-Kasper phase - 11.30 A 9907
Al-Ir-Nb Nb3Ir5Al2 *,t**,* - 0.409,0.409,0.7009,90,90,90 - - - N 9907
Al-Ir-Nb Nb6.24 Ir1.69 Al5.07 Nb6(Nb0.04 Ni0.72 Al0.24 )7,oP52,62 Pnma 0.9297,0.4941,1.6256,90,90,90 Frank-Kasper phase - 9.26 A 9907
Al-Ir-Nb Nb6.39 Ir4Al7.61 Nb6(Nb0.2 Al0.8 )2Ir(I...,hP36,193 P63 /mcm 0.884,0.884,0.822,90,90,120 Friauf-Laves phase - 9.36 X 10758
Al-Ir-Nd NdIrAl TiNiSi,oP12,62 Pnma 0.70327,0.42542,0.80081,90,90,90 AlB2 family - 10.08 A 30303
Al-Ir-Nd Nd2Ir3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.327,0.7661,0.945,90,90,90 - - 7.66 A 43418
Al-Ir-Nd Nd4IrAl Gd4RhIn,cF96,216 F-43m 1.3851,1.3851,1.3851,90,90,90 - gray dark 7.96 A 57034
Al-Ir-Ni Ir0.47 Ni0.43 Al1.1 CsCl,cP2,221 Pm-3m 0.2928,0.2928,0.2928,90,90,90 b.c.c. family - 9.61 X 54558
Al-Ir-Ni Ir0.9 Ni0.1 Al2.75 *,cP*,200 Pm-3 0.76616,0.76616,0.76616,90,90,90 - - 7.48 N 54558
Al-Ir-Ni Ir6Ni3Al28 Ir9Al28,hP236,159 P31c 1.2171,1.2171,2.7069,90,90,120 - - 5.98 A 54558
Al-Ir-Pr PrIrAl TiNiSi,oP12,62 Pnma 0.7062,0.42653,0.80271,90,90,90 AlB2 family - 9.89 A 30303
Al-Ir-Pr Pr2Ir3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3292,0.7674,0.9463,90,90,90 - - 7.58 A 43418
Al-Ir-Pr Pr4IrAl Gd4RhIn,cF96,216 F-43m 1.3942,1.3942,1.3942,90,90,90 - gray dark 7.67 A 57034
Al-Ir-Ru Ru0.5 Ir0.5 Al CsCl,cP2,221 Pm-3m 0.2989,0.2989,0.2989,90,90,90 b.c.c. family - 10.80 X 35927
Al-Ir-Sc ScIrAl MgZn2,hP12,194 P63 /mmc 0.52875,0.52875,0.814,90,90,120 Friauf-Laves phase - 8.90 A 30303
Al-Ir-Sc Sc6Ir7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.231,1.231,1.231,90,90,90 - - 7.29 A 7364
Al-Ir-Sm SmIrAl TiNiSi,oP12,62 Pnma 0.69833,0.42271,0.79611,90,90,90 AlB2 family - 10.45 A 30303
Al-Ir-Sm Sm2Ir3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3261,0.7656,0.9385,90,90,90 - - 7.81 A 43418
Al-Ir-Sm Sm4IrAl Gd4RhIn,cF96,216 F-43m 1.3698,1.3698,1.3698,90,90,90 - gray dark 8.48 A 57034
Al-Ir-Tb TbIrAl TiNiSi,oP12,62 Pnma 0.68907,0.42062,0.78998,90,90,90 AlB2 family - 10.97 A 30303
Al-Ir-Tb Tb2Ir3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.29784,0.75737,0.94384,90,90,90 - - 8.14 X 55413
Al-Ir-Tb Tb4IrAl Gd4RhIn,cF96,216 F-43m 1.3518,1.3518,1.3518,90,90,90 - gray dark 9.20 A 57034
Al-Ir-Th ThIrAl ZrNiAl,hP9,189 P-62m 0.71762,0.71762,0.41417,90,90,120 Fe2P family - 12.17 A 4278
Al-Ir-Ti Ti1.132 Ir0.14 Al2.728 Cu3Au,cP4,221 Pm-3m 0.39733,0.39733,0.39733,90,90,90 close-packed structure - 4.10 X 42939
Al-Ir-Ti Ti8.6 Ir7Al14.4 (Ti0.42 Al0.58)15Pt7Al8,cF120,225 Fm-3m 1.22049,1.22049,1.22049,90,90,90 - - 7.84 X 42939
Al-Ir-Tm TmIrAl TiNiSi,oP12,62 Pnma 0.67774,0.41615,0.78491,90,90,90 AlB2 family - 11.65 A 30303
Al-Ir-Tm Tm2Ir3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3086,0.749,0.9363,90,90,90 - - 8.38 A 43418
Al-Ir-U UIrAl hex1 ZrNiAl,hP9,189 P-62m 0.6929,0.6929,0.401,90,90,120 Fe2P family - 13.66 X 50021
Al-Ir-U UIrAl hex2 MgNi2,hP24,194 P63 /mmc 0.6868,0.6868,2.4693,90,90,120 Friauf-Laves phase - 6.02 A 2440
Handbook of Inorganic Substances – Edition 2015 : Data 227

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ir-U U2Ir3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.313,0.758,0.934,90,90,90 - - 9.26 A 33257


Al-Ir-Y YIrAl TiNiSi,oP12,62 Pnma 0.68676,0.42089,0.78834,90,90,90 AlB2 family - 8.98 A 30303
Al-Ir-Y Y2Ir3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.311,0.7507,0.9422,90,90,90 - - 7.14 A 43418
Al-Ir-Yb Yb2Ir3 Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3056,0.7537,0.9357,90,90,90 - - 8.41 A 43418
Al-Ir-Zr ZrIrAl MgZn2,hP12,194 P63/mmc 0.524,0.524,0.832,90,90,120 Friauf-Laves phase - 10.42 A 8294
Al-Ir-Zr Zr6Ir7Al16 Mg6 Cu16Si7,cF116,225 Fm-3m 1.2332,1.2332,1.2332,90,90,90 - - 8.23 A 3206
Al-K-O KAlO2 ht1 LiAlO2,tP16,92 P41212 0.5502,0.5502,0.7806,90,90,90 - - 2.76 X 43813
Al-K-O KAlO2 ht2 CsNbN2,cF32,227 Fd-3m 0.78329,0.78329,0.78329,90,90,90 - - 2.71 X 57777
Al-K-O KAlO2 rt KGaO2,oP64,61 Pbca 0.54387,1.09236,1.54564,90,90,90 - white 2.84 X 57777
Al-K-O KAl11O17 NaAl11O17,hP58,194 P63/mmc 0.5584,0.5584,2.267,90,90,120 β-alumina - 3.30 A 143
Al-K-O K0.33 Al3O4.67 Na0.5 Al3O4.75 ,oP24,55 Pbam 0.76934,0.76727,0.29323,90,90,90 - - 3.23 X 38467
Al-K-O K1.50 Al11.0 O17.25 Ag1.25 Al11O17.125 ,hP96,194 P63/mmc 0.5598,0.5598,2.2732,90,90,120 β-alumina - 3.40 X 19248
Al-K-O K2Al10.68 O17 K2Al10.67 O17,hR90,166 R-3m 0.5595,0.5595,3.4226,90,90,120 β"-alumina - 3.43 X 3904
Al-K-O K3AlO3 Rb3InS3,mS28,12 C12/m1 0.69825,1.10354,0.64649,90,102.49,90 - colorless 2.63 X 29603
Al-K-P K3AlP 2 K3AlAs2,aP48,2 P-1 0.8871,1.1879,1.53133,96.77,107.062,108.38 - red dark 1.92 X 24287
Al-K-S K2Al20S31 *,hP*,* - 0.6204,0.6204,1.2,90,90,120 - - - N 12627
Al-K-Sb KAlSb4 KGaSb4,oP24,62 Pnma 1.0366,0.422,1.7865,90,90,90 - - 4.70 X 25603
Al-K-Sb K2Al2Sb3 Na2Al2Sb3,mP56,14 P121/c1 1.472,0.723,1.664,90,90.6,90 - - 3.73 X 17471
Al-K-Se KAlSe 2 TlGaSe 2,mS64,15 C12/c1 1.0885,1.0884,1.5382,90,100.19,90 - yellowish 3.32 A 37555
Al-K-Se K3AlSe 3 Cs3GaSe3,mP28,14 P121/c1 0.8047,1.2964,1.0498,90,127.71,90 - amber 2.92 X 25648
Al-K-Si K4Al11.5 Si11.5 Ge19P4I4,cP54,218 P-43n 1.0536,1.0536,1.0536,90,90,90 clathrate blue gray 2.24 A 11105
Al-K-Sn K4Al11.5 Sn11.5 Ge19P4I4,cP54,218 P-43n 1.2007,1.2007,1.2007,90,90,90 clathrate blue gray 3.51 A 11105
Al-K-Sn K4Al4Sn19 Na4Si23,cP54,223 Pm-3n 1.2007,1.2007,1.2007,90,90,90 clathrate gray 4.83 X 35331
Al-K-Te KAlTe 2 mon TlGaSe 2,mS64,15 C12/c1 1.1808,1.1812,1.6465,90,100.32,90 - white 3.78 X 37555
Al-K-Te KAlTe 2 tet TlGaTe 2,tI16,140 I4/mcm 0.877,0.877,0.671,90,90,90 - red 4.14 X 10292
Al-K-Te K3AlTe 3 Cs3GaSe3,mP28,14 P121/c1 0.8632,1.3723,1.1264,90,127.71,90 - black 3.32 X 25640
Al-La-Lu La0.5 Lu0.5 Al2 MgCu2,cF24,227 Fd-3m 0.797,0.797,0.797,90,90,90 Friauf-Laves phase - 5.53 X 18119
Al-La-Mg Mg0.2 LaAl1.8 MgCu2,cF24,227 Fd-3m 0.822,0.822,0.822,90,90,90 Friauf-Laves phase - 4.60 X 21234
Al-La-Mg Mg0.8 LaAl0.2 CsCl,cP2,221 Pm-3m 0.392,0.392,0.392,90,90,90 b.c.c. family - 4.52 X 21234
Al-La-Mg Mg1.5 LaAl0.5 ht MgCu2,cF24,227 Fd-3m 0.8705,0.8705,0.8705,90,90,90 Friauf-Laves phase - 3.80 X 21234
Al-La-Mg Mg11.16 LaAl0.84 ThMn12,tI26,139 I4/mmm 1.03246,1.03246,0.5941,90,90,90 CaCu5-Zr4Al3 - 2.27 X 49406
Al-La-Mg Mg21.01 La6Al1.99 Th6Mn23,cF116,225 Fm-3m 1.45578,1.45578,1.45578,90,90,90 - - 3.01 X 46644
Al-La-Mn LaMn2.26 Al9.74 CaCr2Al10,tP52,129 P4/nmm 1.2906,1.2906,0.5156,90,90,90 CaCu5-Zr4Al3 gray silver 4.07 X 49374
Al-La-Mn LaMn4Al8 CeMn4Al8,tI26,139 I4/mmm 0.9031,0.9031,0.5166,90,90,90 CaCu5-Zr4Al3 - 4.53 A 9924
Al-La-Mn La2Mn7Al10 Zn17 Th2,hR57,166 R-3m 0.914,0.914,1.328,90,90,120 CaCu5-Zr4Al3 - 4.83 A 6308
Al-La-Mn La6Mn10Al4 La6Co 9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.84533,0.84533,2.3935,90,90,90 - - 5.79 X 52936
Al-La-Mo LaMo 2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4634,1.4634,1.4634,90,90,90 - - 3.69 A 30512
Al-La-Mo La4Mo 7Al51 La4Mo 7Al51,hP62,164 P-3m1 1.0424,1.0424,1.1743,90,90,120 - gray silver 3.91 X 36149
Al-La-N La3AlN CaTiO3,cP5,221 Pm-3m 0.50948,0.50948,0.50948,90,90,90 perovskite family - 5.75 X 47706
Al-La-Nb LaNb2 Al20 CeCr2Al20,cF184,227 Fd-3m 1.4811,1.4811,1.4811,90,90,90 - - 3.53 A 34455
Al-La-Nd La0.5 Nd0.5 Al2 MgCu2,cF24,227 Fd-3m 0.81,0.81,0.81,90,90,90 Friauf-Laves phase - 4.89 X 28820
Al-La-Nd La0.5 Nd0.5 Al3 Mg3 Cd,hP8,194 P63/mmc 0.6543,0.6543,0.4628,90,90,120 close-packed structure - 4.31 A 28820
Al-La-Nd La1.5 Nd1.5 Al11 La3Al11,oI28,71 Immm 0.44,1.007,1.307,90,90,90 - - 4.14 A 28820
Al-La-Ni LaNiAl LaNiAl,oP24,62 Pnma 0.7199,0.4203,1.6085,90,90,90 - - 6.13 X 21419
Al-La-Ni LaNiAl2 MgCuAl2,oS16,63 Cmcm 0.4082,1.1164,0.6972,90,90,90 - - 5.26 X 19354
Al-La-Ni LaNi1.44 Al5.56 SrAu(Au0.5 Ga0.5 )2Ga4,tP8,123 P4/mmm 0.4189,0.4189,0.8032,90,90,90 - - 4.40 X 42993
Al-La-Ni LaNi2Al3 EuCo 2Ga3,oS24,63 Cmcm 1.0173,0.7834,0.51374,90,90,90 - - 5.47 X 25854
Al-La-Ni LaNi2Al5 PrNi2Al5,oI16,71 Immm 0.4021,0.7033,0.9677,90,90,90 - - 4.75 A 14144
Al-La-Ni LaNi4.25 Al0.75 CaCu5,hP6,191 P6/mmm 0.5044,0.5044,0.4043,90,90,120 - - 7.62 X 40827
Al-La-Ni La2NiAl7 La2NiAl7,tI40,107 I4mm 0.6221,0.6221,2.1403,90,90,90 - - 4.21 X 44481
Al-La-Ni La2Ni2.25 Al0.75 W2CoB2,oI10,71 Immm 0.4378,0.562,0.8585,90,90,90 - - 6.76 A 15468
Al-La-Ni La5Ni2Al3 m La5Ni2Al3,oS40,63 Cmcm 1.42311,0.6914,1.04598,90,90,90 - - 5.76 X 47666
Al-La-O LaAlO3 ht CaTiO3,cP5,221 Pm-3m 0.37913,0.37913,0.37913,90,90,90 perovskite family pink 6.52 X 44242
Al-La-O LaAlO3 rt LaAlO3,hR30,167 R-3c 0.5366,0.5366,1.31105,90,90,120 perovskite family pink 6.52 X 43253
Al-La-O La0.83 Al11.83 O19 La0.83 Al11.83 O19,hP84,194 P63/mmc 0.5561,0.5561,2.207,90,90,120 magnetoplumbite family colorless 4.15 X 17269
Al-La-O La1.65 Al0.35O3 *,oP*,* - 0.5942,0.9691,1.5481,90,90,90 - - - N 8601
Al-La-O La3AlO CaTiO3,cP5,221 Pm-3m 0.50322,0.50322,0.50322,90,90,90 perovskite family - 5.99 X 47706
Al-La-O La4Al2O9 m Eu4Al2O9,mP60,14 P121/c1 0.797,1.109,1.141,90,108.8,90 - - 5.24 A 31696
Al-La-Os LaOs2Al9.74 YbFe 2Al10,oS52,63 Cmcm 0.9214,1.0285,0.9172,90,90,90 - - 5.98 X 34696
Al-La-Pd LaPd2Al3 PrNi2Al3,hP6,191 P6/mmm 0.55082,0.55082,0.42267,90,90,120 - - 6.47 X 26462
Al-La-Pr La0.6 Pr0.4 Al2 MgCu2,cF24,227 Fd-3m 0.8093,0.8093,0.8093,90,90,90 Friauf-Laves phase - 4.85 X 4766
Al-La-Pr La0.6 Pr0.4 Al3 Mg3 Cd,hP8,194 P63/mmc 0.661,0.661,0.461,90,90,120 close-packed structure - 4.20 A 4766
Al-La-Pt LaPt4Al PrNi2Al3,hP6,191 P6/mmm 0.5394,0.5394,0.4441,90,90,120 - - 14.04 X 28834
Al-La-Rh LaRhAl LaNiAl,oP24,62 Pnma 0.725,0.42594,1.62573,90,90,90 - - 7.11 A 33246
Al-La-Rh La2Rh3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3393,0.7732,0.954,90,90,90 - - 5.58 A 43418
Al-La-Rh La4RhAl Gd4RhIn,cF96,216 F-43m 1.4183,1.4183,1.4183,90,90,90 - gray dark 6.38 A 57034
Al-La-Ru LaRu2 Al10 YbFe 2Al10,oS52,63 Cmcm 0.91545,1.02996,0.92147,90,90,90 - - 4.67 X 57200
Al-La-Ru La11 Ru2Al6 La11 Ru2Al6,oP38,55 Pbam 1.4619,1.5705,0.44866,90,90,90 - - 6.10 X 53941
Al-La-Ru La3Ru4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.89254,0.89254,0.97015,90,90,120 - - 5.68 A 58824
Al-La-Ru La5Ru3Al2 Pr5Ru3Al2,cI40,199 I213 0.99542,0.99542,0.99542,90,90,90 - - 7.08 X 55154
Al-La-S La3Al1.67 S7 ht Ce3Al1.67 S7,hP24,173 P63 1.017,1.017,0.608,90,90,120 - beige gray 4.18 A 5866
Al-La-Sc La0.004 Sc0.996 Al3 Cu3Au,cP4,221 Pm-3m 0.4103,0.4103,0.4103,90,90,90 close-packed structure - 3.04 X 52216
Al-La-Sc La0.75 Sc0.25 Al2 MgCu2,cF24,227 Fd-3m 0.808,0.808,0.808,90,90,90 Friauf-Laves phase - 4.27 X 18551
Al-La-Se La3Al1.67 Se7 Ce3Al1.67 S7,hP24,173 P63 1.043,1.043,0.621,90,90,120 - - 5.76 A 4521
Al-La-Si LaAlSi2 CeAlSi2,hP8,164 P-3m1 0.4196,0.4196,1.1437,90,90,120 - - 4.23 X 39679
Al-La-Si LaAl0.5 Si0.5 TlI,oS8,63 Cmcm 0.45618,1.1557,0.41607,90,90,90 CrB(TlI)-FeB - 5.04 A 43109
Al-La-Si LaAl1.26 Si0.74 ThSi2,tI12,141 I41/amd 0.43377,0.43377,1.4868,90,90,90 - - 4.60 A 50369
Al-La-Si LaAl1.57 Si0.43 ht AlB2 ,hP3,191 P6/mmm 0.4372,0.4372,0.4411,90,90,120 AlB2 family - 4.40 X 50369
228 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-La-Si LaAl1.995 Si0.005 MgCu2,cF24,227 Fd-3m 0.81494,0.81494,0.81494,90,90,90 Friauf-Laves phase - 4.73 X 50369
Al-La-Si LaAl2Si2 Ce2SO2,hP5,164 P-3m1 0.423,0.423,0.7006,90,90,120 - - 3.81 A 6312
Al-La-Si La3Al4Si6 Ce3Al4Si6 ,hP13,164 P-3m1 0.4218,0.4218,1.811,90,90,120 - - 4.13 A 43109
Al-La-Sn LaAl1.625 Sn0.375 AlB2,hP3,191 P6/mmm 0.44919,0.44919,0.43835,90,90,120 AlB2 family - 4.93 X 53272
Al-La-Sn LaAl1.782 Sn0.218 MgCu2,cF24,227 Fd-3m 0.79373,0.79373,0.79373,90,90,90 Friauf-Laves phase - 5.65 X 53272
Al-La-Ta LaTa2 Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4811,1.4811,1.4811,90,90,90 - - 4.25 A 34455
Al-La-Ti LaTi2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.47713,1.47713,1.47713,90,90,90 - - 3.19 X 58994
Al-La-U La0.5 U0.5 Al2 MgCu2,cF24,227 Fd-3m 0.797,0.797,0.797,90,90,90 Friauf-Laves phase - 6.36 X 22939
Al-La-V LaV2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4623,1.4623,1.4623,90,90,90 - - 3.32 X 58994
Al-La-W LaW2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4654,1.4654,1.4654,90,90,90 - - 4.42 A 30512
Al-La-W La4W7Al51 La4Mo7Al51,hP62,164 P-3m1 1.0413,1.0413,1.1733,90,90,120 - gray silver 4.85 A 36149
Al-La-Y La0.09 Y0.91 Al3 rt Mg3Cd,hP8,194 P63 /mmc 0.6325,0.6325,0.4608,90,90,120 close-packed structure - 3.63 A 42932
Al-La-Y La0.37 Y0.63 Al2 MgCu2,cF24,227 Fd-3m 0.7981,0.7981,0.7981,90,90,90 Friauf-Laves phase - 4.22 X 42932
Al-La-Y La0.94 Y0.06 Al3 rt Mg3Cd,hP8,194 P63 /mmc 0.6654,0.6654,0.4617,90,90,120 close-packed structure - 4.07 A 42932
Al-La-Y La2.28 Y0.72 Al11 La3Al11,oI28,71 Immm 0.4391,1.0065,1.3098,90,90,90 - - 3.89 A 42932
Al-La-Yb La0.5 Yb0.5 Al2 MgCu2,cF24,227 Fd-3m 0.804,0.804,0.804,90,90,90 Friauf-Laves phase - 5.37 X 18119
Al-La-Zn ZnLaAl KHg2,oI12,74 Imma 0.4671,0.7713,0.776,90,90,90 AlB2 family - 5.49 X 24841
Al-La-Zn Zn0.4 LaAl0.6 CsCl,cP2,221 Pm-3m 0.378,0.378,0.378,90,90,90 b.c.c. family - 5.57 X 23312
Al-La-Zn Zn2LaAl2 CeAl2Ga2,tI10,139 I4/mmm 0.4292,0.4292,1.1015,90,90,90 - - 5.30 X 23312
Al-Li-Mg LiMgAl2 cub *,cF*,* - 2.031,2.031,2.031,90,90,90 - - - N 10132
Al-Li-Mg LiMgAl2 mon *,mS*,* - 2.0004,1.9797,2.0004,90,91.17,90 - - - N 13614
Al-Li-Mg Li0.09 Mg0.90 Al0.01 Mg,hP2,194 P63 /mmc 0.3204,0.3204,0.5203,90,90,120 close-packed structure - 1.63 X 52754
Al-Li-N Li3AlN2 Li3AlN2,cI96,206 Ia-3 0.9461,0.9461,0.9461,90,90,90 - white 2.38 X 303
Al-Li-O LiAlO2 cub *,cI192,214 I4132 1.265,1.265,1.265,90,90,90 - - - N 1239
Al-Li-O LiAlO2 ht LiAlO2,tP16,92 P41212 0.51687,0.51687,0.62679,90,90,90 - colorless 2.61 X 2491
Al-Li-O LiAlO2 rt NaFeO2,hR12,166 R-3m 0.281,0.281,1.4152,90,90,120 rocksalt family - 3.39 X 52032
Al-Li-O LiAl2O3.5 ht MgAl2O4,cF56,227 Fd-3m 0.791,0.791,0.791,90,90,90 spinel family - 3.14 X 32202
Al-Li-O LiAl5O8 rt LiFe5O8,cP56,213 P4132 0.7908,0.7908,0.7908,90,90,90 spinel family colorless 3.62 X 12544
Al-Li-O Li5AlO4 ht Li5AlO4,oP20,59 Pmmn 0.6302,0.642,0.462,90,90,90 - colorless 2.23 X 11036
Al-Li-O Li5AlO4 rt Li5GaO4,oP80,61 Pbca 0.8947,0.912,0.9087,90,90,90 - - 2.25 A 6316
Al-Li-P Li3AlP 2 *,oI48,73 Ibca 1.1471,1.161,1.1731,90,90,90 - ochre - P 463
Al-Li-Pd LiPdAl LiBaSi,hP3,187 P-6m2 0.4279,0.4279,0.5574,90,90,120 AlB2 family pink 2.64 A 23551
Al-Li-Pd LiPdAl2 Cu2MnAl,cF16,225 Fm-3m 0.6046,0.6046,0.6046,90,90,90 b.c.c. family violet 5.03 X 23551
Al-Li-Pd Li2PdAl Li2AgSb,cF16,216 F-43m 0.6033,0.6033,0.6033,90,90,90 b.c.c. family pink 4.45 X 23551
Al-Li-Pt LiPtAl BeZrSi,hP6,194 P63 /mmc 0.4988,0.4988,1.2139,90,90,120 AlB2 family yellow 2.91 X 23551
Al-Li-Pt LiPtAl2 Cu2MnAl,cF16,225 Fm-3m 0.5991,0.5991,0.5991,90,90,90 b.c.c. family red copper 7.91 X 23551
Al-Li-Pt Li2PtAl Li2AgSb,cF16,216 F-43m 0.5996,0.5996,0.5996,90,90,90 b.c.c. family yellow 7.27 X 23551
Al-Li-Rh LiRhAl2 Cu2MnAl,cF16,225 Fm-3m 0.5977,0.5977,0.5977,90,90,90 b.c.c. family yellow 5.10 X 23551
Al-Li-Rh Li2RhAl Li2AgSb,cF16,216 F-43m 0.6011,0.6011,0.6011,90,90,90 b.c.c. family gray silver 4.40 X 23551
Al-Li-S Li0.5Al2.5 S4 rt MgAl2O4,cF56,227 Fd-3m 0.9996,0.9996,0.9996,90,90,90 spinel family - 2.65 X 1420
Al-Li-S Li5AlS4 *,m**,* - 0.6247,0.7835,0.684,90,90.27,90 - - - N 40549
Al-Li-Se LiAlSe2 NaFeO2,oP16,33 Pna21 0.68228,0.8266,0.65236,90,90,90 adamantane structure colorless 3.46 X 37204
Al-Li-Si LiAlSi MgAgAs,cF12,216 F-43m 0.5928,0.5928,0.5928,90,90,90 - - 1.98 X 42431
Al-Li-Si Li1.75 Al0.75 Si Li2AgSb,cF16,216 F-43m 0.6115,0.6115,0.6115,90,90,90 b.c.c. family - 1.76 X 42431
Al-Li-Si Li12Al3Si4 Li12Mg3Si4,cI76,220 I-43d 1.062,1.062,1.062,90,90,90 - - 1.53 X 26008
Al-Li-Si Li4.5 Al0.5 Si1.5 Li4AlGe1.75,tI32,141 I41/amd 0.6179,0.6179,1.2199,90,90,90 - - 1.24 X 42431
Al-Li-Si Li7.3 Al1.7 Si3 Li6(Li0.65 Al0.35 )2AlSi3,hP24,176 P63 /m 0.7549,0.7549,0.8097,90,90,120 - black 1.50 X 41181
Al-Li-Si Li8Al3Si5 Li8Al3Si5,cP16,215 P-43m 0.61147,0.61147,0.61147,90,90,90 - - 2.01 X 39097
Al-Li-Sn LiAl0.95 Sn0.05 NaTl,cF16,227 Fd-3m 0.63591,0.63591,0.63591,90,90,90 b.c.c. family - 1.99 X 14500
Al-Li-Sn Li5AlSn2 *,tP*,134 P42 /nnm 0.6525,0.6525,0.6499,90,90,90 - - - N 25960
Al-Li-Sr Li17.5 Sr9Al25.5 Li17.5 Sr9Al25.5 ,hP104,194 P63 /mmc 0.9638,0.9638,2.7586,90,90,120 - gray 2.39 X 31681
Al-Li-Te LiAlTe2 tet CuFeS2,tI16,122 I-42d 0.63517,0.63517,1.16904,90,90,90 adamantane structure gray pale 4.07 X 37204
Al-Li-Te LiAlTe2 trig CuScS2,hP4,156 P3m1 0.4481,0.4481,0.7096,90,90,120 - brown pale 3.89 X 37204
Al-Li-Zn Li13Zn11.4 Al15.6 Li13Cu6Ga21,cI160,204 Im-3 1.3966,1.3966,1.3966,90,90,90 - - 3.06 X 38676
Al-Li-Zn Li27Zn35.1 Al18.9 Mg32(Zn0.65 Al0.35)49,cI162,204 Im-3 1.393,1.393,1.393,90,90,90 Frank-Kasper phase - 3.68 A 2363
Al-Li-Zr Li0.14 ZrAl2.86 ZrAl3,tI16,139 I4/mmm 0.4009,0.4009,1.728,90,90,90 close-packed structure - 4.05 X 40133
Al-Li-Zr Li1.2 Zr4.8 Al3 ht Ti5Ga4,hP18,193 P63 /mcm 0.81757,0.81757,0.56909,90,90,120 AlB2 family - 5.31 X 40133
Al-Li-Zr Li2ZrAl Li2AgSb,cF16,216 F-43m 0.6633,0.6633,0.6633,90,90,90 b.c.c. family - 3.01 X 40133
Al-Lu-Mn LuMn6Al6 CeMn4Al8 ,tI26,139 I4/mmm 0.876,0.876,0.5057,90,90,90 CaCu5-Zr4Al3 - 5.70 A 13328
Al-Lu-Mo Lu6Mo4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0963,1.0963,1.7566,90,90,120 - - 4.71 A 29673
Al-Lu-Nb Lu6Nb4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1051,1.1051,1.7707,90,90,120 - - 4.58 A 30591
Al-Lu-Ni LuNiAl hp MgZn2,hP12,194 P63 /mmc 0.528,0.528,0.8491,90,90,120 Friauf-Laves phase - 8.45 A 20055
Al-Lu-Ni LuNiAl ZrNiAl,hP9,189 P-62m 0.69439,0.69439,0.3757,90,90,120 Fe2P family - 8.28 A 52229
Al-Lu-Ni LuNiAl2 MgCuAl2,oS16,63 Cmcm 0.4038,0.9875,0.69,90,90,90 - - 6.94 A 15107
Al-Lu-Ni LuNiAl4 YNiAl4,oS24,63 Cmcm 0.4023,1.497,0.663,90,90,90 - - 5.68 A 7363
Al-Lu-Ni LuNi0.45 Al1.55 MgCu2,cF24,227 Fd-3m 0.7641,0.7641,0.7641,90,90,90 Friauf-Laves phase - 7.24 X 15107
Al-Lu-Ni LuNi2Al3 YNi2Al3,hP18,191 P6/mmm 0.9,0.9,0.4032,90,90,120 - - 6.58 A 15107
Al-Lu-Ni LuNi3.2 Al1.8 CaCu5,hP6,191 P6/mmm 0.4954,0.4954,0.4022,90,90,120 - - 7.99 X 15107
Al-Lu-Ni Lu0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.41871,0.41871,0.90905,90,90,120 - - 4.77 A 59682
Al-Lu-Ni Lu2Ni2Al W2CoB2,oI10,71 Immm 0.4124,0.5263,0.8253,90,90,90 - - 9.17 X 11393
Al-Lu-Ni Lu2Ni3Al7 *,hP*,* - 1.785,1.785,0.4044,90,90,120 - - - N 15107
Al-Lu-Ni Lu3Ni5Al19 Gd3Ni5Al19 ,oS108,63 Cmcm 0.3924,1.54,2.654,90,90,90 - - 5.51 A 15107
Al-Lu-Ni Lu3Ni8Al Ce3Co8Si,hP24,194 P63 /mmc 0.4985,0.4985,1.594,90,90,120 Laves-CaCu5 - 9.89 X 11393
Al-Lu-O LuAlO3 GdFeO3,oP20,62 Pnma 0.533,0.7294,0.51,90,90,90 perovskite family colorless 8.37 A 11875
Al-Lu-O Lu3Al5O12 Y3 Al5O12,cI160,230 Ia-3d 1.19064,1.19064,1.19064,90,90,90 garnet family - 6.70 X 56472
Al-Lu-Pd LuPd5Al2 ZrNi2Al5,tI16,139 I4/mmm 0.40894,0.40894,1.4615,90,90,90 - - 10.34 X 51065
Al-Lu-Pt LuPtAl TiNiSi,oP12,62 Pnma 0.6719,0.4341,0.765,90,90,90 AlB2 family - 11.82 A 17109
Al-Lu-Pt Lu4Pt9Al24 Er4Pt9Al24 ,aP37,2 P-1 0.7456,0.7456,1.3039,84.511,78.98,60. - - 8.36 A 36571
Handbook of Inorganic Substances – Edition 2015 : Data 229

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Lu-Re LuRe 2Al10 LuRe2Al10,oS156,63 Cmcm 0.9282,1.0272,2.681,90,90,90 - - 6.37 X 35746


Al-Lu-Re Lu3.81 Re6Al30.51 Y3.64 Re6Al30.69 ,hP88,193 P63/mcm 1.3045,1.3045,0.9132,90,90,120 - - 6.43 X 33271
Al-Lu-Rh LuRhAl TiNiSi,oP12,62 Pnma 0.6732,0.4128,0.7879,90,90,90 AlB2 family - 9.25 X 43742
Al-Lu-Rh Lu2Rh3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3044,0.7532,0.9361,90,90,90 - - 6.51 A 43418
Al-Lu-Rh Lu4RhAl Gd4RhIn,cF96,216 F-43m 1.318,1.318,1.318,90,90,90 - gray dark 9.63 A 57034
Al-Lu-Sc Sc0.5 Lu0.5Al3 Cu3Au,cP4,221 Pm-3m 0.4121,0.4121,0.4121,90,90,90 close-packed structure - 4.53 X 52216
Al-Lu-Si LuAlSi YAlGe,oS12,63 Cmcm 0.3964,1.0034,0.5598,90,90,90 AlB2 family - 6.86 X 46656
Al-Lu-Si Lu2AlSi2 W2CoB2,oI10,71 Immm 0.4001,0.5662,0.8416,90,90,90 - gray 7.54 X 38143
Al-Lu-Sm Sm0.1 Lu0.9 Al3 Cu3Au,cP4,221 Pm-3m 0.42,0.42,0.42,90,90,90 close-packed structure - 5.68 X 7867
Al-Lu-Sm Sm0.5 Lu0.5 Al3 TiNi3,hP16,194 P63/mmc 0.6073,0.6073,0.9503,90,90,120 close-packed structure - 5.33 A 7867
Al-Lu-Sm Sm0.7 Lu0.3 Al3 rt Mg3 Cd,hP8,194 P63/mmc 0.633,0.633,0.4601,90,90,120 close-packed structure - 4.97 A 7867
Al-Lu-Ta Lu6Ta4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1043,1.1043,1.769,90,90,120 - - 5.22 A 30591
Al-Lu-Tb Tb0.3 Lu0.7 Al3 Cu3Au,cP4,221 Pm-3m 0.4206,0.4206,0.4206,90,90,90 close-packed structure - 5.60 X 7867
Al-Lu-Tb Tb0.41 Lu0.59 Al3 HoAl3,hR60,166 R-3m 0.6036,0.6036,3.573,90,90,120 close-packed structure - 5.51 A 7867
Al-Lu-Tb Tb0.45 Lu0.55 Al3 TiNi3,hP16,194 P63/mmc 0.6065,0.6065,0.9496,90,90,120 close-packed structure - 5.46 A 7867
Al-Lu-Tb Tb0.83 Lu0.17 Al3 BaPb3,hR36,166 R-3m 0.6155,0.6155,2.1132,90,90,120 close-packed structure - 5.23 A 7867
Al-Lu-Ti Lu6Ti4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1008,1.1008,1.7736,90,90,120 - - 4.29 A 30591
Al-Lu-V Lu6V4 Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0921,1.0921,1.7562,90,90,120 - - 4.42 A 30591
Al-Lu-W Lu6W4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0962,1.0962,1.7549,90,90,120 - - 5.36 A 29673
Al-Lu-Y Y0.25 Lu0.75 Al3 Cu3Au,cP4,221 Pm-3m 0.4201,0.4201,0.4201,90,90,90 close-packed structure - 5.25 X 7867
Al-Lu-Y Y0.37 Lu0.63 Al3 HoAl3,hR60,166 R-3m 0.6029,0.6029,3.572,90,90,120 close-packed structure - 4.96 A 7867
Al-Lu-Y Y0.4 Lu0.6 Al3 TiNi3,hP16,194 P63/mmc 0.6058,0.6058,0.9489,90,90,120 close-packed structure - 4.88 A 7867
Al-Lu-Y Y0.78 Lu0.22 Al3 ht BaPb3,hR36,166 R-3m 0.6167,0.6167,2.112,90,90,120 close-packed structure - 4.06 A 7867
Al-Lu-Yb Yb0.5 Lu0.5 Al2 MgCu2,cF24,227 Fd-3m 0.7785,0.7785,0.7785,90,90,90 Friauf-Laves phase - 6.42 X 18119
Al-Lu-Zn Zn5.58 LuAl2.42 Zn3(Zn0.4 Al0.6)5Ho,tI72,139 I4/mmm 0.85616,0.85616,1.63052,90,90,90 - - 6.73 X 47795
Al-Mg-Mn Mg3 Mn2Al18 Mg3 Cr2Al18,cF184,227 Fd-3m 1.4517,1.4517,1.4517,90,90,90 - gray silver 2.90 X 28448
Al-Mg-Mo Mg3 Mo2Al18 Mg3 Cr2Al18,cF184,227 Fd-3m 1.469,1.469,1.469,90,90,90 - - 3.15 A 22393
Al-Mg-Nd Mg0.2 NdAl0.8 rt CsCl,cP2,221 Pm-3m 0.3765,0.3765,0.3765,90,90,90 b.c.c. family - 5.31 X 21236
Al-Mg-Nd Mg0.88 Nd0.12Al2 MgZn2,hP12,194 P63/mmc 0.5526,0.5526,0.8922,90,90,120 Friauf-Laves phase - 2.61 X 21236
Al-Mg-Nd Mg0.9 NdAl1.1 ht MgCu2,cF24,227 Fd-3m 0.8093,0.8093,0.8093,90,90,90 Friauf-Laves phase - 4.91 X 21236
Al-Mg-Ni Mg0.3 NiAl0.7 CsCl,cP2,221 Pm-3m 0.29458,0.29458,0.29458,90,90,90 b.c.c. family - 5.51 X 50376
Al-Mg-Ni Mg0.95 Ni1.79 Al0.26 MgNi2,hP24,194 P63/mmc 0.49003,0.49003,1.59942,90,90,120 Friauf-Laves phase - 5.40 A 50376
Al-Mg-Ni Mg14.21 Ni1.45 Al13.34 Mg17 Al12,cI58,217 I-43m 1.05626,1.05626,1.05626,90,90,90 - - 2.23 A 50376
Al-Mg-Ni Mg3 Ni2Al Mn3 Ni2Si,cF96,227 Fd-3m 1.15474,1.15474,1.15474,90,90,90 - - 3.75 X 38861
Al-Mg-O MgAl2O4 hp CaV2O4,oP28,62 Pnma 0.86468,0.27901,0.99498,90,90,90 - - 3.94 X 48015
Al-Mg-O MgAl2O4 rt MgAl2O4,cF56,227 Fd-3m 0.80861,0.80861,0.80861,90,90,90 spinel colorless 3.58 X 43685
Al-Mg-O Mg0.97 Al0.03 O NaCl,cF8,225 Fm-3m 0.42016,0.42016,0.42016,90,90,90 rocksalt family - 3.62 X 2709
Al-Mg-O Mg2 Al2O5 hp Ca0.76 In2.84 S5,oP36,55 Pbam 0.9371,1.21952,0.27916,90,90,90 - - 3.80 X 52959
Al-Mg-O Mg2 Al4O8 Mo4 Al1.1 S8,cF56,216 F-43m 0.80858,0.80858,0.80858,90,90,90 spinel family - 3.58 X 16442
Al-Mg-Pr Mg0.6PrAl0.4 rt CsCl,cP2,221 Pm-3m 0.3836,0.3836,0.3836,90,90,90 b.c.c. family - 4.89 X 21238
Al-Mg-Pr Mg0.88Pr0.12 Al2 MgZn2,hP12,194 P63/mmc 0.55186,0.55186,0.892,90,90,120 Friauf-Laves phase - 2.61 A 21238
Al-Mg-Pr Mg1.4PrAl0.6 ht MgCu2,cF24,227 Fd-3m 0.884,0.884,0.884,90,90,90 Friauf-Laves phase - 3.68 X 21238
Al-Mg-Pt Mg3 Pt2Al Mn3 Ni2Si,cF96,227 Fd-3m 1.1802,1.1802,1.1802,90,90,90 - - 7.92 X 23187
Al-Mg-S MgAl2S4 orth MgAl2S4,oP28,62 Pnma 1.254,0.7253,0.592,90,90,90 - yellow 2.55 X 23034
Al-Mg-S MgAl2S4 rhom ZnIn2S4,hR21,160 R3m 0.36715,0.36715,3.61042,90,90,120 - white 2.44 A 379
Al-Mg-Sc Mg0.03 ScAl1.97 MgCu2,cF24,227 Fd-3m 0.7579,0.7579,0.7579,90,90,90 Friauf-Laves phase - 3.02 X 36714
Al-Mg-Sc Mg0.12 Sc2Al0.88 Co1.75 Ge,hP6,194 P63/mmc 0.4885,0.4885,0.6157,90,90,120 AlB2 family - 3.04 X 36714
Al-Mg-Sc Mg0.15 ScAl2.85 Cu3Au,cP4,221 Pm-3m 0.4116,0.4116,0.4116,90,90,90 close-packed structure - 2.99 X 36714
Al-Mg-Sc Mg0.2 ScAl0.8 CsCl,cP2,221 Pm-3m 0.34106,0.34106,0.34106,90,90,90 b.c.c. family - 2.99 X 52940
Al-Mg-Sc Mg17 Sc0.35 Al11.65 Mg17 Al12,cI58,217 I-43m 1.0574,1.0574,1.0574,90,90,90 - - 2.09 A 36714
Al-Mg-Se MgAl2Se4 MgAl2Se4,hR21,166 R-3m 0.388,0.388,3.834,90,90,120 - red 3.93 X 10252
Al-Mg-Se Mg2 Al2Se5 Mg2 Al2Se5,hP9,164 P-3m1 0.388,0.388,1.6,90,90,120 - golden 3.96 X 10252
Al-Mg-Se Mg5 Al2Se8 Mg5 Al2Se8,oP36,33 Pna21 1.33,0.632,0.772,90,90,90 - colorless 4.13 X 11108
Al-Mg-Si MgAlSi prec TiNiSi,oP12,62 Pnma 0.678,0.405,0.796,90,90,90 AlB2 family - 2.41 X 45370
Al-Mg-Si MgAl2Si2 Ce2SO2,hP5,164 P-3m1 0.405,0.405,0.674,90,90,120 - - 2.33 X 49221
Al-Mg-Si Mg1.55 Al0.45 Si ht-hp TiNiSi,oP12,62 Pnma 0.69242,0.4138,0.79618,90,90,90 AlB2 family - 2.27 X 58211
Al-Mg-Sr SrMg0.1 Al1.9 KHg2,oI12,74 Imma 0.48049,0.79167,0.79989,90,90,90 AlB2 family - 3.09 A 41713
Al-Mg-Sr SrMg1.04 Al0.96 MgNi2,hP24,194 P63/mmc 0.6194,0.6194,2.01576,90,90,120 Friauf-Laves phase gray silver 2.75 X 42995
Al-Mg-Sr SrMg1.40 Al0.60 MgZn2,hP12,194 P63/mmc 0.63699,0.63699,1.014,90,90,120 Friauf-Laves phase gray silver 2.57 X 42995
Al-Mg-Ta Mg3 Ta2 Al18 Mg3 Cr2Al18,cF184,227 Fd-3m 1.483,1.483,1.483,90,90,90 - - 3.75 A 22393
Al-Mg-Te MgAl2 Te4 *,aP*,* - 0.596,0.843,0.843,90.,90.,90. - red - N 9477
Al-Mg-Ti Mg3 Ti2Al18 Mg3 Cr2Al18,cF184,227 Fd-3m 1.477,1.477,1.477,90,90,90 - - 2.70 A 20219
Al-Mg-V Mg3 V2Al18 Mg3 Cr2Al18,cF184,227 Fd-3m 1.461,1.461,1.461,90,90,90 - - 2.81 A 20219
Al-Mg-W Mg3 W2Al18 Mg3 Cr2Al18,cF184,227 Fd-3m 1.468,1.468,1.468,90,90,90 - - 3.89 A 22393
Al-Mg-Y MgYAl ZrNiAl,hP9,189 P-62m 0.7345,0.7345,0.45913,90,90,120 Fe2P family - 3.26 X 50341
Al-Mg-Y Mg0.5 Y0.5 Al2 MgZn2,hP12,194 P63/mmc 0.533,0.533,0.857,90,90,120 Friauf-Laves phase - 3.48 X 13684
Al-Mg-Zn Mg0.02 Zn0.09 Al0.89 Cu,cF4,225 Fm-3m 0.40506,0.40506,0.40506,90,90,90 close-packed structure - 3.04 X 1728
Al-Mg-Zn Mg2 Zn3Al4 Mg2 Zn3Al4,hP18,194 P63/mmc 0.496,0.496,1.403,90,90,120 - - 3.92 X 57054
Al-Mg-Zn Mg21 Zn8.5 Al8.5 ht Mg21 (Zn0.5 Al0.5)17,oP152,57 Pbcm 0.898,1.699,1.934,90,90,90 - - 2.92 X 38369
Al-Mg-Zn Mg27 Zn47.3 Al10.7 Mg27 Zn47.3 Al10.7 ,cP704,205 Pa-3 2.30349,2.30349,2.30349,90,90,90 - - 4.39 X 47288
Al-Mg-Zn Mg32 Zn31.9 Al17.1 Mg32 (Zn0.65 Al0.35)49,cI162,204 Im-3 1.416,1.416,1.416,90,90,90 Frank-Kasper phase - 3.89 X 835
Al-Mg-Zn Mg4 Zn11Al m Mg4 Zn10(Zn0.5 Al0.5)2 ,hP19,187 P-6m2 0.496,0.496,1.402,90,90,120 - - 4.69 X 8261
Al-Mn-Mo Mo0.01Mn0.02 Al0.97 Cu,cF4,225 Fm-3m 0.4034,0.4034,0.4034,90,90,90 close-packed structure - 2.86 X 4825
Al-Mn-N Mn3 AlN CaTiO3,cP5,221 Pm-3m 0.38545,0.38545,0.38545,90,90,90 perovskite family - 5.97 X 55804
Al-Mn-Nb Nb0.8 Mn2Al0.2 MgZn2,hP12,194 P63/mmc 0.4909,0.4909,0.8,90,90,120 Friauf-Laves phase - 7.54 A 19107
Al-Mn-Nd NdMn0.3 Al1.7 MgCu2,cF24,227 Fd-3m 0.7976,0.7976,0.7976,90,90,90 Friauf-Laves phase - 5.41 X 20022
Al-Mn-Nd NdMn1.7 Al0.3 MgZn2,hP12,194 P63/mmc 0.56,0.56,0.908,90,90,120 Friauf-Laves phase - 6.62 A 20022
Al-Mn-Nd NdMn2Al10 CaCr2Al10,tP52,129 P4/nmm 1.2838,1.2838,0.5134,90,90,90 CaCu5-Zr4Al3 gray silver 4.11 A 35381
230 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Mn-Nd NdMn4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.89365,0.89365,0.51357,90,90,90 CaCu5-Zr4Al3 - 4.70 X 23593


Al-Mn-Nd Nd2Mn10Al7 Zn17Th2,hR57,166 R-3m 0.899,0.899,1.315,90,90,120 CaCu5-Zr4Al3 - 5.56 X 20022
Al-Mn-Ni MnNi2Al rt Cu2MnAl,cF16,225 Fm-3m 0.5824,0.5824,0.5824,90,90,90 b.c.c. family - 6.70 X 14341
Al-Mn-Ni Mn0.4 Ni3Al0.6 Cu3Au,cP4,221 Pm-3m 0.3573,0.3573,0.3573,90,90,90 close-packed structure - 7.80 X 55186
Al-Mn-Ni Mn0.40 Ni0.50 Al0.10 Cu,cF4,225 Fm-3m 0.3636,0.3636,0.3636,90,90,90 close-packed structure - 7.47 X 52833
Al-Mn-Ni Mn0.42 Ni1.14 Al0.44 rt CuAu,tP2,123 P4/mmm 0.27153,0.27153,0.329,90,90,90 close-packed structure - 6.97 X 56571
Al-Mn-Ni Mn0.8 Ni0.3 Al0.9 ht CsCl,cP2,221 Pm-3m 0.2963,0.2963,0.2963,90,90,90 b.c.c. family - 5.48 X 55197
Al-Mn-Ni Mn11Ni4Al62 Mn11Ni4Al60,oS156,63 Cmcm 0.755,2.38,1.25,90,90,90 - - 3.71 X 566
Al-Mn-O MnAl2O4 MgAl2O4,cF56,227 Fd-3m 0.82104,0.82104,0.82104,90,90,90 galaxite yellow 4.15 X 48018
Al-Mn-O Mn1.5 Al1.5 O4 MgAl2O4,cF56,227 Fd-3m 0.8285,0.8285,0.8285,90,90,90 spinel family - 4.37 X 55055
Al-Mn-O Mn1.8 Al0.2 O3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 0.94,0.94,0.94,90,90,90 - - 4.87 A 3127
Al-Mn-O Mn2.5Al0.5 O4 Mn3O4,tI28,141 I41/amd 0.5721,0.5721,0.9475,90,90,90 - - 4.60 A 55055
Al-Mn-Pd MnPd2Al rt Cu2MnAl,cF16,225 Fm-3m 0.6182,0.6182,0.6182,90,90,90 b.c.c. family - 8.29 X 14527
Al-Mn-Pd Mn0.04Pd0.22Al0.74 *,o**,* - 1.23,1.65,2.35,90,90,90 - - - N 35915
Al-Mn-Pd Mn0.5PdAl0.5 ht CsCl,cP2,221 Pm-3m 0.3083,0.3083,0.3083,90,90,90 b.c.c. family - 8.35 X 4078
Al-Mn-Pd Mn2.85Pd15.59 Al51.15 Mn2.85Pd15.59 Al51.15 ,oP320,62 Pnma 2.3541,1.6566,1.2339,90,90,90 - - 4.41 X 32241
Al-Mn-Pd Mn31.3Pd124.6 Al357.1 Mn31.3Pd124.6 Al357.1 ,cP597,200 Pm-3 2.0211,2.0211,2.0211,90,90,90 - - 4.95 X 35264
Al-Mn-Pd Mn9.55Pd1.25 Al28.20 Mn6(Mn0.5 Al0.5)8Al25,oP156,62 Pnma 1.4717,1.251,1.2594,90,90,90 - - 4.06 X 33662
Al-Mn-Pr PrMn0.3Al1.7 MgCu2,cF24,227 Fd-3m 0.7999,0.7999,0.7999,90,90,90 Friauf-Laves phase - 5.28 X 3595
Al-Mn-Pr PrMn2Al10 CaCr2Al10 ,tP52,129 P4/nmm 1.2857,1.2857,0.514,90,90,90 CaCu5-Zr4Al3 gray silver 4.07 A 35381
Al-Mn-Pr PrMn4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.89617,0.89617,0.51459,90,90,90 CaCu5-Zr4Al3 - 4.63 X 23593
Al-Mn-Pr Pr1.42 Mn8.5 Al8.5 Zn17Th2,hR57,166 R-3m 0.9005,0.9005,1.313,90,90,120 CaCu5-Zr4Al3 - 4.84 A 13328
Al-Mn-Pt MnPtAl BeZrSi,hP6,194 P63 /mmc 0.43255,0.43255,0.54965,90,90,120 AlB2 family - 10.33 X 31916
Al-Mn-Pt MnPt2Al rt Cu2MnAl,cF16,225 Fm-3m 0.6253,0.6253,0.6253,90,90,90 b.c.c. family - 12.83 X 14527
Al-Mn-Pu PuMnAl MgZn2,hP12,194 P63 /mmc 0.5346,0.5346,0.8671,90,90,120 Friauf-Laves phase - 10.09 A 8280
Al-Mn-Rh MnRh2Al Cu2MnAl,cF16,225 Fm-3m 0.6022,0.6022,0.6022,90,90,90 b.c.c. family - 8.75 X 6860
Al-Mn-Rh Mn0.5 RhAl0.5 CsCl,cP2,221 Pm-3m 0.30025,0.30025,0.30025,90,90,90 b.c.c. family - 8.83 X 10094
Al-Mn-S MnAl2S4 rt ZnIn2S4,hR21,160 R3m 0.37013,0.37013,3.6416,90,90,120 - golden 2.73 X 55972
Al-Mn-S Mn0.5 Al2S3.5 hp MgAl2O4,cF56,227 Fd-3m 1.0048,1.0048,1.0048,90,90,90 spinel family orange 2.54 A 6119
Al-Mn-S Mn1.00 Al1.04 S1.84 *,mP*,11 P121/m1 1.1112,1.049,2.3224,90,92.83,90 - yellow - N 17160
Al-Mn-Sc ScMn4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.87734,0.87734,0.50629,90,90,90 CaCu5-Zr4Al3 - 4.10 X 43110
Al-Mn-Se Mn1.04 Al1.00 Se1.77 *,cF*,225 Fm-3m 0.6273,0.6273,0.6273,90,90,90 - gray silver - N 17160
Al-Mn-Si MnAl0.05 Si0.95 rt FeSi,cP8,198 P213 0.4573,0.4573,0.4573,90,90,90 - - 5.76 A 15543
Al-Mn-Si MnAl0.75 Si1.25 CrSi2,hP9,180 P6222 0.4475,0.4475,0.6427,90,90,120 - - 4.93 X 2300
Al-Mn-Si MnAl1.3 Si0.7 TiSi2,oF24,70 Fddd 0.457,0.7889,0.8506,90,90,90 - - 4.75 X 2300
Al-Mn-Si MnAl2.5 Si2.5 PdGa5,tI24,140 I4/mcm 0.6087,0.6087,0.9529,90,90,90 - - 3.62 A 4699
Al-Mn-Si MnAl3Si2 *,tP48,85 P4/n 1.231,1.231,0.491,90,90,90 - - - N 4699
Al-Mn-Si Mn0.44 Al0.44 Si0.12 ht4 W,cI2,229 Im-3m 0.308,0.308,0.308,90,90,90 b.c.c. family - 4.48 X 15543
Al-Mn-Si Mn0.55 Al0.375 Si0.075 Mg,hP2,194 P63 /mmc 0.2753,0.2753,0.4415,90,90,120 close-packed structure - 4.86 X 15543
Al-Mn-Si Mn0.68 Al0.19 Si0.13 ht1 Mn,cP20,213 P4132 0.638,0.638,0.638,90,90,90 - - 5.90 A 15543
Al-Mn-Si Mn11Al0.8 Si18.2 Mn11Si19,tP120,118 P-4n2 0.5558,0.5558,4.8149,90,90,90 chimney-ladder structure - 5.08 A 15543
Al-Mn-Si Mn2Al2Si3 Mn2Al2Si3 ,hP21,174 P-6 0.96121,0.96121,0.3564,90,90,120 - - 4.33 X 40169
Al-Mn-Si Mn20Al76Si4 *,cP*,* - 0.4597,0.4597,0.4597,90,90,90 - - - N 23257
Al-Mn-Si Mn3Al3Si4 *,hP10,180 P6222 0.4483,0.4483,0.6451,90,90,120 - - - N 15543
Al-Mn-Si Mn3Al8Si9 *,hP100,194 P63 /mmc 0.5631,0.5631,4.9334,90,90,120 - - - N 15543
Al-Mn-Si Mn3Al9Si Mn3Al9Si,hP26,194 P63 /mmc 0.7513,0.7513,0.7745,90,90,120 - - 3.82 X 420
Al-Mn-Si Mn4Al16Si3 Mn4Al14(Al0.5 Si0.5 )4Si,cP138,200 Pm-3 1.2643,1.2643,1.2643,90,90,90 - gray 3.63 X 34071
Al-Mn-Si Mn4Al9Si3 (Cu0.5 Al0.5 )3(Mo0.67 ...,hP32,194 P63 /mmc 0.7625,0.7625,0.8258,90,90,120 - - 4.37 A 15543
Al-Mn-Si Mn5Al0.26 Si2.74 Mn5Si3,hP16,193 P63 /mcm 0.6949,0.6949,0.4818,90,90,120 - - 5.91 A 15543
Al-Mn-Sm SmMn2Al10 CaCr2Al10 ,tP52,129 P4/nmm 1.2811,1.2811,0.513,90,90,90 CaCu5-Zr4Al3 gray silver 4.18 A 35381
Al-Mn-Sm SmMn4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.8902,0.8902,0.512,90,90,90 CaCu5-Zr4Al3 - 4.80 A 12492
Al-Mn-Sm Sm1.42Mn8.5 Al8.5 Zn17Th2,hR57,166 R-3m 0.8951,0.8951,1.309,90,90,120 CaCu5-Zr4Al3 - 4.99 A 13328
Al-Mn-Ta Ta0.8 Mn2Al0.2 MgZn2,hP12,194 P63 /mmc 0.4902,0.4902,0.8023,90,90,120 Friauf-Laves phase - 10.35 A 18051
Al-Mn-Tb TbMn1.2 Al0.8 MgCu2,cF24,227 Fd-3m 0.778,0.778,0.778,90,90,90 Friauf-Laves phase - 6.95 X 30470
Al-Mn-Tb TbMn2Al9.63 CaCr2Al10 ,tP52,129 P4/nmm 1.2743,1.2743,0.5114,90,90,90 CaCu5-Zr4Al3 gray silver 4.23 X 35381
Al-Mn-Tb TbMn4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.8868,0.8868,0.51029,90,90,90 CaCu5-Zr4Al3 - 4.92 X 23593
Al-Mn-Tb Tb2Mn10.2 Al6.8 Zn17Th2,hR57,166 R-3m 0.88543,0.88543,1.29767,90,90,120 CaCu5-Zr4Al3 - 6.00 X 38955
Al-Mn-Tb Tb2Mn13.2 Al3.8 Th2Ni17,hP38,194 P63 /mmc 0.874,0.874,0.8612,90,90,120 CaCu5-Zr4Al3 - 6.68 A 39406
Al-Mn-Te MnAl2 Te4 Cu2HgI4,tI14,121 I-42m 0.6017,0.6017,1.2203,90,90,90 - - 4.66 A 25297
Al-Mn-Te Mn1.00 Al1.02 Te2.18 *,mP*,10 P12/m1 0.8349,0.826,1.0808,90,95.53,90 - gray silver - N 17160
Al-Mn-Th ThMnAl MgCu2,cF24,227 Fd-3m 0.796,0.796,0.796,90,90,90 Friauf-Laves phase - 8.27 X 2275
Al-Mn-Th ThMn3Al2 PrNi2Al3,hP6,191 P6/mmm 0.516,0.516,0.4148,90,90,120 - - 7.83 X 12437
Al-Mn-Th ThMn4Al8 CeMn4Al8 ,tI26,139 I4/mmm 0.8963,0.8963,0.515,90,90,90 CaCu5-Zr4Al3 - 5.36 A 20256
Al-Mn-Ti TiMn1.62 Al0.38 MgZn2,hP12,194 P63 /mmc 0.49004,0.49004,0.79761,90,90,120 Friauf-Laves phase - 5.89 X 50355
Al-Mn-Ti Ti0.9 Mn3.8 Al8.3 *,c**,* - 0.9047,0.9047,0.9047,90,90,90 - - - N 25209
Al-Mn-Ti Ti0.934 Mn0.066 Al CuAu,tP2,123 P4/mmm 0.28217,0.28217,0.4057,90,90,90 close-packed structure - 3.87 X 23955
Al-Mn-Ti Ti1.03 Mn0.30 Al2.67 Cu3Au,cP4,221 Pm-3m 0.3962,0.3962,0.3962,90,90,90 close-packed structure - 3.68 X 29836
Al-Mn-Ti Ti7.25 Mn7.25 Al14.5 Mg6Cu16Si7,cF116,225 Fm-3m 1.189,1.189,1.189,90,90,90 - - 4.49 A 22851
Al-Mn-Tm TmMn6 Al6 CeMn4Al8 ,tI26,139 I4/mmm 0.8765,0.8765,0.506,90,90,90 CaCu5-Zr4Al3 - 5.64 A 13328
Al-Mn-Tm Tm6Mn4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.0752,1.0752,1.7491,90,90,120 - - 4.54 A 34455
Al-Mn-U UMnAl MgZn2,hP12,194 P63 /mmc 0.5251,0.5251,0.8408,90,90,120 Friauf-Laves phase - 10.59 X 2426
Al-Mn-U UMn0.38 Al1.62 MgCu2,cF24,227 Fd-3m 0.754,0.754,0.754,90,90,90 Friauf-Laves phase - 9.38 X 2427
Al-Mn-U UMn1.2 Al0.8 rt MgCu2,cF24,227 Fd-3m 0.742,0.742,0.742,90,90,90 Friauf-Laves phase - 10.59 X 19623
Al-Mn-U UMn2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4326,1.4326,1.4326,90,90,90 - - 4.01 X 55274
Al-Mn-U UMn5Al7 CeMn4Al8 ,tI26,139 I4/mmm 0.8787,0.8787,0.5085,90,90,90 CaCu5-Zr4Al3 - 5.93 X 30239
Al-Mn-V VMn2 Al cub1 Cu2MnAl,cF16,225 Fm-3m 0.5932,0.5932,0.5932,90,90,90 b.c.c. family - 5.98 X 14341
Al-Mn-V V0.5 MnAl0.5 CsCl,cP2,221 Pm-3m 0.2937,0.2937,0.2937,90,90,90 b.c.c. family - 6.15 X 14455
Al-Mn-V V1.02 Mn2.07 Al0.91 cub2 BiF3,cF16,225 Fm-3m 0.5875,0.5875,0.5875,90,90,90 b.c.c. family - 6.23 X 16212
Handbook of Inorganic Substances – Edition 2015 : Data 231

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Mn-Y YMn1.74 Al0.26 MgCu2,cF24,227 Fd-3m 0.7765,0.7765,0.7765,90,90,90 Friauf-Laves phase - 5.43 X 20284
Al-Mn-Y YMn2 Al10 CaCr2Al10,tP52,129 P4/nmm 1.2738,1.2738,0.5124,90,90,90 CaCu5-Zr4Al3 gray silver 3.74 A 35381
Al-Mn-Y YMn6 Al6 CeMn4Al8,tI26,139 I4/mmm 0.8796,0.8796,0.5079,90,90,90 CaCu5-Zr4Al3 - 4.91 A 13328
Al-Mn-Yb YbMn2.06 Al9.94 CaCr2Al10,tP52,129 P4/nmm 1.2776,1.2776,0.51168,90,90,90 CaCu5-Zr4Al3 gray silver 4.41 X 58961
Al-Mn-Yb YbMn3.52 Al8.48 CeMn4Al8,tI26,139 I4/mmm 0.883,0.883,0.51,90,90,90 CaCu5-Zr4Al3 - 4.97 X 30187
Al-Mn-Yb Yb6Mn4 Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0791,1.0791,1.7609,90,90,120 - - 4.52 A 34455
Al-Mn-Zn ZnMn5Al24 *,oS*,* - 2.48,2.51,3.03,90,90,90 - - - N 454
Al-Mn-Zn Zn0.3 Mn3.7 Al11 rt Mn4 Al11,aP15,2 P-1 0.5047,0.5092,0.8862,74.67,85.32,79.6 - - 4.00 X 934
Al-Mn-Zn Zn5.8 Mn6.4 Al25.8 Zn5.8 Mn6.4 Al25.8 ,oS152,63 Cmcm 0.778,2.38,1.26,90,90,90 - - 4.06 X 1399
Al-Mn-Zr ZrMnAl MgZn2,hP12,194 P63/mmc 0.525,0.525,0.8479,90,90,120 Friauf-Laves phase - 5.68 A 8280
Al-Mn-Zr ZrMn1.62 Al0.38 MgZn2,hP12,194 P63/mmc 0.51102,0.51102,0.83426,90,90,120 Friauf-Laves phase - 6.71 X 28368
Al-Mn-Zr ZrMn6Al6 ThMn12,tI26,139 I4/mmm 0.867,0.867,0.501,90,90,90 CaCu5-Zr4Al3 - 5.14 A 4605
Al-Mo-N Mo0.94 Al0.06 N NaCl,cF8,225 Fm-3m 0.416,0.416,0.416,90,90,90 rocksalt family - 9.76 X 53097
Al-Mo-Nb Nb0.35 Mo0.325 Al0.325 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9706,0.9706,0.5057,90,90,90 Frank-Kasper phase - 7.58 A 4314
Al-Mo-Nb Nb0.5 Mo0.5 Al3 TiAl3,tI8,139 I4/mmm 0.3841,0.3841,0.8521,90,90,90 close-packed structure - 4.63 X 4314
Al-Mo-Nb Nb1.5 Mo1.5 Al Cr3Si,cP8,223 Pm-3n 0.506,0.506,0.506,90,90,90 Frank-Kasper phase - 7.95 X 4314
Al-Mo-Nd NdMo 2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4594,1.4594,1.4594,90,90,90 - - 3.74 A 30512
Al-Mo-Nd Nd6 Mo4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1053,1.1053,1.7899,90,90,120 - - 4.23 A 29673
Al-Mo-Ni MoNi0.2 Al2.8 TiAl3,tI8,139 I4/mmm 0.3761,0.3761,0.8412,90,90,90 close-packed structure - 5.11 X 40143
Al-Mo-Ni Mo0.059 Ni0.796 Al0.145 Cu,cF4,225 Fm-3m 0.36,0.36,0.36,90,90,90 close-packed structure - 8.02 X 31719
Al-Mo-Ni Mo0.08 Ni3Al0.92 Cu3Au,cP4,221 Pm-3m 0.3575,0.3575,0.3575,90,90,90 close-packed structure - 7.58 X 17833
Al-Mo-Ni Mo11 Ni14Al75 *,oP*,* - 0.8519,1.0054,1.5288,90,90,90 - - - N 40143
Al-Mo-Ni Mo2 Ni3.67 Al16.33 Mo2 Ni3(Ni0.67 Al0.33)Al16,oP100,55 Pbam 1.00664,1.53108,0.85205,90,90,90 - - 4.29 X 58175
Al-Mo-Ni Mo3 Ni0.24 Al0.76 Cr3Si,cP8,223 Pm-3n 0.4876,0.4876,0.4876,90,90,90 Frank-Kasper phase - 9.24 X 4917
Al-Mo-Ni Mo7 Ni6.72 Al0.28 Mo3(Mo0.8 Ni0.2)5Ni6 ,oP56,19 P212121 0.8848,0.9098,0.9098,90,90,90 Frank-Kasper phase - 9.74 A 4917
Al-Mo-O Al2[MoO4]3 ht Sc2[WO4]3,oP68,60 Pbcn 1.25547,0.90214,0.91035,90,90,90 - white 3.44 X 30776
Al-Mo-O Al2[MoO4]3 rt Fe2[MoO4]3,mP136,14 P121/c1 1.54249,0.90443,1.53803,90,109.003,90 - - 3.50 X 21547
Al-Mo-O Al2[MoO4]3 *,oP170,60 Pbcn 0.905,1.79,1.54,90,90,90 - - - N 18446
Al-Mo-P MoAlP CrSi2,hP9,180 P6222 0.476,0.476,0.664,90,90,120 - - 5.88 A 1835
Al-Mo-Pd MoPd1.933 Al8.067 MoPd(Pd0.97 Al0.03 )2Al8,oP44,57 Pbcm 0.78153,1.02643,0.86098,90,90,90 - - 4.99 X 58049
Al-Mo-Pd MoPd2Al Cu2MnAl,cF16,225 Fm-3m 0.627,0.627,0.627,90,90,90 b.c.c. family - 9.05 X 53513
Al-Mo-Pr PrMo 2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4601,1.4601,1.4601,90,90,90 - - 3.72 A 30512
Al-Mo-S Mo3 Al1.5 S4 rt Mo3 Ni1.25 S4,hR78,148 R-3 0.968,0.968,1.002,90,90,120 Chevrel phase black 5.59 A 13419
Al-Mo-S Mo4 AlS8 lt Mo4 GaS8,hR39,160 R3m 0.68887,0.68887,1.67314,90,90,120 - - 4.83 X 26909
Al-Mo-S Mo4 AlS8 rt Mo4 GaS8,cF52,216 F-43m 0.97289,0.97289,0.97289,90,90,90 - - 4.81 X 26909
Al-Mo-Se MoAl0.75 Se2 Cu0.65 NbS2,hP10,194 P63/mmc 0.329,0.329,1.2924,90,90,120 - - 7.51 X 19544
Al-Mo-Si MoAlSi hex CrSi2,hP9,180 P6222 0.4719,0.4719,0.6569,90,90,120 - - 5.94 A 1712
Al-Mo-Si MoAlSi tet MoSi2,tI6,139 I4/mmm 0.3205,0.3205,0.7863,90,90,90 b.c.c. family - 6.21 A 1712
Al-Mo-Si MoAl1.3 Si0.7 TiSi2,oF24,70 Fddd 0.4793,0.8256,0.8776,90,90,90 - - 5.76 A 1482
Al-Mo-Si MoAl4Si *,oF*,43 Fdd2 0.916,7.4,0.494,90,90,90 - - - N 17565
Al-Mo-Si Mo3 Al0.77 Si0.23 Cr3Si,cP8,223 Pm-3n 0.4933,0.4933,0.4933,90,90,90 Frank-Kasper phase - 8.72 X 1712
Al-Mo-Sm SmMo 2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4597,1.4597,1.4597,90,90,90 - - 3.77 A 30512
Al-Mo-Sm Sm6 Mo4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1027,1.1027,1.7838,90,90,120 - - 4.33 A 29673
Al-Mo-Tb Tb6Mo 4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0994,1.0994,1.7723,90,90,120 - - 4.47 A 29673
Al-Mo-Th ThMo 1.69 Al20 CeCr2Al20,cF184,227 Fd-3m 1.46117,1.46117,1.46117,90,90,90 - - 3.98 X 45626
Al-Mo-Th Th6Mo 4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1085,1.1085,1.8087,90,90,120 - - 5.07 A 29673
Al-Mo-Ti TiMo 0.4 Al2.6 TiAl3,tI8,139 I4/mmm 0.3871,0.3871,0.8313,90,90,90 close-packed structure - 4.17 X 5600
Al-Mo-Ti TiMo 0.5 Al0.5 CsCl,cP2,221 Pm-3m 0.31838,0.31838,0.31838,90,90,90 b.c.c. family - 5.63 X 49288
Al-Mo-Ti Ti0.25 Mo0.33 Al0.42 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9651,0.9651,0.5018,90,90,90 Frank-Kasper phase - 5.86 A 5600
Al-Mo-Ti Ti0.36 Mo0.10 Al0.54 m Cu,cF4,225 Fm-3m 0.4017,0.4017,0.4017,90,90,90 close-packed structure - 4.24 X 28469
Al-Mo-Ti Ti0.6 Mo0.2 Al0.2 W,cI2,229 Im-3m 0.3203,0.3203,0.3203,90,90,90 b.c.c. family - 5.39 X 21237
Al-Mo-Tm Tm6 Mo4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0964,1.0964,1.7597,90,90,120 - - 4.64 A 29673
Al-Mo-U UMo 1.27 Al20.73 CeCr2Al20,cF184,227 Fd-3m 1.4495,1.4495,1.4495,90,90,90 - black 4.01 X 52769
Al-Mo-U U6Mo7Al40 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0955,1.0955,1.7655,90,90,120 - black 5.75 X 52769
Al-Mo-Y Y6Mo 4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.099,1.099,1.7708,90,90,120 - - 3.72 A 29673
Al-Mo-Yb YbMo 2Al4 YbMo 2Al4,tI14,139 I4/mmm 0.6717,0.6717,0.5312,90,90,90 - - 6.55 X 9904
Al-Mo-Yb Yb6Mo 4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.10034,1.10034,1.76903,90,90,120 - - 4.62 X 59675
Al-Mo-Zr ZrMoAl MgZn2,hP12,194 P63/mmc 0.5315,0.5315,0.8701,90,90,120 Friauf-Laves phase - 6.68 A 5600
Al-Mo-Zr Zr0.165 Mo0.67 Al0.165 W,cI2,229 Im-3m 0.3179,0.3179,0.3179,90,90,90 b.c.c. family - 8.66 X 17134
Al-Mo-Zr Zr0.5Mo0.5 Al3 TiAl3,tI8,139 I4/mmm 0.3866,0.3866,0.8673,90,90,90 close-packed structure - 4.47 X 5600
Al-Mo-Zr Zr0.5Mo2Al0.5 lt MgZn2,hP12,194 P63/mmc 0.5335,0.5335,0.8784,90,90,120 Friauf-Laves phase - 7.70 A 17134
Al-Mo-Zr Zr0.9Mo2Al0.1 MgCu2,cF24,227 Fd-3m 0.7592,0.7592,0.7592,90,90,90 Friauf-Laves phase - 8.40 X 17134
Al-N-Nb Nb3 Al2N Mo3 Al2C,cP24,213 P4132 0.70314,0.70314,0.70314,90,90,90 - - 6.62 A 18499
Al-N-Nd Nd3 AlN0.8 CaTiO3,cP5,221 Pm-3m 0.5129,0.5129,0.5129,90,90,90 perovskite family - 5.80 X 18040
Al-N-O Al10 N8O3 20H *,hP42,186 P63mc 0.309,0.309,5.31,90,90,120 - - 3.25 N 12144
Al-N-O Al12 N10O3 24H *,hP50,* - 0.31,0.31,6.54,90,90,120 - - - N 43066
Al-N-O Al13 N11O3 39R *,hR81,* - 0.31,0.31,10.2,90,90,120 - - 3.24 N 43066
Al-N-O Al2.68 N0.04 O3.96 *,o**,* - 0.7943,0.7962,1.171,90,90,90 - - - N 1646
Al-N-O Al2.685 N0.055 O3.95 *,t**,* - 0.7943,0.7943,1.172,90,90,90 - - - N 1646
Al-N-O Al2.81 N0.44 O3.56 Fe3O4,cF56,227 Fd-3m 0.79435,0.79435,0.79435,90,90,90 spinel family - 3.68 X 27605
Al-N-O Al6N4O3 12H *,hP26,* - 0.31,0.31,3.3324,90,90,120 - - - N 43066
Al-N-O Al7N5O3 21R *,hR45,* - 0.31,0.31,5.726,90,90,120 - - - N 43066
Al-N-O Al8N6O3 16H *,hP34,* - 0.31,0.31,4.3072,90,90,120 - - - N 43066
Al-N-O Al9N7O3 27R *,hR57,* - 0.31,0.31,7.205,90,90,120 - - - N 43066
Al-N-O [NO]Al11O17 *,hP60,194 P63/mmc 0.5597,0.5597,2.2711,90,90,120 - - 3.23 N 4632
Al-N-Pr Pr3AlN0.8 CaTiO3,cP5,221 Pm-3m 0.4977,0.4977,0.4977,90,90,90 perovskite family - 6.21 X 18040
Al-N-Sc Sc3AlN0.8 CaTiO3,cP5,221 Pm-3m 0.4435,0.4435,0.4435,90,90,90 perovskite family - 3.29 X 18499
Al-N-Sm Sm3 AlN0.8 CaTiO3,cP5,221 Pm-3m 0.48619,0.48619,0.48619,90,90,90 perovskite family - 7.07 X 18040
232 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-N-Sr Sr3Al2N4 Sr3Al2N4,oP36,52 Pnna 0.5901,1.0005,0.958,90,90,90 - colorless 4.38 X 29721


Al-N-Ti Ti0.32 Al0.68 N ZnO,hP4,186 P63 mc 0.321,0.321,0.514,90,90,120 adamantane structure - 3.45 A 50687
Al-N-Ti Ti0.5 Al0.5 N NaCl,cF8,225 Fm-3m 0.419,0.419,0.419,90,90,90 rocksalt family - 4.65 X 20366
Al-N-Ti Ti2AlN Cr2AlC,hP8,194 P63 /mmc 0.29903,0.29903,1.36134,90,90,120 - - 4.31 X 56468
Al-N-Ti Ti3AlN CaTiO3,cP5,221 Pm-3m 0.4112,0.4112,0.4112,90,90,90 perovskite family - 4.41 X 17242
Al-N-Ti Ti3Al2N2 Ti3Al2N2,hP22,186 P63 mc 0.29875,0.29875,2.335,90,90,120 - - 4.15 X 17242
Al-N-Ti Ti4AlN2.89 CsYb3Se4,hP16,194 P63 /mmc 0.2988,0.2988,2.3372,90,90,120 - gray 4.76 X 37858
Al-N-Zr Zr3AlN Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.3369,1.1498,0.89825,90,90,90 - - 6.01 X 19740
Al-N-Zr Zr5Al3N0.89 CuHf5Sn3,hP18,193 P63 /mcm 0.817,0.817,0.56554,90,90,120 AlB2 family - 5.58 A 16233
Al-Na-O NaAlO2 ht NaFeO2,oP16,33 Pna21 0.53871,0.7032,0.5218,90,90,90 adamantane structure - 2.75 X 30542
Al-Na-O NaAlO2 ht-hp NaFeO2,hR12,166 R-3m 0.2868,0.2868,1.588,90,90,120 rocksalt family - 3.61 X 4035
Al-Na-O NaAlO2 rt LiAlO2,tP16,92 P41212 0.5325,0.5325,0.7058,90,90,90 - - 2.72 A 1421
Al-Na-O NaAl11O17 NaAl11O17 ,hP58,194 P63 /mmc 0.55962,0.55962,2.2526,90,90,120 diaoyudaoite - 3.22 X 4339
Al-Na-O NaAl5O8 *,hR*,166 R-3m 0.56012,0.56012,3.3898,90,90,120 - - - N 23028
Al-Na-O Na0.5 Al3O4.75 Na0.5 Al3O4.75 ,oP24,55 Pbam 0.764,0.764,0.2937,90,90,90 - - 3.26 X 26023
Al-Na-O Na14Al4O13 Na14Al4O13 ,mP62,14 P121/c1 0.5974,2.704,0.5969,90,119.717,90 - colorless 2.53 X 16704
Al-Na-O Na17Al5O16 Na17Al5O16 ,mS76,8 C1m1 0.5961,3.2769,0.59687,90,119.732,90 - white 2.56 X 17082
Al-Na-O Na5AlO4 Na5GaO4,oP80,61 Pbca 0.5894,1.787,1.0095,90,90,90 - - 2.57 X 17082
Al-Na-O Na7Al3O8 Na7Al3O8,aP36,2 P-1 0.5851,0.7972,1.1272,69.43,89.71,71.01 - - 2.66 X 17082
Al-Na-P Na3AlP 2 Na3AlAs2,oI24,72 Ibam 0.6773,1.3194,0.6077,90,90,90 - orange 1.93 X 31183
Al-Na-S Na3AlS3 ht Na3AlS3,mP56,14 P121/c1 1.3706,1.2071,0.7608,90,98.6,90 - colorless 2.05 X 25642
Al-Na-S Na3AlS3 rt Na3FeS3,mP28,14 P121/c1 0.7191,0.6897,1.45806,90,119.43,90 - - 2.03 A 20511
Al-Na-Sb Na2Al2Sb3 Na2Al2Sb3 ,mP56,14 P121/c1 1.41,0.722,1.544,90,90.3,90 - - 3.93 X 17471
Al-Na-Sb Na7Al2Sb5 Na7Al2Sb5 ,mP28,11 P121/m1 0.772,1.359,0.819,90,118.,90 - - 3.61 X 17624
Al-Na-Se NaAlSe2 mon TlGaSe2,mS64,15 C12/c1 1.072,1.0708,1.4126,90,100.9,90 - colorless 3.47 X 25647
Al-Na-Se NaAlSe2 tet TlGaTe2,tI16,140 I4/mcm 0.776,0.776,0.616,90,90,90 - yellow 3.72 X 10292
Al-Na-Se Na3AlSe3 Na3FeS3,mP28,14 P121/c1 0.7499,0.7203,1.52199,90,119.888,90 - colorless 3.10 X 25632
Al-Na-Si NaAlSi PbClF,tP6,129 P4/nmm 0.4135,0.4135,0.7379,90,90,90 - gray dark 2.05 X 12884
Al-Na-Te NaAlTe2 TlGaTe2,tI16,140 I4/mcm 0.831,0.831,0.671,90,90,90 - red 4.37 X 10292
Al-Na-Te Na3AlTe3 Na3FeS3,mP28,14 P121/c1 0.8062,0.7756,1.62924,90,120.028,90 - black 3.61 X 25631
Al-Nb-Nd NdNb2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4754,1.4754,1.4754,90,90,90 - - 3.60 A 34455
Al-Nb-Nd Nd6Nb4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1157,1.1157,1.8029,90,90,120 - - 4.10 A 30591
Al-Nb-Ni NbNi0.5 Al2.5 Cu3Au,cP4,221 Pm-3m 0.403,0.403,0.403,90,90,90 close-packed structure - 4.81 X 2320
Al-Nb-Ni NbNi1.08 Al0.92 MgZn2,hP12,194 P63 /mmc 0.49481,0.49481,0.79878,90,90,120 Friauf-Laves phase - 7.10 X 51922
Al-Nb-Ni NbNi2Al Cu2MnAl,cF16,225 Fm-3m 0.59779,0.59779,0.59779,90,90,90 b.c.c. family - 7.38 X 51922
Al-Nb-Ni Nb0.20 Ni3Al0.80 rt Cu3Au,cP4,221 Pm-3m 0.3593,0.3593,0.3593,90,90,90 close-packed structure - 7.74 X 17833
Al-Nb-Ni Nb0.63 Ni0.05 Al0.32 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.988,0.988,0.516,90,90,90 Frank-Kasper phase - 6.93 A 4314
Al-Nb-Ni Nb6Ni7Al17 Ti6Ni7Al17 ,cF144,225 Fm-3m 1.143,1.143,1.143,90,90,90 - - 6.35 A 2320
Al-Nb-Ni Nb6.28 Ni5.04 Al1.68 Nb6(Nb0.04 Ni0.72 Al0.24 )7,oP52,62 Pnma 0.9303,0.4933,1.6266,90,90,90 Frank-Kasper phase - 8.23 X 3365
Al-Nb-Ni Nb6.3 Ni2.9 Al3.8 W6Fe7,hR39,166 R-3m 0.5008,0.5008,2.7233,90,90,120 Frank-Kasper phase - 7.23 X 45139
Al-Nb-O NbAlO4 NbFeO4,mS24,12 C12/m1 1.2157,0.37363,0.64902,90,107.623,90 - - 4.35 X 32192
Al-Nb-O Nb0.5 Al0.5 O1.75 TiO2,tP6,136 P42 /mnm 0.4824,0.4824,0.3006,90,90,90 - gray 4.18 A 11194
Al-Nb-O Nb0.5 Al0.5 O2 VO2-b,mS24,12 C12/m1 1.2151,0.3735,0.6486,90,107.63,90 - - 4.35 X 14599
Al-Nb-O Nb11AlO29 (Ti0.17 Nb0.83)12O29,mS82,12 C12/m1 2.054,0.381,1.555,90,113.,90 - - 4.49 A 5974
Al-Nb-O Nb49AlO124 *,mP174,* - 2.11,0.382,2.977,90,95.,90 - - 4.56 N 5974
Al-Nb-Pd NbPd0.5 Al1.5 MgZn2,hP12,194 P63 /mmc 0.5099,0.5099,0.8339,90,90,120 Friauf-Laves phase - 6.60 X 27465
Al-Nb-Pd Nb0.5 PdAl0.5 CsCl,cP2,221 Pm-3m 0.3235,0.3235,0.3235,90,90,90 b.c.c. family - 8.16 X 53513
Al-Nb-Pr PrNb2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4765,1.4765,1.4765,90,90,90 - - 3.58 A 34455
Al-Nb-Rh Nb0.65 Rh0.10 Al0.25 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9854,0.9854,0.5162,90,90,90 Frank-Kasper phase - 7.70 A 5600
Al-Nb-Ru NbRu0.5 Al1.5 MgZn2,hP12,194 P63 /mmc 0.5107,0.5107,0.8329,90,90,120 Friauf-Laves phase - 6.49 X 27465
Al-Nb-Ru NbRu2Al Cu2MnAl,cF16,225 Fm-3m 0.6135,0.6135,0.6135,90,90,90 b.c.c. family - 9.26 X 27465
Al-Nb-Sb Nb3Al0.5 Sb0.5 Cr3Si,cP8,223 Pm-3n 0.5223,0.5223,0.5223,90,90,90 Frank-Kasper phase - 8.23 X 1835
Al-Nb-Sc Sc0.969 Nb0.001 Al0.03 Mg,hP2,194 P63 /mmc 0.328,0.328,0.52,90,90,120 close-packed structure - 3.05 X 21235
Al-Nb-Se NbAl0.33 Se 2 NbAl0.33 Se2,hP10,194 P63 /mmc 0.3456,0.3456,1.2822,90,90,120 - - 6.50 X 6738
Al-Nb-Si NbAl0.3 Si1.7 CrSi2,hP9,180 P6222 0.481,0.481,0.664,90,90,120 - - 5.57 A 1478
Al-Nb-Si NbAl0.6 Si1.4 TiSi2,oF24,70 Fddd 0.4901,0.8403,0.8794,90,90,90 - - 5.44 A 1478
Al-Nb-Si Nb3Al0.5 Si0.5 Cr3Si,cP8,223 Pm-3n 0.517,0.517,0.517,90,90,90 Frank-Kasper phase - 7.36 X 11076
Al-Nb-Si Nb5Al1.5 Si1.5 W5Si3,tI32,140 I4/mcm 1.016,1.016,0.5081,90,90,90 - - 6.93 A 1486
Al-Nb-Sm SmNb2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.474,1.474,1.474,90,90,90 - - 3.63 A 34455
Al-Nb-Sm Sm6Nb4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.113,1.113,1.7972,90,90,120 - - 4.19 A 30591
Al-Nb-Sn Nb3Al0.5 Sn0.5 Cr3Si,cP8,223 Pm-3n 0.5248,0.5248,0.5248,90,90,90 Frank-Kasper phase - 8.08 X 4326
Al-Nb-Ta TaNbAl Ta2Al,tP30,136 P42 /mnm 0.987,0.987,0.5174,90,90,90 Frank-Kasper phase - 9.91 A 5600
Al-Nb-Ta Ta0.5 Nb0.5 Al3 TiAl3,tI8,139 I4/mmm 0.3833,0.3833,0.856,90,90,90 close-packed structure - 5.75 X 5600
Al-Nb-Ta Ta1.7 Nb1.7 Al0.6 Cr3Si,cP8,223 Pm-3n 0.5288,0.5288,0.5288,90,90,90 Frank-Kasper phase - 10.82 X 5600
Al-Nb-Tb Tb6Nb4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1082,1.1082,1.7846,90,90,120 - - 4.35 A 30591
Al-Nb-Ti Ti0.36 Nb0.10 Al0.54 m Cu,cF4,225 Fm-3m 0.4034,0.4034,0.4034,90,90,90 close-packed structure - 4.16 X 28469
Al-Nb-Ti Ti0.44 Nb0.56 Al3 TiAl3,tI8,139 I4/mmm 0.3862,0.3862,0.859,90,90,90 close-packed structure - 3.99 X 25209
Al-Nb-Ti Ti0.5 Nb0.375 Al0.125 W,cI2,229 Im-3m 0.328,0.328,0.328,90,90,90 b.c.c. family - 5.85 X 24455
Al-Nb-Ti Ti0.72 Nb0.20 Al1.08 CuAu,tP2,123 P4/mmm 0.28079,0.28079,0.409,90,90,90 close-packed structure - 4.23 X 28469
Al-Nb-Ti Ti1.1 Nb0.48 Al2.42 Cu3Au,cP4,221 Pm-3m 0.3978,0.3978,0.3978,90,90,90 close-packed structure - 4.29 X 25209
Al-Nb-Ti Ti1.2 Nb0.28 Al0.52 ht cub CsCl,cP2,221 Pm-3m 0.3243,0.3243,0.3243,90,90,90 b.c.c. family - 4.75 X 50312
Al-Nb-Ti Ti1.2 Nb0.28 Al0.52 AuCd,oP4,51 Pmma 0.3439,0.2845,0.4225,90,90,90 close-packed structure - 7.84 A 50312
Al-Nb-Ti Ti2NbAl rt (Ti0.67 Nb0.33)3Al,oS16,63 Cmcm 0.60893,0.95694,0.46666,90,90,90 - - 5.27 X 24052
Al-Nb-Ti Ti2.045 Nb0.195 Al1.76 ht hex Mg3Cd,hP8,194 P63 /mmc 0.57508,0.57508,0.46164,90,90,120 close-packed structure - 4.11 X 44856
Al-Nb-Ti Ti3Nb0.75 Al2.25 m Ti3Nb0.75 Al2.25 ,hP6,164 P-3m1 0.45554,0.45554,0.55415,90,90,120 b.c.c. family - 4.57 X 23199
Al-Nb-Ti Ti4Nb3Al9 Ti4Nb3Al9 ,tP16,123 P4/mmm 0.5607,0.5607,0.827,90,90,90 - - 4.55 X 44637
Al-Nb-Ti Ti42.7 Nb3.8 Al53.5 prec *,c**,* - 0.69,0.69,0.69,90,90,90 - - - N 38887
Al-Nb-Tm Tm6Nb4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.106,1.106,1.7746,90,90,120 - - 4.50 A 30591
Handbook of Inorganic Substances – Edition 2015 : Data 233

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Nb-U UNb2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4662,1.4662,1.4662,90,90,90 - - 4.06 A 30512


Al-Nb-U U6Nb4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1061,1.1061,1.781,90,90,120 - - 5.21 A 30591
Al-Nb-Y Y0.998 Nb0.001 Al0.001 rt Mg,hP2,194 P63/mmc 0.367,0.367,0.578,90,90,120 close-packed structure - 4.38 X 21235
Al-Nb-Y Y6Nb4 Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1085,1.1085,1.7853,90,90,120 - - 3.61 A 34455
Al-Nb-Yb Yb6Nb4 Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1093,1.1093,1.7847,90,90,120 - - 4.49 A 30591
Al-Nb-Zr Zr0.135 Nb0.535 Al0.33 (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9952,0.9952,0.5174,90,90,90 Frank-Kasper phase - 6.89 A 5600
Al-Nb-Zr Zr0.5 Nb0.5Al3 TiAl3,tI8,139 I4/mmm 0.3879,0.3879,0.8771,90,90,90 close-packed structure - 4.35 X 5600
Al-Nb-Zr Zr0.75 Nb0.45 Al1.8 MgZn2,hP12,194 P63/mmc 0.5254,0.5254,0.869,90,90,120 Friauf-Laves phase - 5.08 A 5600
Al-Nb-Zr Zr0.8 Nb0.2Al3 ZrAl3,tI16,139 I4/mmm 0.4005,0.4005,1.727,90,90,90 close-packed structure - 4.14 A 5600
Al-Nb-Zr Zr1.77 Nb0.6 Al0.63 Co1.75 Ge,hP6,194 P63/mmc 0.461,0.461,0.5913,90,90,120 AlB2 family - 7.15 X 5600
Al-Nb-Zr Zr3.5 Nb0.7Al2.8 rt Zr4Al3,hP7,191 P6/mmm 0.5368,0.5368,0.5333,90,90,120 Frank-Kasper phase - 5.74 A 5600
Al-Nb-Zr Zr4NbAl3 ht W5Si3,tI32,140 I4/mcm 1.087,1.087,0.5296,90,90,90 - - 5.72 A 5600
Al-Nb-Zr Zr4.55 Nb1.95 Al6.5 W6Fe7,hR39,166 R-3m 0.53089,0.53089,2.8837,90,90,120 Frank-Kasper phase - 5.46 X 49697
Al-Nd-Ni NdNiAl ZrNiAl,hP9,189 P-62m 0.7,0.7,0.407,90,90,120 Fe2P family - 6.63 X 31940
Al-Nd-Ni NdNiAl2 MgCuAl2,oS16,63 Cmcm 0.4063,1.074,0.6933,90,90,90 - - 5.64 A 19354
Al-Nd-Ni NdNiAl4 YNiAl4,oS24,63 Cmcm 0.411,1.548,0.6669,90,90,90 - - 4.87 A 12315
Al-Nd-Ni NdNi2.61 Al2.39 YNi2Al3,hP18,191 P6/mmm 0.8972,0.8972,0.4118,90,90,120 - - 6.28 X 34450
Al-Nd-Ni NdNi4Al CaCu5,hP6,191 P6/mmm 0.50057,0.50057,0.40555,90,90,120 - - 7.66 X 34450
Al-Nd-Ni NdNi4Al PrNi2Al3,hP6,191 P6/mmm 0.50103,0.50103,0.40601,90,90,120 - - 7.64 X 42200
Al-Nd-Ni Nd2 Ni2Al W2CoB2,oI10,71 Immm 0.4269,0.5488,0.849,90,90,90 - - 7.23 X 11393
Al-Nd-Ni Nd3 Ni8Al Ce3Co8Si,hP24,194 P63/mmc 0.5107,0.5107,1.628,90,90,120 Laves-CaCu5 - 8.39 X 11393
Al-Nd-Ni Nd4 Ni6Al23 Y4Ni6Al23,mS66,12 C12/m1 1.60126,0.41142,1.8368,90,113.169,90 - - 4.63 A 53475
Al-Nd-O NdAlO3 rhom LaAlO3,hR30,167 R-3c 0.5322,0.5322,1.2916,90,90,120 perovskite family - 6.89 X 6809
Al-Nd-O Nd0.825 Al11.71 O19 La0.83 Al11.83 O19,hP84,194 P63/mmc 0.5553,0.5553,2.199,90,90,120 magnetoplumbite family - 4.18 X 17257
Al-Nd-O Nd4 Al2O9 Eu4Al2O9,mP60,14 P121/c1 0.77402,1.08543,1.13083,90,109.45,90 - - 5.75 X 47063
Al-Nd-Os NdOs2Al10 YbFe 2Al10,oS52,63 Cmcm 0.917,1.0227,0.9138,90,90,90 - - 6.16 A 34696
Al-Nd-Os Nd3 Os4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.8872,0.8872,0.9582,90,90,120 - gray dark 7.72 X 40923
Al-Nd-Os Nd3.5 Os6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63/mcm 1.3087,1.3087,0.9084,90,90,120 - gray silver 6.09 A 42976
Al-Nd-Pr Pr0.5 Nd0.5Al3 Mg3 Cd,hP8,194 P63/mmc 0.6497,0.6497,0.4603,90,90,120 close-packed structure - 4.41 A 28820
Al-Nd-Pr Pr0.6 Nd0.4Al2 MgCu2,cF24,227 Fd-3m 0.801,0.801,0.801,90,90,90 Friauf-Laves phase - 5.07 X 4155
Al-Nd-Pt NdPtAl TiNiSi,oP12,62 Pnma 0.70736,0.44495,0.77729,90,90,90 AlB2 family - 9.95 X 34851
Al-Nd-Pt NdPt4Al PrNi2Al3,hP6,191 P6/mmm 0.5361,0.5361,0.4436,90,90,120 - - 14.31 X 28834
Al-Nd-Re NdRe2Al10 CaCr2Al10,tP52,129 P4/nmm 1.2943,1.2943,0.51712,90,90,90 CaCu5-Zr4Al3 - 6.03 X 35746
Al-Nd-Rh NdRhAl TiNiSi,oP12,62 Pnma 0.69996,0.42499,0.80651,90,90,90 AlB2 family - 7.59 A 33246
Al-Nd-Rh NdRh4Al15.7 NdRh4Al15.7 ,tP96,137 P42/nmc 0.9124,0.9124,1.5614,90,90,90 - gray silver 5.01 X 37295
Al-Nd-Rh Nd2 Rh3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3318,0.7689,0.9492,90,90,90 - - 5.74 A 43418
Al-Nd-Rh Nd4 RhAl Gd4RhIn,cF96,216 F-43m 1.3818,1.3818,1.3818,90,90,90 - gray dark 7.12 A 57034
Al-Nd-Ru NdRu2Al10 YbFe 2Al10,oS52,63 Cmcm 0.9152,1.0261,0.9115,90,90,90 - - 4.78 A 34696
Al-Nd-Ru Nd3 Ru4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.88552,0.88552,0.96202,90,90,120 - gray dark 5.90 A 58824
Al-Nd-Ru Nd4 RuAl Gd4RhIn,cF96,216 F-43m 1.3745,1.3745,1.3745,90,90,90 - gray dark 7.21 A 57034
Al-Nd-S Nd3 Al1.67 S7 Ce3Al1.67 S7,hP24,173 P63 0.989,0.989,0.607,90,90,120 - gray silver 4.54 A 5866
Al-Nd-Sc Sc0.988 Nd0.012 Al3 Cu3Au,cP4,221 Pm-3m 0.4105,0.4105,0.4105,90,90,90 close-packed structure - 3.05 X 52216
Al-Nd-Se Nd3 Al1.67 Se7 Ce3Al1.67 S7,hP24,173 P63 1.023,1.023,0.619,90,90,120 - - 6.10 A 4521
Al-Nd-Si NdAlSi ThSi2,tI12,141 I41/amd 0.41991,0.41991,1.44916,90,90,90 - - 5.18 X 47398
Al-Nd-Si NdAlSi2 CeAlSi2,hP8,164 P-3m1 0.41523,0.41523,1.1073,90,90,120 - - 4.57 A 43109
Al-Nd-Si NdAl0.16 Si0.84 FeB-b,oP8,62 Pnma 0.8207,0.3944,0.5911,90,90,90 CrB(TlI)-FeB - 5.98 A 56977
Al-Nd-Si NdAl0.4 Si0.6 TlI,oS8,63 Cmcm 0.4442,1.1131,0.4043,90,90,90 CrB(TlI)-FeB - 5.71 A 56977
Al-Nd-Si NdAl1.5 Si0.5 AlB2 ,hP3,191 P6/mmm 0.4276,0.4276,0.4204,90,90,120 AlB2 family - 4.96 X 56977
Al-Nd-Si NdAl1.94 Si0.06 MgCu2,cF24,227 Fd-3m 0.7986,0.7986,0.7986,90,90,90 Friauf-Laves phase - 5.17 X 56977
Al-Nd-Si NdAl2Si2 Ce2SO2,hP5,164 P-3m1 0.4212,0.4212,0.6702,90,90,120 - - 4.10 A 56977
Al-Nd-Si NdAl2.8 Si0.2 Mg3 Cd,hP8,194 P63/mmc 0.6444,0.6444,0.4585,90,90,120 close-packed structure - 4.54 A 56977
Al-Nd-Si Nd4 Al3Si3 *,oS20,63 Cmcm 0.4107,2.5987,0.4286,90,90,90 - - 10.78 N 56977
Al-Nd-Si Nd5 Al0.4 Si3.6 Zr5Si4,tP36,92 P41212 0.7882,0.7882,1.4857,90,90,90 - - 6.00 A 56977
Al-Nd-Si Nd5 Al0.8 Si2.2 Cr5B3,tI32,140 I4/mcm 0.775,0.775,1.3723,90,90,90 - - 6.48 A 56977
Al-Nd-Sn NdAl1.25 Sn0.75 AlB2 ,hP3,191 P6/mmm 0.445,0.445,0.4179,90,90,120 AlB2 family - 6.19 X 3532
Al-Nd-Ta NdTa2 Al20 CeCr2Al20,cF184,227 Fd-3m 1.4753,1.4753,1.4753,90,90,90 - - 4.33 A 34455
Al-Nd-Ta Nd6 Ta4 Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1151,1.1151,1.8026,90,90,120 - - 4.70 A 30591
Al-Nd-Ti NdTi2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4704,1.4704,1.4704,90,90,90 - - 3.26 A 30512
Al-Nd-Ti Nd6 Ti4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1124,1.1124,1.8069,90,90,120 - - 3.80 A 30591
Al-Nd-V NdV2 Al20 CeCr2Al20,cF184,227 Fd-3m 1.457,1.457,1.457,90,90,90 - - 3.37 A 4015
Al-Nd-V Nd6 V4 Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1036,1.1036,1.7939,90,90,120 - - 3.91 A 30591
Al-Nd-W NdW2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4605,1.4605,1.4605,90,90,90 - - 4.48 A 30512
Al-Nd-W Nd6 W4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1064,1.1064,1.7927,90,90,120 - - 4.83 A 29673
Al-Nd-Zn Zn2.34 NdAl1.66 CeAl2Ga2,tI10,139 I4/mmm 0.42013,0.42013,1.09767,90,90,90 - - 5.86 X 44889
Al-Ni-O NiAl2O4 MgAl2O4,cF56,227 Fd-3m 0.80457,0.80457,0.80457,90,90,90 spinel family - 4.51 X 52956
Al-Ni-O NiAl6O10 *,aP*,* - 0.786,0.796,0.8015,89.3,89.3,89.93 - - - N 8363
Al-Ni-Pd Ni0.64Pd0.72 Al0.64 CuAu,tP2,123 P4/mmm 0.27867,0.27867,0.3366,90,90,90 close-packed structure - 8.35 X 36711
Al-Ni-Pd Ni0.8Pd1.2Al3 Ni2Al3,hP5,164 P-3m1 0.412,0.412,0.501,90,90,120 - - 5.76 A 30364
Al-Ni-Pd Ni2.3Pd0.7Al Cu3Au,cP4,221 Pm-3m 0.36475,0.36475,0.36475,90,90,90 close-packed structure - 8.09 X 36711
Al-Ni-Pr PrNiAl ZrNiAl,hP9,189 P-62m 0.7003,0.7003,0.4085,90,90,120 Fe2P family - 6.51 X 32716
Al-Ni-Pr PrNiAl2 MgCuAl2,oS16,63 Cmcm 0.4067,1.0848,0.6942,90,90,90 - - 5.50 A 19354
Al-Ni-Pr PrNiAl4 YNiAl4,oS24,63 Cmcm 0.4112,1.549,0.6672,90,90,90 - - 4.81 A 11475
Al-Ni-Pr PrNi0.3Al1.7 MgCu2,cF24,227 Fd-3m 0.7971,0.7971,0.7971,90,90,90 Friauf-Laves phase - 5.36 X 3595
Al-Ni-Pr PrNi2Al3 PrNi2Al3,hP6,191 P6/mmm 0.5293,0.5293,0.4064,90,90,120 - - 5.71 X 11475
Al-Ni-Pr PrNi2Al5 PrNi2Al5,oI16,71 Immm 0.3979,0.7024,0.9562,90,90,90 - - 4.89 X 14144
Al-Ni-Pr PrNi4Al CaCu5,hP6,191 P6/mmm 0.5023,0.5023,0.4064,90,90,120 - - 7.53 X 11685
Al-Ni-Pr Pr2Ni2Al W2CoB2,oI10,71 Immm 0.4273,0.5523,0.8527,90,90,90 - - 7.03 X 11393
Al-Ni-Pr Pr3Ni8Al Ce3Co8Si,hP24,194 P63/mmc 0.5123,0.5123,1.633,90,90,120 Laves-CaCu5 - 8.23 X 11393
234 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ni-Pr Pr4Ni6Al23 Y4Ni6Al23 ,mS66,12 C12/m1 1.6055,0.41231,1.8394,90,113.2,90 - - 4.56 A 53475


Al-Ni-Pt Ni0.105Pt0.165 Al0.73 *,oP*,* - 2.34,1.65,1.24,90,90,90 - - - N 58494
Al-Ni-Pt Ni0.2Pt0.8 Al FeSi,cP8,198 P213 0.48202,0.48202,0.48202,90,90,90 - - 11.55 A 57103
Al-Ni-Pt Ni0.58Pt4.74 Al2.68 Pt5Ga3,oS16,65 Cmmm 0.72583,0.79022,0.39319,90,90,90 close-packed structure - 15.18 A 57103
Al-Ni-Pt Ni0.69Pt0.72 Al1.59 CaF2,cF12,225 Fm-3m 0.59411,0.59411,0.59411,90,90,90 fluorite family - 7.09 X 58494
Al-Ni-Pt Ni0.704Pt0.894 Al0.402 CuAu,tP2,123 P4/mmm 0.27379,0.27379,0.3548,90,90,90 close-packed structure - 14.15 X 57103
Al-Ni-Pt Ni1.1Pt6.9 Al21 Pt8Al21,tI116,88 I41/a 1.2911,1.2911,1.0615,90,90,90 - - 7.42 A 57103
Al-Ni-Pt Ni1.12Pt1.68 Al1.2 Co2NiGa,tP4,123 P4/mmm 0.3891,0.3891,0.3547,90,90,90 - - 13.17 X 44181
Al-Ni-Pt Ni1.5Pt0.5 Al3 Ni2Al3,hP5,164 P-3m1 0.4083,0.4083,0.4984,90,90,120 - - 6.15 A 57103
Al-Ni-Pt Ni2.48Pt0.52 Al Cu3Au,cP4,221 Pm-3m 0.3642,0.3642,0.3642,90,90,90 close-packed structure - 9.42 X 17833
Al-Ni-Pu PuNiAl ZrNiAl,hP9,189 P-62m 0.686,0.686,0.398,90,90,120 Fe2P family - 10.13 A 8280
Al-Ni-Re ReNi2Al7.967 ReNi2Al7.97 ,oP88,55 Pbam 1.0032,1.51258,0.8389,90,90,90 - - 5.41 X 58175
Al-Ni-Ru Ru0.58 Ni0.48 Al0.94 CsCl,cP2,221 Pm-3m 0.2939,0.2939,0.2939,90,90,90 b.c.c. family - 7.34 X 34401
Al-Ni-Ru Ru0.65 Ni1.35 Al9 Co2Al9,mP22,14 P121/c1 0.6273,0.6333,0.8636,90,95.12,90 - - 3.77 A 41653
Al-Ni-Ru Ru1.2 Ni0.8 Al5 *,cP*,* - 0.7674,0.7674,0.7674,90,90,90 - - - N 41653
Al-Ni-Ru Ru2.74 Ni1.26 Al13 (Ru0.68 Ni0.32)4Al13,oP102,58 Pnnm 1.26641,1.49643,0.82818,90,90,90 - - 4.45 X 59554
Al-Ni-Ru Ru3.4 Ni0.6 Al13 Fe4Al13,mS102,12 C12/m1 1.5778,0.8229,1.268,90,107.79,90 - - 4.64 X 57060
Al-Ni-Ru Ru8.5 Ni16.0 Al75.5 *,hP*,* - 1.2132,1.2132,2.702,90,90,120 - - - N 41653
Al-Ni-S Ni0.7 Al2S3.7 FeGa2S4,hP7,164 P-3m1 0.3606,0.3606,1.1985,90,90,120 - - 2.63 X 57176
Al-Ni-Sb Ni1.5 Al0.5 Sb0.5 Co1.75 Ge,hP6,194 P63 /mmc 0.403,0.403,0.513,90,90,120 AlB2 family - 7.48 X 24974
Al-Ni-Sb Ni3Al0.8Sb0.2 Cu3Au,cP4,221 Pm-3m 0.3598,0.3598,0.3598,90,90,90 close-packed structure - 7.92 X 19208
Al-Ni-Sc ScNiAl MgZn2,hP12,194 P63 /mmc 0.51374,0.51374,0.82241,90,90,120 Friauf-Laves phase - 4.62 X 58988
Al-Ni-Sc ScNiAl2 MgCuAl2,oS16,63 Cmcm 0.40048,0.9518,0.6679,90,90,90 - - 4.11 X 26886
Al-Ni-Sc ScNi2Al Cu2MnAl,cF16,225 Fm-3m 0.599,0.599,0.599,90,90,90 b.c.c. family - 5.85 X 20154
Al-Ni-Sc Sc0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.4164,0.4164,0.90586,90,90,120 - - 3.78 A 59682
Al-Ni-Sc Sc6Ni7Al16 Th6Mn23,cF116,225 Fm-3m 1.216,1.216,1.216,90,90,90 - - 4.11 A 4605
Al-Ni-Si NiAl0.3 Si1.7 CaF2,cF12,225 Fm-3m 0.5432,0.5432,0.5432,90,90,90 fluorite family - 4.75 X 41490
Al-Ni-Si NiAl0.5 Si0.5 FeSi,cP8,198 P213 0.456,0.456,0.456,90,90,90 - - 6.04 X 923
Al-Ni-Si NiAl0.8 Si0.2 CsCl,cP2,221 Pm-3m 0.287,0.287,0.287,90,90,90 b.c.c. family - 6.03 X 42938
Al-Ni-Si Ni0.60 Al0.36 Si0.04 W,cI2,229 Im-3m 0.2858,0.2858,0.2858,90,90,90 b.c.c. family - 6.55 X 10891
Al-Ni-Si Ni0.845 Al0.116 Si0.036 Cu,cF4,225 Fm-3m 0.35414,0.35414,0.35414,90,90,90 close-packed structure - 8.04 X 46380
Al-Ni-Si Ni12.5 Al0.9 Si8.1 ht Ni13Ga3Ge6,hP66,152 P3121 0.7653,0.7653,1.4665,90,90,120 AlB2 family - 6.60 X 40191
Al-Ni-Si Ni16AlSi9 rt Ni16AlSi9,oS116,63 Cmcm 1.12778,0.85346,1.21268,90,90,90 - - 6.94 X 44007
Al-Ni-Si Ni2Al0.3 Si0.7 Co2Si-b,oP12,62 Pnma 0.496,0.376,0.717,90,90,90 - - 7.21 A 42938
Al-Ni-Si Ni2Al2.425 Si0.575 Ni2Al3,hP5,164 P-3m1 0.40151,0.40151,0.48231,90,90,120 - - 4.91 A 41490
Al-Ni-Si Ni3Al0.95 Si0.05 Cu3Au,cP4,221 Pm-3m 0.35575,0.35575,0.35575,90,90,90 close-packed structure - 7.49 X 26629
Al-Ni-Si Ni3Al6.1 Si0.9 Ru3Sn7,cI40,229 Im-3m 0.83159,0.83159,0.83159,90,90,90 - - 4.23 A 41490
Al-Ni-Si Ni31Al0.3 Si11.7 Ni31Si12,hP43,150 P321 0.66773,0.66773,1.227,90,90,120 - - 7.56 A 46380
Al-Ni-Sm SmNiAl ht-hp MgZn2,hP12,194 P63 /mmc 0.5404,0.5404,0.8666,90,90,120 Friauf-Laves phase - 7.15 A 20055
Al-Ni-Sm SmNiAl ZrNiAl,hP9,189 P-62m 0.6982,0.6982,0.4008,90,90,120 Fe2P family - 6.95 A 7469
Al-Ni-Sm SmNiAl2 MgCuAl2,oS16,63 Cmcm 0.4058,1.0519,0.6903,90,90,90 - - 5.93 A 50353
Al-Ni-Sm SmNiAl3 YNiAl3,oP20,62 Pnma 0.81871,0.40915,1.07013,90,90,90 - - 5.37 X 53946
Al-Ni-Sm SmNiAl4 YNiAl4,oS24,63 Cmcm 0.40948,1.5582,0.661,90,90,90 - - 4.99 X 44084
Al-Ni-Sm SmNi0.075 Al1.925 MgCu2,cF24,227 Fd-3m 0.7937,0.7937,0.7937,90,90,90 Friauf-Laves phase - 5.49 X 50353
Al-Ni-Sm SmNi2Al3 YNi2Al3,hP18,191 P6/mmm 0.9141,0.9141,0.4039,90,90,120 - - 5.94 A 50353
Al-Ni-Sm SmNi4Al CaCu5,hP6,191 P6/mmm 0.498,0.498,0.405,90,90,120 - - 7.87 X 11685
Al-Ni-Sm Sm2Ni2Al W2CoB2,oI10,71 Immm 0.4221,0.5414,0.8424,90,90,90 - - 7.68 X 11393
Al-Ni-Sm Sm3Ni5Al19 Gd3Ni5Al19 ,oS108,63 Cmcm 0.40992,1.60304,2.7105,90,90,90 - - 4.69 A 53475
Al-Ni-Sm Sm3Ni6Al2 Ce3Ni6Si2 ,cI44,229 Im-3m 0.9006,0.9006,0.9006,90,90,90 - - 7.80 X 26480
Al-Ni-Sm Sm3Ni7Al14 Gd3Ni7Al14 ,hP72,189 P-62m 1.8047,1.8047,0.4059,90,90,120 - - 5.40 A 54193
Al-Ni-Sm Sm3Ni8Al Ce3Co8Si,hP24,194 P63 /mmc 0.5082,0.5082,1.619,90,90,120 Laves-CaCu5 - 8.69 X 11393
Al-Ni-Sm Sm4Ni6Al23 Y4Ni6Al23 ,mS66,12 C12/m1 1.5939,0.40967,1.832,90,113.09,90 - - 4.75 X 44085
Al-Ni-Sn Ni3Al0.8 Sn0.2 Cu3Au,cP4,221 Pm-3m 0.3601,0.3601,0.3601,90,90,90 close-packed structure - 7.87 X 19208
Al-Ni-Sr SrNi2Al9 BaFe2Al9,hP12,191 P6/mmm 0.788,0.788,0.396,90,90,120 - gray 3.49 A 9094
Al-Ni-Ta TaNiAl MgZn2,hP12,194 P63 /mmc 0.4969,0.4969,0.7985,90,90,120 Friauf-Laves phase - 10.37 X 2311
Al-Ni-Ta Ta0.0004 Ni0.906 Al1.0936 CsCl,cP2,221 Pm-3m 0.28606,0.28606,0.28606,90,90,90 b.c.c. family - 5.87 X 32616
Al-Ni-Ta Ta0.0005 Ni2Al2.9995 Ni2Al3,hP5,164 P-3m1 0.40365,0.40365,0.48975,90,90,120 - - 4.77 A 32616
Al-Ni-Ta Ta0.24 Ni3Al0.76 Cu3Au,cP4,221 Pm-3m 0.3597,0.3597,0.3597,90,90,90 close-packed structure - 8.56 X 18696
Al-Ni-Ta Ta0.366 Ni0.022 Al0.612 *,o*24,* - 0.4791,0.6771,1.1052,90,90,90 - - - N 32616
Al-Ni-Ta Ta0.5 Ni3Al0.5 TiNi3,hP16,194 P63 /mmc 0.5112,0.5112,0.834,90,90,120 close-packed structure - 9.86 A 2443
Al-Ni-Ta Ta0.952 Ni0.124 Al2.924 TiAl3,tI8,139 I4/mmm 0.3838,0.3838,0.8548,90,90,90 close-packed structure - 6.82 X 32616
Al-Ni-Ta Ta0.956 Ni2.04 Al1.004 Cu2MnAl,cF16,225 Fm-3m 0.593,0.593,0.593,90,90,90 b.c.c. family - 10.19 X 32616
Al-Ni-Ta Ta0.975 Ni1.974 Al0.051 MoSi2,tI6,139 I4/mmm 0.3153,0.3153,0.7917,90,90,90 b.c.c. family - 12.39 A 32616
Al-Ni-Ta Ta6Ni7Al17 Ti6Ni7Al17 ,cF144,225 Fm-3m 1.133,1.133,1.133,90,90,90 - - 8.93 A 2320
Al-Ni-Ta Ta6.032 Ni2.379 Al4.589 W6Fe7,hR39,166 R-3m 0.49962,0.49962,2.7436,90,90,120 Frank-Kasper phase - 11.38 A 32616
Al-Ni-Tb TbNiAl hp MgZn2,hP12,194 P63 /mmc 0.5397,0.5397,0.8591,90,90,120 Friauf-Laves phase - 7.50 A 20055
Al-Ni-Tb TbNiAl ZrNiAl,hP9,189 P-62m 0.69992,0.69992,0.38801,90,90,120 Fe2P family - 7.40 A 40127
Al-Ni-Tb TbNiAl2 MgCuAl2,oS16,63 Cmcm 0.4084,1.011,0.697,90,90,90 - - 6.27 A 7363
Al-Ni-Tb TbNiAl3 YNiAl3,oP20,62 Pnma 0.81484,0.40544,1.06328,90,90,90 - - 5.65 A 53946
Al-Ni-Tb TbNiAl4 YNiAl4,oS24,63 Cmcm 0.4063,1.5415,0.6603,90,90,90 - - 5.23 X 46868
Al-Ni-Tb TbNi0.45 Al1.55 MgCu2,cF24,227 Fd-3m 0.772,0.772,0.772,90,90,90 Friauf-Laves phase - 6.56 X 13210
Al-Ni-Tb TbNi2.5 Al2.5 YCo3Ga2,hP18,191 P6/mmm 0.8898,0.8898,0.4098,90,90,120 - - 6.62 X 33312
Al-Ni-Tb TbNi3.62 Al1.38 CaCu5,hP6,191 P6/mmm 0.4997,0.4997,0.40559,90,90,120 - - 7.74 X 44960
Al-Ni-Tb Tb0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.42008,0.42008,0.91303,90,90,120 - - 4.59 A 59682
Al-Ni-Tb Tb2Ni10Al7 Th2Ni17,hP38,194 P63 /mmc 0.7362,0.7362,0.8569,90,90,120 CaCu5-Zr4Al3 - 9.03 A 16966
Al-Ni-Tb Tb2Ni2Al W2CoB2,oI10,71 Immm 0.4203,0.5396,0.8344,90,90,90 - - 8.11 X 11393
Al-Ni-Tb Tb3Ni5Al19 Gd3Ni5Al19 ,oS108,63 Cmcm 0.4035,1.591,2.708,90,90,90 - - 4.90 A 13210
Al-Ni-Tb Tb3Ni6Al2 Ce3Ni6Si2 ,cI44,229 Im-3m 0.8934,0.8934,0.8934,90,90,90 - - 8.22 X 26638
Handbook of Inorganic Substances – Edition 2015 : Data 235

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ni-Tb Tb3Ni7Al14 Gd3Ni7Al14,hP72,189 P-62m 1.7945,1.7945,0.404,90,90,120 - - 5.60 A 54193


Al-Ni-Tb Tb3Ni8Al Ce3Co8Si,hP24,194 P63/mmc 0.5042,0.5042,1.614,90,90,120 Laves-CaCu5 - 9.10 X 11393
Al-Ni-Tb Tb4Ni6Al23 Y4Ni6Al23,mS66,12 C12/m1 1.5832,0.40716,1.828,90,112.99,90 - - 4.92 A 53475
Al-Ni-Th ThNiAl ZrNiAl,hP9,189 P-62m 0.7078,0.7078,0.4053,90,90,120 Fe2P family - 9.00 A 15241
Al-Ni-Th ThNiAl3 BaAl4,tI10,139 I4/mmm 0.4233,0.4233,1.0364,90,90,90 - - 6.65 A 35715
Al-Ni-Th ThNi2Al3 PrNi2Al3,hP6,191 P6/mmm 0.5318,0.5318,0.4057,90,90,120 - - 7.19 X 10756
Al-Ni-Ti TiNi0.25Al2.75 ht Ti(Ti0.25 Al0.75)Al2,tI16,139 I4/mmm 0.392,0.392,1.662,90,90,90 - - 3.56 A 2865
Al-Ni-Ti TiNi0.33 Al2.67 Cu3Au,cP4,221 Pm-3m 0.39316,0.39316,0.39316,90,90,90 close-packed structure - 3.81 X 42939
Al-Ni-Ti TiNi1.52 Al5 ZrNi2Al5,tI16,139 I4/mmm 0.3984,0.3984,1.4073,90,90,90 - - 4.04 X 56211
Al-Ni-Ti TiNi2Al Cu2MnAl,cF16,225 Fm-3m 0.5895,0.5895,0.5895,90,90,90 b.c.c. family - 6.23 X 50864
Al-Ni-Ti Ti0.007 Ni0.006 Al0.987 Cu,cF4,225 Fm-3m 0.40495,0.40495,0.40495,90,90,90 close-packed structure - 2.73 X 48363
Al-Ni-Ti Ti0.008 Ni0.984 Al3.008 Fe3C-b,oP16,62 Pnma 0.66158,0.73869,0.48141,90,90,90 - - 3.93 A 48363
Al-Ni-Ti Ti0.015 Ni2.095 Al2.89 Ni2Al3,hP5,164 P-3m1 0.40433,0.40433,0.49058,90,90,120 - - 4.82 A 48363
Al-Ni-Ti Ti0.1 NiAl0.9 CsCl,cP2,221 Pm-3m 0.289,0.289,0.289,90,90,90 b.c.c. family - 6.04 X 52818
Al-Ni-Ti Ti0.4 Ni2.96 Al0.64 Cu3Au,cP4,221 Pm-3m 0.3582,0.3582,0.3582,90,90,90 close-packed structure - 7.59 X 52818
Al-Ni-Ti Ti0.9 NiAl0.1 rt CsCl,cP2,221 Pm-3m 0.2999,0.2999,0.2999,90,90,90 b.c.c. family - 6.43 X 52818
Al-Ni-Ti Ti1.006 Ni0.104 Al0.89 CuAu,tP2,123 P4/mmm 0.28305,0.28305,0.40609,90,90,90 close-packed structure - 4.00 X 48363
Al-Ni-Ti Ti1.02 Ni0.54 Al1.44 MgZn2,hP12,194 P63/mmc 0.50189,0.50189,0.8205,90,90,120 Friauf-Laves phase - 4.43 X 47694
Al-Ni-Ti Ti1.023 Ni0.012 Al1.965 rt HfGa2,tI24,141 I41/amd 0.39712,0.39712,2.4374,90,90,90 close-packed structure - 3.55 A 48363
Al-Ni-Ti Ti1.036 Ni0.024 Al2.94 TiAl3,tI8,139 I4/mmm 0.38569,0.38569,0.86044,90,90,90 close-packed structure - 3.38 X 48363
Al-Ni-Ti Ti1.068 Ni2.896 Al0.036 TiNi3,hP16,194 P63/mmc 0.51165,0.51165,0.83552,90,90,120 close-packed structure - 7.79 A 48363
Al-Ni-Ti Ti1.68 NiAl0.32 Ti2Ni,cF96,227 Fd-3m 1.12543,1.12543,1.12543,90,90,90 - - 5.51 X 56340
Al-Ni-Ti Ti2.48 Ni1.29 Al1.23 ht V2(Co 0.57 Si0.43 )3,mS50,12 C12/m1 1.85383,0.4997,0.81511,90,99.597,90 Frank-Kasper phase - 5.08 X 56340
Al-Ni-Ti Ti2.90 Ni0.04 Al1.06 rt Mg3 Cd,hP8,194 P63/mmc 0.5786,0.5786,0.46509,90,90,120 close-packed structure - 4.18 A 56340
Al-Ni-Ti Ti6Ni7Al17 Ti6Ni7Al17,cF144,225 Fm-3m 1.1892,1.1892,1.1892,90,90,90 - - 4.57 X 41497
Al-Ni-Tm TmNiAl hp MgZn2,hP12,194 P63/mmc 0.5304,0.5304,0.8553,90,90,120 Friauf-Laves phase - 8.12 A 20055
Al-Ni-Tm TmNiAl ZrNiAl,hP9,189 P-62m 0.6965,0.6965,0.3775,90,90,120 Fe2P family - 8.00 A 7469
Al-Ni-Tm TmNiAl2 MgCuAl2,oS16,63 Cmcm 0.4064,1.003,0.69,90,90,90 - - 6.65 A 7363
Al-Ni-Tm TmNiAl4 YNiAl4,oS24,63 Cmcm 0.4044,1.504,0.663,90,90,90 - - 5.53 A 7363
Al-Ni-Tm TmNi0.45 Al1.55 MgCu2,cF24,227 Fd-3m 0.7692,0.7692,0.7692,90,90,90 Friauf-Laves phase - 6.92 X 15107
Al-Ni-Tm TmNi2Al3 YNi2Al3,hP18,191 P6/mmm 0.9,0.9,0.4037,90,90,120 - - 6.46 A 15107
Al-Ni-Tm TmNi4Al CaCu5,hP6,191 P6/mmm 0.4934,0.4934,0.40482,90,90,120 - - 8.38 X 47390
Al-Ni-Tm Tm0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.41888,0.41888,0.90983,90,90,120 - - 4.71 A 59682
Al-Ni-Tm Tm2 Ni2Al W2CoB2,oI10,71 Immm 0.4167,0.5322,0.8308,90,90,90 - - 8.69 X 11393
Al-Ni-Tm Tm2 Ni3Al7 *,hP*,* - 1.785,1.785,0.4048,90,90,120 - - - N 15107
Al-Ni-Tm Tm3 Ni5Al19 Gd3Ni5Al19,oS108,63 Cmcm 0.3927,1.546,2.659,90,90,90 - - 5.40 A 15107
Al-Ni-Tm Tm3 Ni6Al2 Ce3Ni6Si2,cI44,229 Im-3m 0.886,0.886,0.886,90,90,90 - - 8.72 A 15107
Al-Ni-Tm Tm3 Ni8Al Ce3Co8Si,hP24,194 P63/mmc 0.4986,0.4986,1.596,90,90,120 Laves-CaCu5 - 9.70 X 11393
Al-Ni-U UNiAl ZrNiAl,hP9,189 P-62m 0.6733,0.6733,0.4035,90,90,120 Fe2P family - 10.18 X 34490
Al-Ni-U UNi1.76 Al0.24 MgZn2,hP12,194 P63/mmc 0.5039,0.5039,0.8264,90,90,120 Friauf-Laves phase - 12.71 A 11999
Al-Ni-U UNi2Al3 PrNi2Al3,hP6,191 P6/mmm 0.52193,0.52193,0.40177,90,90,120 - gray silver 7.65 X 30456
Al-Ni-U UNi2.9 Al2.1 PrNi2Al3,hP6,191 P6/mmm 0.50108,0.50108,0.41093,90,90,120 - - 8.64 X 43105
Al-Ni-U UNi4Al MgCu4Sn,cF24,216 F-43m 0.6812,0.6812,0.6812,90,90,90 Friauf-Laves phase - 10.50 X 7498
Al-Ni-U UNi4.55 Al0.45 PrNi2Al3,hP6,191 P6/mmm 0.48032,0.48032,0.40417,90,90,120 - - 10.64 X 43105
Al-Ni-U U0.71 Ni1.29 Al MgNi2,hP24,194 P63/mmc 0.6932,0.6932,1.9622,90,90,120 Friauf-Laves phase - 4.42 A 2440
Al-Ni-U U4Ni5Al18 U4Ni5Al18,mS54,8 C1m1 1.5547,0.4061,1.60219,90,117.178,90 - - 6.39 X 23047
Al-Ni-V VNi2Al rt Cu2MnAl,cF16,225 Fm-3m 0.633,0.633,0.633,90,90,90 b.c.c. family - 5.12 X 9083
Al-Ni-V V0.20 Ni0.75 Al0.05 Cu,cF4,225 Fm-3m 0.3565,0.3565,0.3565,90,90,90 close-packed structure - 8.15 X 56067
Al-Ni-V V0.40 Ni3Al0.60 Cu3Au,cP4,221 Pm-3m 0.3564,0.3564,0.3564,90,90,90 close-packed structure - 7.80 X 56067
Al-Ni-V V0.5 NiAl0.5 ht CsCl,cP2,221 Pm-3m 0.3165,0.3165,0.3165,90,90,90 b.c.c. family - 5.12 X 9083
Al-Ni-W W0.04 Ni3Al0.96 Cu3Au,cP4,221 Pm-3m 0.3572,0.3572,0.3572,90,90,90 close-packed structure - 7.63 X 17833
Al-Ni-W W2Ni3.646 Al16.304 Mo2 Ni3(Ni0.67 Al0.33)Al16,oP100,55 Pbam 1.00683,1.53236,0.85232,90,90,90 - - 5.16 X 58175
Al-Ni-Y YNiAl hp MgZn2,hP12,194 P63/mmc 0.5385,0.5385,0.8681,90,90,120 Friauf-Laves phase - 5.32 A 20055
Al-Ni-Y YNiAl ZrNiAl,hP9,189 P-62m 0.7036,0.7036,0.3839,90,90,120 Fe2P family - 5.28 A 33169
Al-Ni-Y YNiAl2 MgCuAl2,oS16,63 Cmcm 0.407,1.013,0.706,90,90,90 - - 4.60 X 7004
Al-Ni-Y YNiAl3 YNiAl3,oP20,62 Pnma 0.8156,0.40462,1.0638,90,90,90 - - 4.32 X 25785
Al-Ni-Y YNiAl4 YNiAl4,oS24,63 Cmcm 0.408,1.544,0.662,90,90,90 - - 4.07 X 7004
Al-Ni-Y YNi0.45 Al1.55 MgCu2,cF24,227 Fd-3m 0.771,0.771,0.771,90,90,90 Friauf-Laves phase - 4.55 X 10610
Al-Ni-Y YNi2Al3 YNi2Al3,hP18,191 P6/mmm 0.9006,0.9006,0.407,90,90,120 - - 5.01 X 34422
Al-Ni-Y YNi2.5 Al2.5 YCo 3Ga2,hP18,191 P6/mmm 0.8916,0.8916,0.4089,90,90,120 - - 5.36 X 34422
Al-Ni-Y YNi3Al9 DyNi3Al9,hR99,155 R32 0.72894,0.72894,2.743,90,90,120 - - 4.01 X 27128
Al-Ni-Y YNi3.91 Al1.09 CaCu5,hP6,191 P6/mmm 0.49713,0.49713,0.40451,90,90,120 - - 6.67 X 44960
Al-Ni-Y Y0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.42038,0.42038,0.91316,90,90,120 - - 4.03 A 59682
Al-Ni-Y Y2Ni2Al W2CoB2,oI10,71 Immm 0.4181,0.5418,0.842,90,90,90 - - 5.61 X 11393
Al-Ni-Y Y2Ni3Al7 *,h**,* - 1.798,1.798,0.407,90,90,120 - - - N 10610
Al-Ni-Y Y3Ni5Al19 Gd3Ni5Al19,oS108,63 Cmcm 0.408,1.604,2.729,90,90,90 - - 3.99 A 10610
Al-Ni-Y Y3Ni6Al2 Ce3Ni6Si2,cI44,229 Im-3m 0.8915,0.8915,0.8915,90,90,90 - - 6.31 X 26480
Al-Ni-Y Y3Ni8Al Ce3Co8Si,hP24,194 P63/mmc 0.508,0.508,1.627,90,90,120 Laves-CaCu5 - 6.97 A 10610
Al-Ni-Y Y4Ni6Al23 Y4Ni6Al23,mS66,12 C12/m1 1.5836,0.40681,1.8311,90,112.97,90 - - 4.06 X 25786
Al-Ni-Yb YbNiAl ht-hp MgZn2,hP12,194 P63/mmc 0.5293,0.5293,0.8518,90,90,120 Friauf-Laves phase - 8.32 A 20055
Al-Ni-Yb YbNiAl ZrNiAl,hP9,189 P-62m 0.6949,0.6949,0.3771,90,90,120 Fe2P family - 8.17 A 30412
Al-Ni-Yb YbNiAl2 MgCuAl2,oS16,63 Cmcm 0.40402,0.9889,0.6824,90,90,90 - - 6.96 X 26902
Al-Ni-Yb YbNi0.8 Al4.2 YNiAl4,oS24,63 Cmcm 0.4049,1.5305,0.6586,90,90,90 - - 5.42 A 46758
Al-Ni-Yb YbNi3 Al9.23 YbNi3 Al9.23 ,hR81,155 R32 0.72443,0.72443,2.7251,90,90,120 - - 4.81 X 56605
Al-Ni-Yb Yb0.67 Ni2Al6 Yb0.67 Ni2Al6,hP11,187 P-6m2 0.4189,0.4189,0.90982,90,90,120 - - 4.75 X 59682
Al-Ni-Yb Yb2Ni2Al rt W2CoB2,oI10,71 Immm 0.4087,0.5614,0.8314,90,90,90 - - 8.54 A 15468
Al-Ni-Yb Yb3Ni5Al19 Gd3Ni5Al19,oS108,63 Cmcm 0.4073,1.6091,2.7099,90,90,90 - - 4.96 A 46758
Al-Ni-Yb Yb4Ni6Al23 Y4Ni6Al23,mS66,12 C12/m1 1.5834,0.4069,1.818,90,112.84,90 - - 5.12 X 32520
236 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ni-Zn Zn0.12 Ni3Al0.88 Cu3Au,cP4,221 Pm-3m 0.3573,0.3573,0.3573,90,90,90 close-packed structure - 7.56 X 17833
Al-Ni-Zr ZrNiAl ZrNiAl,hP9,189 P-62m 0.6906,0.6906,0.3464,90,90,120 Fe2P family gray light 6.16 X 36786
Al-Ni-Zr ZrNi0.3 Al1.7 MgCu2,cF24,227 Fd-3m 0.742,0.742,0.742,90,90,90 Friauf-Laves phase - 5.03 X 3099
Al-Ni-Zr ZrNi0.48 Al2.52 m Cu3Au,cP4,221 Pm-3m 0.406,0.406,0.406,90,90,90 close-packed structure - 4.65 X 2865
Al-Ni-Zr ZrNi1.6 Al4.6 ZrNi2Al5,tI16,139 I4/mmm 0.40193,0.40193,1.44304,90,90,90 - - 4.41 X 56211
Al-Ni-Zr ZrNi2Al rt cub Cu2MnAl,cF16,225 Fm-3m 0.6106,0.6106,0.6106,90,90,90 b.c.c. family - 6.87 X 16356
Al-Ni-Zr Zr0.01 Ni3Al0.99 Cu3Au,cP4,221 Pm-3m 0.3573,0.3573,0.3573,90,90,90 close-packed structure - 7.42 X 26629
Al-Ni-Zr Zr0.5 NiAl0.5 tf CsCl,cP2,221 Pm-3m 0.302,0.302,0.302,90,90,90 b.c.c. family - 7.10 X 1720
Al-Ni-Zr Zr2.5 Ni2Al0.5 m Zr3Al2,tP20,136 P42 /mnm 0.71651,0.71651,0.66506,90,90,90 - - 6.98 X 46385
Al-Ni-Zr Zr5Ni4Al rt Zr5Ni4Al,tP20,84 P42 /m 0.7167,0.7167,0.6598,90,90,90 - - 7.03 X 46385
Al-Ni-Zr Zr6NiAl2 K2UF6,hP9,189 P-62m 0.7928,0.7928,0.3347,90,90,120 Fe2P family - 6.02 A 35805
Al-Ni-Zr Zr6Ni7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.208,1.208,1.208,90,90,90 - - 5.24 A 3099
Al-Np-Pd NpPd2Al3 PrNi2Al3,hP6,191 P6/mmm 0.5391,0.5391,0.4196,90,90,120 - - 8.35 X 29469
Al-Np-Pd NpPd5Al2 ZrNi2Al5,tI16,139 I4/mmm 0.4141,0.4141,1.46851,90,90,90 - - 10.85 X 51253
Al-O-P AlP 3O9 cub AlP 3O9,cI208,220 I-43d 1.363,1.363,1.363,90,90,90 - - 2.77 X 141
Al-O-P AlP 3O9 mon1 AlP 3O9,mS156,9 C1c1 1.28725,1.8687,0.9222,90,126.766,90 - - 2.96 X 9598
Al-O-P AlP 3O9 mon2 CrP3O9,mP52,14 P121/c1 0.60931,1.50676,0.82016,90,105.166,90 - colorless 2.41 X 53685
Al-O-P AlP 3O9 trig AlP 3O9,hP78,165 P-3c1 1.0935,1.0935,0.9191,90,90,120 - white 2.76 X 38317
Al-O-P Al[PO4] 8 rt Al[PO4],oS216,36 Cmc21 3.3227,1.4745,0.83807,90,90,90 zeolite AET - 1.78 X 27825
Al-O-P Al[PO4] AFI Al[PO4],hP72,184 P6cc 1.3718,1.3718,0.84526,90,90,120 zeolite AFI - 1.76 X 37810
Al-O-P Al[PO4] VFI Al[PO4],hP108,185 P63 cm 1.86005,1.86005,0.83664,90,90,120 zeolite VFI - 1.45 X 26308
Al-O-P Al[PO4] ber ht Al[PO4],hP18,180 P6222 0.50387,0.50387,1.1061,90,90,120 berlinite high colorless 2.50 X 33617
Al-O-P Al[PO4] ber rt Al[AsO4],hP18,152 P3121 0.49458,0.49458,1.09526,90,90,120 berlinite low colorless 2.62 X 48037
Al-O-P Al[PO4] hp mon1 Al[PO4],mP72,14 P121/c1 0.61322,1.43465,0.85762,90,104.743,90 - - 3.33 X 55815
Al-O-P Al[PO4] hp mon2 Al[PO4],mP36,13 P12/c1 1.08602,0.48586,0.87438,90,90.128,90 - - 2.63 X 58342
Al-O-P Al[PO4] hp tricl Zn[MoO4],aP36,2 P-1 0.61328,0.75151,0.85801,98.263,104.622,102.14 - - 3.32 X 55815
Al-O-P Al[PO4] hp Cr[VO4],oS24,63 Cmcm 0.506,0.677,0.519,90,90,90 - - 4.56 A 37454
Al-O-P Al[PO4] ht1 cub Al[PO4],cF56,216 F-43m 0.71969,0.71969,0.71969,90,90,90 - colorless 2.17 X 42012
Al-O-P Al[PO4] ht1 orth Al[PO4],oP96,61 Pbca 0.8935,1.9816,1.0047,90,90,90 zeolite APC - 1.82 X 24129
Al-O-P Al[PO4] ht2 mon Al[PO4],mS144,12 C12/m1 2.52366,1.03132,1.26975,90,119.863,90 - - 1.70 X 46204
Al-O-P Al[PO4] ht2 orth Al[PO4],oP96,29 Pca21 1.9187,0.8576,0.9804,90,90,90 zeolite APD - 2.01 X 24129
Al-O-P Al[PO4] mon1 Al[PO4],mS432,8 C1m1 1.8468,3.19703,1.66759,90,90.,90 zeolite VFI - 1.48 X 37806
Al-O-P Al[PO4] mon2 Al[PO4],mP60,4 P1211 0.97179,0.83591,1.37915,90,110.6,90 - - 1.93 X 29679
Al-O-P Al[PO4] mon3 Al[PO4],mP288,7 P1c1 3.42111,0.50455,2.62217,90,104.864,90 - white 2.22 X 36840
Al-O-P Al[PO4] mon4 Al[PO4],mS144,15 C12/c1 1.37114,1.27314,1.85703,90,90.01,90 - white 1.50 X 25700
Al-O-P Al[PO4] mon6 Al[PO4],mS216,8 C1m1 1.85218,3.21247,0.84003,90,90.,90 zeolite VFI - 1.46 X 37806
Al-O-P Al[PO4] mon7 Al[PO4],mS72,5 C121 1.6444,0.51075,1.34846,90,91.741,90 - - 2.15 X 37813
Al-O-P Al[PO4] mon8 Al[PO4],mS192,15 C12/c1 2.25541,1.37357,1.40756,90,98.617,90 - colorless 1.50 X 48084
Al-O-P Al[PO4] orth2 Al[PO4],oI120,46 Ima2 1.84821,1.35336,0.83703,90,90,90 zeolite AEL - 1.93 X 21072
Al-O-P Al[PO4] orth4 Al[PO4],oP144,27 Pcc2 1.3794,2.39,0.84168,90,90,90 zeolite AFI white 1.75 X 31876
Al-O-P Al[PO4] orth5 Al[PO4],oP144,61 Pbca 0.9663,1.8031,1.3918,90,90,90 zeolite AEN - 2.00 X 37814
Al-O-P Al[PO4] orth6 Al[PO4],oP144,34 Pnn2 1.37711,2.3846,0.83769,90,90,90 - - 1.77 X 36092
Al-O-P Al[PO4] rhom Al[PO4]-b,hR108,148 R-3 1.37157,1.37157,1.49273,90,90,120 zeolite CHA - 1.50 X 52017
Al-O-P Al[PO4] rt Al[PO4],oS24,20 C222 1 0.70843,0.70823,0.69989,90,90,90 - colorless 2.31 X 42012
Al-O-P Al[PO4] tet Al[PO4],tI12,82 I-4 0.485,0.485,0.66,90,90,90 - - 2.61 X 72
Al-O-P Al[PO4] tricl ht Al[PO4],hP12,186 P63 mc 0.50976,0.50976,0.83441,90,90,120 - white 2.16 X 38403
Al-O-P Al[PO4] tricl rt Al[PO4],aP240,1 P1 1.00129,1.00203,4.15485,86.558,83.106,60.044 - white 2.26 X 36840
Al-O-P Al[PO4] trid Al[PO4],mP12,4 P1211 0.50748,0.83009,0.508,90,119.625,90 - white 2.18 X 39747
Al-O-P Al0.5 P0.5 O2 8 ht (Al0.5P 0.5 )O2,oS144,63 Cmcm 1.37011,1.27298,1.85715,90,90,90 zeolite AEI - 1.50 X 52017
Al-O-P Al0.5 P0.5 O2 orth3 Al0.5 P0.5 O2 ,oI120,74 Imma 0.83703,1.84845,1.35333,90,90,90 - - 1.93 X 21072
Al-O-Pb Al12PbO19 BaFe12O19 ,hP66,194 P63 /mmc 0.55711,0.55711,2.2045,90,90,120 magnetoplumbite family - 4.68 X 23724
Al-O-Pb Al2PbO4 mon Al2PbO4,mP14,4 P1211 0.507,0.8458,0.52668,90,118.756,90 - - 5.45 X 15643
Al-O-Pb Al2PbO4 orth1 Al2PbO4,oS28,40 Ama2 0.8458,0.9234,0.507,90,90,90 - - 5.45 X 29885
Al-O-Pb Al2PbO4 orth2 *,oP42,17 P222 1 0.508,0.923,0.845,90,90,90 - - - N 3491
Al-O-Pb Al2PbO4 tricl Al2PbO4,aP14,1 P1 0.507,0.52668,0.8458,90.,90.,118.756 - - 5.45 X 15643
Al-O-Pb Al8Pb8.46 O20.46 Al8Pb9O21 ,cP152,205 Pa-3 1.32522,1.32522,1.32522,90,90,90 - colorless 6.55 X 50877
Al-O-Pr PrAlO3 ht tet BaTiO3,tP5,99 P4mm 0.374,0.374,0.376,90,90,90 perovskite family - 6.82 A 2374
Al-O-Pr PrAlO3 rt LaAlO3,hR30,167 R-3c 0.53269,0.53269,1.29575,90,90,120 perovskite family - 6.76 X 52629
Al-O-Pr Pr0.83 Al11.83 O19 Pr0.83 Al11.83 O19,hP82,194 P63 /mmc 0.55582,0.55582,2.1999,90,90,120 magnetoplumbite family green pale 4.18 X 27854
Al-O-Pr Pr4Al2O9 *,mP60,14 P121/c1 0.78,1.103,1.131,90,109.6,90 - - - N 31696
Al-O-Pu PuAlO3 LaAlO3,hR30,167 R-3c 0.5367,0.5367,1.312,90,90,120 perovskite family - 9.71 A 2689
Al-O-Rb RbAlO2 *,cF40,227 Fd-3m 0.791,0.791,0.791,90,90,90 - - - N 2164
Al-O-Rb RbAl11O17 TlAl11O17 ,hP72,194 P63 /mmc 0.56,0.56,2.287,90,90,120 β-alumina colorless 3.50 X 10027
Al-O-Rb Rb0.33 Al3O4.67 Na0.33 Al3O4.67 ,oP26,55 Pbam 0.76807,0.76905,0.2942,90,90,90 - - 3.51 A 50770
Al-O-Rb Rb3AlO3 Rb3InS3,mS28,12 C12/m1 0.72592,1.14333,0.67806,90,104.05,90 - colorless 4.03 X 29603
Al-O-S Al2[SO4]3 Fe2[SO4]3,hR102,148 R-3 0.8032,0.8032,2.136,90,90,120 millosevichite - 2.86 X 12797
Al-O-Sb Al0.5 Sb0.5 O2 TiO2,tP6,136 P42 /mnm 0.4524,0.4524,0.29734,90,90,90 - - 5.80 A 29414
Al-O-Sc ScAlO3 GdFeO3,oP20,62 Pnma 0.52313,0.72007,0.49355,90,90,90 perovskite family pink faint 4.29 X 12837
Al-O-Sc Sc3.31 Al0.69 O6 Mg3[TeO6 ],hR60,148 R-3 0.87745,0.87745,1.01333,90,90,120 - colorless 3.88 X 43990
Al-O-Se Al2Se6O15 *,mP*,14 P121/c1 1.0825,1.1214,1.51492,90,130.472,90 - white - N 39929
Al-O-Se Al2[SeO4]3 Fe2[SO4]3,hR102,148 R-3 0.829,0.829,2.2345,90,90,120 - - 3.62 A 3920
Al-O-Si Al13Si35O89.5 Al13Si35O89.5 ,cF672,227 Fd-3m 2.449,2.449,2.449,90,90,90 zeolite FAU - 1.25 X 22351
Al-O-Si Al2SiO5 and Al2[SiO4]O,oP32,58 Pnnm 0.7798,0.79031,0.55566,90,90,90 andalusite green faint 3.14 X 12243
Al-O-Si Al2Si4O11 Al2Si4O11,aP17,2 P-1 0.5191,0.51932,0.9499,85.948,79.79,61.403 pyrophyllite 1A - 2.57 X 6536
Al-O-Si Al2[SiO4]O kya Al2[SiO4]O-b,aP32,2 P-1 0.5576,0.71301,0.7867,73.88,90.14,78.86 kyanite - 3.66 X 53050
Al-O-Si Al2[SiO4]O sil Al2[SiO4]O-a,oP32,62 Pnma 0.76808,0.57774,0.74883,90,90,90 sillimanite brown dark 3.24 X 12243
Al-O-Si Al2.4 Si0.6 O4.8 Al(Al0.7 Si0.3)2O4.8 ,oP24,55 Pbam 0.75785,0.76817,0.28864,90,90,90 mullite gray 3.13 X 18857
Al-O-Si Al4.6 Si20.55 O48 Al4.6 Si20.55 O48,oS184,64 Cmce 0.74422,1.85324,1.91877,90,90,90 zeolite MOR - 1.84 X 51592
Handbook of Inorganic Substances – Edition 2015 : Data 237

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-O-Sm SmAlO3 ht LaAlO3,hR30,167 R-3c 0.53417,0.53417,1.29899,90,90,120 perovskite family - 7.00 A 834


Al-O-Sm SmAlO3 m YAlO3,hP10,194 P63/mmc 0.3785,0.3785,1.056,90,90,120 - - 5.71 A 3993
Al-O-Sm SmAlO3 rt GdFeO3,oP20,62 Pnma 0.52904,0.7474,0.52912,90,90,90 perovskite family yellow 7.16 X 6809
Al-O-Sm Sm4 Al2O9 Eu4Al2O9,mP60,14 P121/c1 0.762,1.068,1.115,90,108.5,90 - - 6.17 A 4621
Al-O-Sr SrAl12O19 Fe12PbO19,hP64,194 P63/mmc 0.5562,0.5562,2.1972,90,90,120 magnetoplumbite family - 4.04 X 8833
Al-O-Sr SrAl2O4 ht1 SrAl2O4,hP42,173 P63 0.89291,0.89291,0.84963,90,90,120 - - 3.49 X 49081
Al-O-Sr SrAl2O4 ht2 BaAl2O4,hP18,182 P6322 0.51765,0.51765,0.85758,90,90,120 - - 3.43 X 49081
Al-O-Sr SrAl2O4 rt SrAl2O4,mP28,4 P1211 0.51568,0.88234,0.84422,90,93.409,90 - colorless 3.56 X 47113
Al-O-Sr SrAl4O7 hp SrAl4O7,oS48,67 Cmme 0.8085,1.1845,0.4407,90,90,90 - - 4.84 X 15005
Al-O-Sr SrAl4O7 rt CaAl4O7,mS48,15 C12/c1 1.30389,0.90113,0.55358,90,106.12,90 - - 3.27 X 6440
Al-O-Sr Sr10 Al6O19 Sr10Ga6O19,mS280,15 C12/c1 3.45823,0.7846,1.57485,90,103.68,90 - - 4.29 X 40653
Al-O-Sr Sr2Al6O11 Ba2Fe6O11,oP76,58 Pnnm 0.48843,2.19145,0.84039,90,90,90 - - 3.79 X 39998
Al-O-Sr Sr3Al2O6 Ca3Al2O6,cP264,205 Pa-3 1.58556,1.58556,1.58556,90,90,90 - white 4.13 X 25796
Al-O-Sr Sr4Al14O25 Sr4Al14O25,oP86,51 Pmma 2.47451,0.84735,0.48808,90,90,90 - - 3.66 X 36077
Al-O-Sr Sr7Al12O25 Sr7Al12O25,hP138,143 P3 1.791,1.791,0.716,90,90,120 - - 3.35 X 12758
Al-O-Ta TaAlO4 orth CaTeO4,oP24,60 Pbcn 0.4473,1.1308,0.4775,90,90,90 alumotantite white 7.48 X 25868
Al-O-Ta TaAlO4 rt NbFeO4,mS24,12 C12/m1 1.2135,0.3776,0.6449,90,107.74,90 - - 6.42 X 25507
Al-O-Ta Ta0.5 Al0.5 O2 ht TiO2 ,tP6,136 P42/mnm 0.46065,0.46065,0.2985,90,90,90 - rose light 7.13 X 16691
Al-O-Tb TbAlO3 hex YAlO3,hP10,194 P63/mmc 0.371,0.371,1.051,90,90,120 - - 6.20 A 1881
Al-O-Tb TbAlO3 orth GdFeO3,oP20,62 Pnma 0.5308,0.7415,0.5229,90,90,90 perovskite family colorless 7.55 X 25724
Al-O-Tb Tb3Al5O12 Y3 Al5O12,cI160,230 Ia-3d 1.2,1.2,1.2,90,90,90 garnet family yellow 6.18 X 4389
Al-O-Tb Tb4Al2O9 rt Eu4Al2O9,mP60,14 P121/c1 0.74831,1.05569,1.11507,90,108.96,90 - - 6.65 X 52529
Al-O-Te Al2Te 4O11 Cr2Te4O11,mP34,14 P121/c1 0.6906,0.7477,0.9529,90,99.28,90 - - 5.06 A 9562
Al-O-Ti TiAl2O5 ht1 TiFe 2O5,oS32,63 Cmcm 0.3605,0.9445,0.9653,90,90,90 - blue 3.68 X 44248
Al-O-Ti Ti0.67 Al0.33 O1.83 TiO2 ,tI12,141 I41/amd 0.3784,0.3784,0.948,90,90,90 anatase - 3.44 A 22329
Al-O-Ti Ti0.984 Al0.016 O1.992 TiO2 ,tP6,136 P42/mnm 0.45931,0.45931,0.29583,90,90,90 rutile - 4.23 X 36151
Al-O-Ti Ti1.98 Al0.02 O3 Al2O3,hR30,167 R-3c 0.51526,0.51526,1.3609,90,90,120 - - 4.57 X 10806
Al-O-Ti Ti2Al6O13 (Ti0.29 Al0.71)7AlO13,oS42,38 Amm2 1.2554,0.36509,0.9368,90,90,90 - blue light 3.60 X 44199
Al-O-Ti Ti3AlO0.01 rt BaNiO3,hP10,194 P63/mmc 0.57817,0.57817,0.46395,90,90,120 perovskite family - 4.22 X 46384
Al-O-Ti Ti5Al16O34 Ti5Al16O34,oS220,63 Cmcm 0.364,0.93107,6.5321,90,90,90 - - 3.65 X 45192
Al-O-Ti Ti5Al3O2 *,cP*,* - 0.691,0.691,0.691,90,90,90 - - - N 33021
Al-O-Ti Ti7Al2O15 Ti7Al2O15,mS48,12 C12/m1 1.7674,0.29737,0.9358,90,98.66,90 - - 4.30 X 21538
Al-O-Tl TlAlO2 ht TlAlO2,hR24,166 R-3m 0.5431,0.5431,1.4,90,90,120 - - 7.34 X 7076
Al-O-Tl TlAlO3 *,cF692,* - 2.11,2.11,2.11,90,90,90 - - - N 6268
Al-O-Tl TlAl11O17 TlAl11O17,hP70,194 P63/mmc 0.5596,0.5596,2.2912,90,90,120 β-alumina colorless 4.13 X 10811
Al-O-Tm TmAlO3 GdFeO3,oP20,62 Pnma 0.53277,0.73335,0.51435,90,90,90 perovskite family green 8.06 A 6182
Al-O-Tm Tm3 Al5O12 Y3 Al5O12,cI160,230 Ia-3d 1.1956,1.1956,1.1956,90,90,90 garnet family green 6.48 A 20100
Al-O-Tm Tm4 Al2O9 rt Eu4Al2O9,mP60,14 P121/c1 0.7301,1.03739,1.10576,90,108.387,90 - - 7.30 A 30149
Al-O-V Al[VO4] Zn[MoO4],aP36,2 P-1 0.65323,0.77498,0.91233,96.175,107.234,101.404 - - 3.32 X 52815
Al-O-V VAl2O4 MgAl2O4,cF56,227 Fd-3m 0.8242,0.8242,0.8242,90,90,90 spinel family - 4.01 A 4668
Al-O-V V0.01 Al1.99 O3 hp Al2O3,hR30,167 R-3c 0.4757,0.4757,1.2999,90,90,120 - - 4.00 A 5425
Al-O-V V0.965Al0.035 O2 ht2 *,oP12,* - 0.2881,0.6262,0.6473,90,90,90 - - 4.67 N 3445
Al-O-V V0.985 Al0.015 O2 ht mon VO2 -a,mS24,12 C12/m1 0.906,0.58,0.45217,90,91.85,90 - - 4.62 X 10828
Al-O-V V0.985 Al0.015O2 ht tricl VO2 ,aP12,2 P-1 0.45212,0.53579,0.53765,64.767,89.106,89.103 - - 4.66 X 10828
Al-O-V V0.985 Al0.015 O2 rt TiO2 ,tP6,136 P42/mnm 0.45546,0.45546,0.28528,90,90,90 - - 4.63 X 10828
Al-O-V V1.33 Al1.33 O4 MgAl2O4,cF56,227 Fd-3m 0.8422,0.8422,0.8422,90,90,90 spinel family black 3.73 X 5425
Al-O-V V1.99 Al0.01 O3 hp Al2O3,hR30,167 R-3c 0.4982,0.4982,1.386,90,90,120 - - 5.00 A 5425
Al-O-V V2 AlO4 ht MgAl2O4,cF56,227 Fd-3m 0.8192,0.8192,0.8192,90,90,90 spinel family - 4.66 X 16671
Al-O-V V2 AlO4 rhom V2 AlO4,hR84,166 R-3m 0.57515,0.57515,2.88541,90,90,120 - - 4.65 X 47379
Al-O-V V2 Al0.33 O5 lt *,mS*,12 C12/m1 1.2187,0.3672,1.0314,90,103.5,90 - - - N 18241
Al-O-V V2.54 Al0.46 O5 V3O5,mS32,15 C12/c1 0.9979,0.5033,0.69426,90,111.559,90 - - 4.54 A 10142
Al-O-V V3.4 Al0.6 O7 Ti4O7-a,aP22,2 P-1 0.5501,0.67948,0.70021,64.117,71.001,75.732 - - 4.53 A 10142
Al-O-W Al2[WO4]3 hp1 Fe2[MoO4]3,mP136,14 P121/c1 1.53178,0.89367,1.5235,90,109.318,90 - - 5.38 A 45003
Al-O-W Al2[WO4]3 hp2 *,mP68,4 P1211 0.78415,1.25182,0.95929,90,91.992,90 - - - N 43249
Al-O-W Al2[WO4]3 ht Sc2[WO4]3,oP68,60 Pbcn 1.2571,0.9046,0.9129,90,90,90 - colorless 5.10 X 27736
Al-O-W Al2[WO4]3 rt Al2[WO4]3,mP68,4 P1211 0.8962,0.908,1.2587,90,90.06,90 - colorless 5.17 X 27736
Al-O-W WAlO4 mon WAlO4,mS24,12 C12/m1 0.9069,0.5705,0.4541,90,92.29,90 - black 7.78 X 9161
Al-O-W WAlO4 orth WAlO4,oS12,65 Cmmm 0.632,0.657,0.285,90,90,90 - - 7.71 X 9862
Al-O-W W5Al2O16 W5Al2O16,tI46,139 I4/mmm 0.375,0.375,3.95,90,90,90 - - 7.35 X 50959
Al-O-Y YAlO3 ht GdFeO3,oP20,62 Pnma 0.5301,0.73418,0.5161,90,90,90 perovskite family colorless 5.42 X 43344
Al-O-Y YAlO3 rt YAlO3,hP10,194 P63/mmc 0.368,0.368,1.052,90,90,120 - - 4.41 X 1881
Al-O-Y Y3 Al5O12 ht Y3 Al5O12,cI160,230 Ia-3d 1.20062,1.20062,1.20062,90,90,90 garnet family white 4.56 X 35551
Al-O-Y Y4 Al2O9 ht Y4 Al2O9,mP60,14 P121/c1 0.74804,1.05461,1.12057,90,108.927,90 - - 4.40 X 34888
Al-O-Y Y4 Al2O9 rt Eu4Al2O9,mP60,14 P121/c1 0.7375,1.0507,1.1113,90,108.58,90 - - 4.50 X 24335
Al-O-Yb YbAlO3 GdFeO3,oP20,62 Pnma 0.53314,0.73132,0.51261,90,90,90 perovskite family colorless 8.24 X 54671
Al-O-Yb Yb3 Al5O12 Y3 Al5O12,cI160,230 Ia-3d 1.19386,1.19386,1.19386,90,90,90 garnet family colorless 6.61 X 38483
Al-O-Yb Yb4 Al2O9 rt Eu4Al2O9,mP60,14 P121/c1 0.72636,1.03375,1.10256,90,108.293,90 - - 7.52 A 30149
Al-O-Zn ZnAl2O4 MgAl2O4,cF56,227 Fd-3m 0.80846,0.80846,0.80846,90,90,90 gahnite white 4.61 X 52338
Al-O-Zn Zn0.943 Al0.038 O ZnO,hP4,186 P63mc 0.32518,0.32518,0.51839,90,90,120 adamantane structure - 5.50 A 46895
Al-O-Zr Zr0.33 Al0.67 O1.665 ht2 CaF2 ,cF12,225 Fm-3m 0.509,0.509,0.509,90,90,90 fluorite family - 3.77 X 876
Al-O-Zr Zr0.36 Al2.20 O4 Fe3O4,cF56,227 Fd-3m 0.7864,0.7864,0.7864,90,90,90 spinel family - 4.27 A 22746
Al-O-Zr Zr0.68 Al0.32 O2 ht1 ZrO2,tP6,137 P42/nmc 0.36013,0.36013,0.5189,90,90,90 fluorite family - 5.07 A 22746
Al-O-Zr Zr0.76 Al0.24 O2 rt ZrO2-b,mP12,14 P121/c1 0.51639,0.50937,0.53352,90,99.2,90 - - 5.17 A 22746
Al-O-Zr Zr5Al3O0.17 CuHf5Sn3,hP18,193 P63/mcm 0.8248,0.8248,0.5706,90,90,120 AlB2 family - 5.33 X 21314
Al-O-Zr Zr5Al3O0.5 Zr5Al3O0.5 ,hP52,186 P63mc 1.41552,1.41552,0.56862,90,90,120 - - 5.50 X 28369
Al-Os-Pr PrOs2Al10 YbFe 2Al10,oS52,63 Cmcm 0.9181,1.0262,0.9152,90,90,90 - - 6.09 A 34696
Al-Os-Pr Pr3Os4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.8904,0.8904,0.9638,90,90,120 - gray dark 7.56 A 40923
Al-Os-Sc Sc6Os7Al16 Mg6 Cu16Si7,cF116,225 Fm-3m 1.241,1.241,1.241,90,90,90 - - 7.07 A 7364
238 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Os-Sm Sm2Os3Al15 Sm2Os3Al15,hP84,193 P63 /mcm 1.30605,1.30605,0.90535,90,90,120 - gray 6.34 X 53386


Al-Os-Sm Sm3Os4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.8861,0.8861,0.9585,90,90,120 - gray dark 7.83 A 40923
Al-Os-Sm Sm3.5 Os6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63 /mcm 1.3058,1.3058,0.9063,90,90,120 - gray silver 6.18 A 42976
Al-Os-Tb Tb3Os4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.8799,0.8799,0.9515,90,90,120 - gray dark 8.13 A 40923
Al-Os-Tb Tb3.5 Os6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63 /mcm 1.3019,1.3019,0.9034,90,90,120 - gray silver 6.31 A 42976
Al-Os-Ti Ti1.15 Os0.15 Al2.7 Cu3Au,cP4,221 Pm-3m 0.39724,0.39724,0.39724,90,90,90 close-packed structure - 4.14 X 42939
Al-Os-Ti Ti6Os7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.2222,1.2222,1.2222,90,90,90 - - 7.46 A 3206
Al-Os-Ti Ti9.0 Os7Al14.0 (Ti0.42 Al0.58)15Pt7Al8,cF120,225 Fm-3m 1.22747,1.22747,1.22747,90,90,90 - - 7.69 X 42939
Al-Os-Tm Tm3Os4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.8752,0.8752,0.9465,90,90,120 - gray dark 8.42 A 40923
Al-Os-Tm Tm3.5 Os6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63 /mcm 1.2973,1.2973,0.9003,90,90,120 - gray silver 6.47 A 42976
Al-Os-U UOsAl *,h**,* - 0.9331,0.9331,3.4704,90,90,120 - - - N 2440
Al-Os-U UOs0.4 Al1.6 *,h**,* P63 /mmc 0.6827,0.6827,2.6398,90,90,120 - - 4.45 N 2440
Al-Os-U UOs0.5 Al1.5 MgZn2,hP12,194 P63 /mmc 0.538,0.538,0.8482,90,90,120 Friauf-Laves phase - 11.67 X 2426
Al-Os-Y Y3Os4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.8819,0.8819,0.9492,90,90,120 - gray dark 7.02 A 40923
Al-Os-Y Y3.93 Os6Al30.75 Y3.93 Os6Al30.75 ,hP90,193 P63 /mcm 1.3015,1.3015,0.903,90,90,120 - gray silver 5.82 X 42976
Al-Os-Yb Yb3.5 Os6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63 /mcm 1.2996,1.2996,0.9024,90,90,120 - gray silver 6.47 A 42976
Al-Os-Zr ZrOsAl MgZn2,hP12,194 P63 /mmc 0.522,0.522,0.848,90,90,120 Friauf-Laves phase - 10.24 A 8294
Al-Os-Zr Zr6Os7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.2409,1.2409,1.2409,90,90,90 - - 8.03 A 3206
Al-P-Pd Pd2Al0.5P 0.5 Fe2P,hP9,189 P-62m 0.6626,0.6626,0.3355,90,90,120 Fe2P family - 9.44 A 18138
Al-P-Pt Pt5AlP TlPd5As,tP7,123 P4/mmm 0.3896,0.3896,0.6818,90,90,90 - - 16.58 A 5603
Al-P-S AlPS4 AlPS4,oP12,16 P222 0.561,0.567,0.905,90,90,90 - colorless 2.15 X 1284
Al-P-Si AlSiP 3 AlSiP 3,oP20,62 Pnma 0.5861,0.9872,0.6088,90,90,90 - black 2.79 X 12515
Al-P-Sr Sr3Al2P4 Ca3Al2As4 ,mS36,15 C12/c1 1.3146,1.0176,0.6657,90,88.87,90 - red 3.29 X 35286
Al-P-Zr Zr2Al0.7P 0.3 CuAl2,tI12,140 I4/mcm 0.6656,0.6656,0.549,90,90,90 - - 5.75 A 27326
Al-P-Zr Zr5Al1.1P 1.9 Mn5Si3,hP16,193 P63 /mcm 0.8041,0.8041,0.5633,90,90,120 - - 5.73 A 27326
Al-Pb-S Al2PbS4 rt *,tP7,* - 0.516,0.516,0.5957,90,90,90 - yellow 4.08 N 434
Al-Pb-Se Al2PbSe4 CaAl2Se4,oS36,66 Cccm 0.636,1.063,1.078,90,90,90 - - 5.26 X 13554
Al-Pb-Sr SrAl2Pb2 CeAl2Ga2,tI10,139 I4/mmm 0.446,0.446,1.119,90,90,90 - - 8.30 X 7079
Al-Pb-Sr Sr10.87Al4Pb3.13 Ca11Ga7,cF144,225 Fm-3m 1.7319,1.7319,1.7319,90,90,90 - - 4.37 X 50550
Al-Pd-Pu PuPd2Al3 PrNi2Al3,hP6,191 P6/mmm 0.5403,0.5403,0.4202,90,90,120 - - 8.41 X 34524
Al-Pd-Pu PuPd5Al2 ZrNi2Al5,tI16,139 I4/mmm 0.41302,0.41302,1.48428,90,90,90 - - 10.89 X 52766
Al-Pd-Re Re19.2Pd33.3 Al165.5 Re19.2Pd33.3 Al165.5 ,hP230,159 P31c 1.23744,1.23744,2.7489,90,90,120 - - 5.28 X 57098
Al-Pd-Rh Rh0.06Pd0.82 Al1.12 CsCl,cP2,221 Pm-3m 0.29883,0.29883,0.29883,90,90,90 b.c.c. family - 7.69 X 46381
Al-Pd-Rh Rh0.27Pd0.06 Al0.67 *,h**,* - 1.0916,1.0916,1.3386,90,90,120 - - - N 46381
Al-Pd-Rh Rh0.75Pd0.25 Al2.13 ht RhAl2.63 ,cP54,195 P23 0.76979,0.76979,0.76979,90,90,90 - - 4.70 A 46381
Al-Pd-Rh Rh1.76Pd0.385 Al8.855 Co2Al9,mP22,14 P121/c1 0.6357,0.6422,0.8725,90,94.9,90 - - 4.31 A 46381
Al-Pd-Rh Rh10Pd13Al41 Fe2Pd21Al39,cF296,202 Fm-3 1.54831,1.54831,1.54831,90,90,90 - - 6.30 A 46381
Al-Pd-Rh Rh2.8 Pd0.25 Al6.95 ht *,m**,* - 0.6599,0.3809,1.0306,90,102.39,90 - - - N 46381
Al-Pd-Ru Ru12.6Pd19.7 Al69.5 *,cF*,202 Fm-3 1.55659,1.55659,1.55659,90,90,90 - - - N 50659
Al-Pd-Ru Ru14.5Pd13 Al72.5 *,cF*,* - 3.96,3.96,3.96,90,90,90 - - - N 50659
Al-Pd-Ru Ru15.4Pd25.6 Al87 Ru15.4Pd25.6 Al87,cP296,195 P23 1.554,1.554,1.554,90,90,90 - - 5.87 X 32510
Al-Pd-Ru Ru16.5Pd12.5 Al71 rt *,cI*,204 Im-3 1.5532,1.5532,1.5532,90,90,90 - - - N 50659
Al-Pd-Ru Ru18.1Pd7.5 Al74.4 *,cP*,200 Pm-3 0.77568,0.77568,0.77568,90,90,90 - - - N 50659
Al-Pd-Sc ScPd2Al Cu2MnAl,cF16,225 Fm-3m 0.6327,0.6327,0.6327,90,90,90 b.c.c. family - 7.47 X 20154
Al-Pd-Sc Sc1.05Pd2.17 Al3.78 Cd6Y,cI184,204 Im-3 1.395,1.395,1.395,90,90,90 - - 5.58 X 58553
Al-Pd-Sc Sc6Pd7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.234,1.234,1.234,90,90,90 - - 5.11 A 7364
Al-Pd-Si PdAl0.75 Si0.25 rt Al+ FeSi,cP8,198 P213 0.484,0.484,0.484,90,90,90 - - 7.83 X 923
Al-Pd-Si Pd0.6 Al1.95 Si0.45 m CaF2,cF12,225 Fm-3m 0.5926,0.5926,0.5926,90,90,90 fluorite family - 4.12 X 15268
Al-Pd-Si Pd12Al2Si5 Th7S12,hP20,176 P63 /m 0.9238,0.9238,0.3599,90,90,120 - - 9.18 A 14776
Al-Pd-Si Pd8Al17Si4 ht-hp Pd8Al17Si4 ,tI116,88 I41/a 1.2962,1.2962,1.0682,90,90,90 - gray 5.26 X 21293
Al-Pd-Sm SmPdAl TiNiSi,oP12,62 Pnma 0.7013,0.4493,0.7766,90,90,90 AlB2 family - 7.70 A 17109
Al-Pd-Sm SmPd2Al3 PrNi2Al3,hP6,191 P6/mmm 0.5293,0.5293,0.4064,90,90,120 - - 7.48 X 55223
Al-Pd-Sm Sm0.67Pd2 Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63 /mmc 0.43314,0.43314,1.6423,90,90,120 - - 5.58 X 57903
Al-Pd-Tb TbPdAl ht ZrNiAl,hP9,189 P-62m 0.716,0.716,0.4021,90,90,120 Fe2P family - 8.16 X 50715
Al-Pd-Tb TbPdAl rt TiNiSi,oP12,62 Pnma 0.6897,0.4425,0.7728,90,90,90 AlB2 family - 8.23 X 35898
Al-Pd-Tb Tb0.67PdAl3 Tb0.67PdAl3,hP14,194 P63 /mmc 0.4394,0.4394,0.9372,90,90,120 - gray silver 6.23 X 50105
Al-Pd-Tb Tb2Pd3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.315,0.7664,0.9403,90,90,90 - - 6.17 A 43418
Al-Pd-Tb Tb4Pd9Al24 Er4Pt9Al24 ,aP37,2 P-1 0.7525,0.7525,1.3115,84.51,78.98,60. - - 5.89 A 36571
Al-Pd-Th ThPdAl ZrNiAl,hP9,189 P-62m 0.72653,0.72653,0.41806,90,90,120 Fe2P family - 9.53 A 4278
Al-Pd-Th ThPd2Al3 PrNi2Al3,hP6,191 P6/mmm 0.5444,0.5444,0.422,90,90,120 - - 8.06 X 36015
Al-Pd-Ti TiPd0.56 Al2.44 Cu3Au,cP4,221 Pm-3m 0.39575,0.39575,0.39575,90,90,90 close-packed structure - 4.64 X 37137
Al-Pd-Ti TiPd2Al Cu2MnAl,cF16,225 Fm-3m 0.6214,0.6214,0.6214,90,90,90 b.c.c. family - 7.96 X 7096
Al-Pd-Ti Ti0.26 Pd0.75 Al0.99 m CsCl,cP2,221 Pm-3m 0.3059,0.3059,0.3059,90,90,90 b.c.c. family - 6.90 X 37137
Al-Pd-Ti Ti0.78 Pd0.62 Al0.6 CsCl,cP2,221 Pm-3m 0.31406,0.31406,0.31406,90,90,90 b.c.c. family - 6.41 X 56507
Al-Pd-Ti Ti0.87 Pd0.06 Al1.07 CuAu,tP2,123 P4/mmm 0.28016,0.28016,0.4078,90,90,90 close-packed structure - 3.99 X 37137
Al-Pd-Ti Ti1.04 Pd0.6 Al1.36 MgZn2,hP12,194 P63 /mmc 0.51392,0.51392,0.82663,90,90,120 Friauf-Laves phase - 5.28 X 52219
Al-Pd-Ti Ti2.34 Pd0.10 Al1.56 rt Mg3Cd,hP8,194 P63 /mmc 0.5775,0.5775,0.4655,90,90,120 close-packed structure - 4.07 A 37137
Al-Pd-Ti Ti6Pd4.5 Al7.5 Nb6(Nb0.2 Al0.8 )2Ir(I...,hP36,193 P63 /mcm 0.89198,0.89198,0.8204,90,90,120 Friauf-Laves phase - 5.69 X 52219
Al-Pd-Ti Ti7.14 Pd6.72 Al16.4 (Ti0.42 Al0.58)15Pt7Al8,cF120,225 Fm-3m 1.22295,1.22295,1.22295,90,90,90 - - 5.45 X 37137
Al-Pd-Tm TmPdAl TiNiSi,oP12,62 Pnma 0.679,0.438,0.7712,90,90,90 AlB2 family - 8.76 A 17109
Al-Pd-Tm Tm2Pd3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3099,0.7635,0.9345,90,90,90 - - 6.40 A 43418
Al-Pd-Tm Tm4Pd9Al24 Er4Pt9Al24 ,aP37,2 P-1 0.7497,0.7497,1.3058,84.51,78.97,60. - - 6.07 A 36571
Al-Pd-U UPd2Al3 rt PrNi2Al3,hP6,191 P6/mmm 0.53688,0.53688,0.41899,90,90,120 - - 8.44 X 30456
Al-Pd-U UPd5Al2 ZrNi2Al5,tI16,139 I4/mmm 0.41693,0.41693,1.4629,90,90,90 - gray silver 10.76 X 50664
Al-Pd-U U0.67 Pd2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63 /mmc 0.43278,0.43278,1.6287,90,90,120 - - 6.38 X 51085
Al-Pd-Y YPdAl hex ZrNiAl,hP9,189 P-62m 0.722,0.722,0.3943,90,90,120 Fe2P family - 6.22 X 48618
Al-Pd-Y YPdAl orth TiNiSi,oP12,62 Pnma 0.689,0.4415,0.773,90,90,90 AlB2 family - 6.28 A 17109
Al-Pd-Y YPd2Al3 PrNi2Al3,hP6,191 P6/mmm 0.53704,0.53704,0.41932,90,90,120 - - 6.07 X 56481
Handbook of Inorganic Substances – Edition 2015 : Data 239

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Pd-Y YPd5Al2 ZrNi2Al5,tI16,139 I4/mmm 0.4105,0.4105,1.4755,90,90,90 - - 9.01 X 59177


Al-Pd-Y Y2Pd3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3159,0.7667,0.9399,90,90,90 - - 5.18 A 43418
Al-Pd-Yb YbPdAl TiNiSi,oP12,62 Pnma 0.6819,0.435,0.7801,90,90,90 AlB2 family - 8.80 X 28219
Al-Pd-Zn Zn10.37Pd2.28 Al0.35 Zn9(Zn0.5 Fe0.5)2Fe2,cI52,217 I-43m 0.91079,0.91079,0.91079,90,90,90 γ-brass - 8.18 X 53708
Al-Pd-Zn Zn40.10Pd8.125 Al2.675 Zn40.10Pd8.12 Al2.68 ,cF432,216 F-43m 1.8113,1.8113,1.8113,90,90,90 - - 7.96 X 53910
Al-Pd-Zn Zn74.44Pd18Al7.56 Zn62 (Zn0.78 Al0.22 )16...,cF400,216 F-43m 1.807,1.807,1.807,90,90,90 - - 7.86 X 53910
Al-Pd-Zr ZrPd0.276 Al2.724 Cu3Au,cP4,221 Pm-3m 0.40835,0.40835,0.40835,90,90,90 close-packed structure - 4.73 X 48559
Al-Pd-Zr ZrPd0.321 Al1.679 MgCu2,cF24,227 Fd-3m 0.74811,0.74811,0.74811,90,90,90 Friauf-Laves phase - 5.42 X 48559
Al-Pd-Zr ZrPd0.82 Al1.18 MgZn2,hP12,194 P63/mmc 0.52839,0.52839,0.84753,90,90,120 Friauf-Laves phase - 6.82 X 49532
Al-Pd-Zr ZrPd2Al Cu2MnAl,cF16,225 Fm-3m 0.6406,0.6406,0.6406,90,90,90 b.c.c. family - 8.36 X 53178
Al-Pd-Zr Zr6Pd7Al16 Mg6 Cu16Si7,cF116,225 Fm-3m 1.2407,1.2407,1.2407,90,90,90 - - 6.00 A 3206
Al-Pr-Pt PrPtAl TiNiSi,oP12,62 Pnma 0.71143,0.44601,0.77853,90,90,90 AlB2 family - 9.76 X 34851
Al-Pr-Re PrRe 2Al10 CaCr2Al10,tP52,129 P4/nmm 1.2981,1.2981,0.5186,90,90,90 CaCu5-Zr4Al3 gray silver 5.95 A 35381
Al-Pr-Rh PrRhAl TiNiSi,oP12,62 Pnma 0.70217,0.42704,0.80788,90,90,90 AlB2 family - 7.43 A 33246
Al-Pr-Rh Pr2Rh3Al9 Y2Co 3Ga9,oS56,63 Cmcm 1.3365,0.7716,0.9461,90,90,90 - - 5.67 A 43418
Al-Pr-Rh Pr4RhAl Gd4RhIn,cF96,216 F-43m 1.39,1.39,1.39,90,90,90 - gray dark 6.86 A 57034
Al-Pr-Ru PrRu2Al10 YbFe 2Al10,oS52,63 Cmcm 0.91232,1.02664,0.918,90,90,90 - - 4.73 X 58634
Al-Pr-Ru Pr3Ru4Al12 Gd3Ru4Al12,hP38,194 P63/mmc 0.88824,0.88824,0.96508,90,90,120 - gray dark 5.80 A 58824
Al-Pr-Ru Pr4RuAl Gd4RhIn,cF96,216 F-43m 1.3843,1.3843,1.3843,90,90,90 - gray dark 6.93 A 57034
Al-Pr-Ru Pr5Ru3Al2 Pr5Ru3Al2,cI40,199 I213 0.98084,0.98084,0.98084,90,90,90 - - 7.47 X 55154
Al-Pr-S Pr3Al1.67 S7 Ce3Al1.67 S7,hP24,173 P63 0.995,0.995,0.607,90,90,120 - gray rose 4.42 A 5866
Al-Pr-Se Pr3Al1.67 Se7 Ce3Al1.67 S7,hP24,173 P63 1.028,1.028,0.62,90,90,120 - - 5.97 A 4521
Al-Pr-Si PrAlSi ThSi2,tI12,141 I41/amd 0.42201,0.42201,1.4454,90,90,90 - - 5.06 A 44935
Al-Pr-Si PrAlSi2 CeAlSi2,hP8,164 P-3m1 0.41615,0.41615,1.11312,90,90,120 - - 4.46 X 44935
Al-Pr-Si PrAl0.2Si0.8 FeB-b,oP8,62 Pnma 0.8268,0.3976,0.5946,90,90,90 CrB(TlI)-FeB - 5.74 A 39415
Al-Pr-Si PrAl0.5Si0.5 TlI,oS8,63 Cmcm 0.44718,1.12733,0.40701,90,90,90 CrB(TlI)-FeB - 5.45 X 43109
Al-Pr-Si PrAl1.5Si0.5 AlB2 ,hP3,191 P6/mmm 0.4293,0.4293,0.4253,90,90,120 AlB2 family - 4.78 X 39415
Al-Pr-Si PrAl2Si2 Ce2SO2,hP5,164 P-3m1 0.42096,0.42096,0.68422,90,90,120 - - 3.97 X 44935
Al-Pr-Si PrAl2.8Si0.2 Mg3 Cd,hP8,194 P63/mmc 0.6458,0.6458,0.4586,90,90,120 close-packed structure - 4.45 A 39415
Al-Pr-Si Pr3Al4Si6 Ce3Al4Si6,hP13,164 P-3m1 0.41805,0.41805,1.79793,90,90,120 - - 4.27 X 44935
Al-Pr-Ta PrTa2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4759,1.4759,1.4759,90,90,90 - - 4.31 A 34455
Al-Pr-Ti PrTi2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4725,1.4725,1.4725,90,90,90 - - 3.23 X 58994
Al-Pr-U Pr0.15 U0.85 Al2 MgCu2,cF24,227 Fd-3m 0.779,0.779,0.779,90,90,90 Friauf-Laves phase - 7.80 X 29217
Al-Pr-V PrV2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4567,1.4567,1.4567,90,90,90 - - 3.36 X 58994
Al-Pr-W PrW2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4612,1.4612,1.4612,90,90,90 - - 4.46 A 30512
Al-Pr-Y Y0.6 Pr0.4 Al2 MgCu2,cF24,227 Fd-3m 0.7933,0.7933,0.7933,90,90,90 Friauf-Laves phase - 4.36 X 4766
Al-Pr-Y Y0.6 Pr0.4 Al3 Mg3 Cd,hP8,194 P63/mmc 0.638,0.638,0.46,90,90,120 close-packed structure - 3.90 A 4766
Al-Pr-Zn ZnPrAl rt KHg2,oI12,74 Imma 0.4612,0.7528,0.7774,90,90,90 AlB2 family - 5.74 A 24841
Al-Pr-Zn Zn0.6 PrAl0.4 CsCl,cP2,221 Pm-3m 0.369,0.369,0.369,90,90,90 b.c.c. family - 6.31 X 24045
Al-Pr-Zn Zn2PrAl2 CeAl2Ga2,tI10,139 I4/mmm 0.4226,0.4226,1.0995,90,90,90 - - 5.51 X 24045
Al-Pt-Ru Ru0.44Pt0.56 Al2.7 RhAl2.63 ,cP54,195 P23 0.7721,0.7721,0.7721,90,90,90 - - 6.54 A 44944
Al-Pt-Sm SmPtAl TiNiSi,oP12,62 Pnma 0.7026,0.4432,0.7746,90,90,90 AlB2 family - 10.26 A 17109
Al-Pt-Sm Sm0.67Pt2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63/mmc 0.42909,0.42909,1.6447,90,90,120 - - 7.93 X 57903
Al-Pt-Tb TbPtAl TiNiSi,oP12,62 Pnma 0.6921,0.4396,0.7967,90,90,90 AlB2 family - 10.44 X 17109
Al-Pt-Tb TbPt0.5Al1.5 MgCu2,cF24,227 Fd-3m 0.7771,0.7771,0.7771,90,90,90 Friauf-Laves phase - 8.41 X 17109
Al-Pt-Tb TbPt1.8Al0.2 MgCu2,cF24,227 Fd-3m 0.7615,0.7615,0.7615,90,90,90 Friauf-Laves phase - 15.51 X 17109
Al-Pt-Tb Tb0.67Pt2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63/mmc 0.42734,0.42734,1.6391,90,90,120 - gray silver 8.09 X 51976
Al-Pt-Tb Tb4Pt9Al24 Er4Pt9Al24,aP37,2 P-1 0.7494,0.7494,1.3104,84.53,79.01,60. - - 8.07 A 36571
Al-Pt-Th ThPtAl ZrNiAl,hP9,189 P-62m 0.7271,0.7271,0.4154,90,90,120 Fe2P family - 11.89 A 4278
Al-Pt-Ti TiPtAl BeZrSi,hP6,194 P63/mmc 0.43964,0.43964,0.54868,90,90,120 AlB2 family - 9.76 X 52219
Al-Pt-Ti TiPt0.24 Al2.76 Cu3Au,cP4,221 Pm-3m 0.39625,0.39625,0.39625,90,90,90 close-packed structure - 4.52 X 42939
Al-Pt-Ti Ti0.263Pt0.073 Al0.664 Cu,cF4,225 Fm-3m 0.39577,0.39577,0.39577,90,90,90 close-packed structure - 4.80 X 37137
Al-Pt-Ti Ti0.83 Pt0.03 Al1.14 CuAu,tP2,123 P4/mmm 0.27994,0.27994,0.4069,90,90,90 close-packed structure - 3.98 X 37137
Al-Pt-Ti Ti1.35 Pt0.40 Al1.25 MgZn2,hP12,194 P63/mmc 0.51309,0.51309,0.82691,90,90,120 Friauf-Laves phase - 6.22 X 37137
Al-Pt-Ti Ti2.4 Pt0.1 Al1.5 rt Mg3 Cd,hP8,194 P63/mmc 0.5771,0.5771,0.4635,90,90,120 close-packed structure - 4.35 A 37137
Al-Pt-Ti Ti6.48 Pt4.5Al7.02 Nb6(Nb0.2 Al0.8 )2Ir(I...,hP36,193 P63/mcm 0.89014,0.89014,0.82019,90,90,120 Friauf-Laves phase - 8.13 X 52219
Al-Pt-Ti Ti7.1 Pt7Al15.9 (Ti0.42 Al0.58)15Pt7Al8 ,cF120,225 Fm-3m 1.22315,1.22315,1.22315,90,90,90 - - 7.75 X 42939
Al-Pt-Tm TmPtAl TiNiSi,oP12,62 Pnma 0.6777,0.4354,0.7669,90,90,90 AlB2 family - 11.48 A 17109
Al-Pt-Tm Tm4 Pt9Al24 Er4Pt9Al24,aP37,2 P-1 0.7465,0.7465,1.3035,84.52,78.99,60. - - 8.28 A 36571
Al-Pt-U UPtAl ZrNiAl,hP9,189 P-62m 0.701,0.701,0.413,90,90,120 Fe2P family - 13.04 A 35893
Al-Pt-U U0.67 Pt2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63/mmc 0.42929,0.42929,1.6276,90,90,120 - gray 8.75 X 46036
Al-Pt-Y YPtAl TiNiSi,oP12,62 Pnma 0.6888,0.4395,0.7683,90,90,90 AlB2 family - 8.88 A 17109
Al-Pt-Y Y0.67 Pt2Al5 Sc0.6 Fe2Si4.9 ,hP20,194 P63/mmc 0.4281,0.4281,1.6383,90,90,120 - gray silver 7.47 X 44004
Al-Pt-Y Y4Pt9Al24 Y4Pt9Al24,aP51,2 P-1 0.749,0.749,1.3093,84.52,79.01,60. - - 7.34 X 36571
Al-Pt-Yb YbPtAl TiNiSi,oP12,62 Pnma 0.6767,0.4348,0.7705,90,90,90 AlB2 family - 11.58 A 30412
Al-Pt-Yb Yb4Pt9Al24 Er4Pt9Al24,aP37,2 P-1 0.747,0.747,1.3084,84.531,79.02,60. - - 8.28 A 36571
Al-Pt-Zr ZrPtAl HfRhSn,hP18,190 P-62c 0.71042,0.71042,0.72145,90,90,120 - - 9.90 X 48589
Al-Pt-Zr ZrPt0.154 Al1.846 MgCu2,cF24,227 Fd-3m 0.74644,0.74644,0.74644,90,90,90 Friauf-Laves phase - 5.46 X 48559
Al-Pt-Zr ZrPt2Al hex Li2CuAs,hP8,194 P63/mmc 0.4267,0.4267,0.8611,90,90,120 - - 12.44 X 17101
Al-Pt-Zr Zr0.5Pt2Al5.11 Sc0.6 Fe2Si4.9 ,hP20,194 P63/mmc 0.4261,0.4261,1.6228,90,90,120 - gray silver 7.47 X 44004
Al-Pt-Zr Zr6Pt7Al16 Mg6 Cu16Si7,cF116,225 Fm-3m 1.2335,1.2335,1.2335,90,90,90 - - 8.30 A 3206
Al-Pu-Zr Pu0.9162 Zr0.0373 Al0.0465 Cu,cF4,225 Fm-3m 0.46175,0.46175,0.46175,90,90,90 close-packed structure - 15.40 X 2277
Al-Rb-Sb Rb6AlSb3 Cs6AlSb3,mP20,11 P121/m1 1.0624,0.626,1.2377,90,100.7,90 - - 3.72 X 26901
Al-Rb-Sn Rb4Al4Sn19 Na4Si23,cP54,223 Pm-3n 1.2036,1.2036,1.2036,90,90,90 clathrate gray 5.15 X 35328
Al-Re-Si ReAl1.2 Si0.8 MoSi2,tI6,139 I4/mmm 0.318,0.318,0.802,90,90,90 b.c.c. family - 9.87 X 10690
Al-Re-Si Re4Al17Si2 Mn4 Al14(Al0.5 Si0.5 )4Si,cP138,200 Pm-3 1.2874,1.2874,1.2874,90,90,90 - - 5.88 X 40223
Al-Re-Sm SmRe 2Al9.16 CaCr2Al10,tP52,129 P4/nmm 1.2915,1.2915,0.5165,90,90,90 CaCu5-Zr4Al3 gray silver 5.94 X 35381
Al-Re-Tb Tb1.872 Re4Al20.128 Tb(Tb0.87 Al0.13 )Re4Al20,oS104,63 Cmcm 0.9322,1.0304,1.8032,90,90,90 - gray dark 6.08 X 36775
240 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Re-Tb Tb3.5 Re6Al30.5 Y3.64 Re6Al30.69 ,hP88,193 P63 /mcm 1.3111,1.3111,0.9152,90,90,120 - - 6.09 A 33271
Al-Re-Ti Ti1.04 Re0.28 Al2.68 Cu3Au,cP4,221 Pm-3m 0.39707,0.39707,0.39707,90,90,90 close-packed structure - 4.62 X 42939
Al-Re-Tm TmRe2Al10 LuRe2Al10 ,oS156,63 Cmcm 0.92902,1.0278,2.6847,90,90,90 - gray dark 6.31 A 53203
Al-Re-Y YRe2Al10 LuRe2Al10 ,oS156,63 Cmcm 0.93062,1.0308,2.6936,90,90,90 - - 5.64 A 53203
Al-Re-Y Y3.64 Re6Al30.69 Y3.64 Re6Al30.69 ,hP88,193 P63 /mcm 1.3116,1.3116,0.9161,90,90,120 - gray 5.52 X 30205
Al-Re-Yb YbRe2Al10 LuRe2Al10 ,oS156,63 Cmcm 0.9294,1.0298,2.6866,90,90,90 - - 6.32 X 35746
Al-Rh-Ru Ru0.27 Rh0.64 Al1.09 CsCl,cP2,221 Pm-3m 0.29717,0.29717,0.29717,90,90,90 b.c.c. family - 7.76 X 56540
Al-Rh-Ru Ru0.5 Rh0.5 Al2.63 RhAl2.63 ,cP54,195 P23 0.77163,0.77163,0.77163,90,90,90 - - 5.00 A 56540
Al-Rh-Ru Ru1.7 Rh2.38 Al12.92 Fe4Al13,mS102,12 C12/m1 1.5647,0.8274,1.2651,90,107.82,90 - - 4.89 A 56540
Al-Rh-Sc Sc6Rh7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.234,1.234,1.234,90,90,90 - - 5.03 A 7364
Al-Rh-Si Rh129Al328 Si36 Rh129Al328 Si36,cP585,200 Pm-3 1.9935,1.9935,1.9935,90,90,90 - - 4.85 X 43314
Al-Rh-Si Rh152Al367 Si45 Rh152Al367 Si45,cP597,200 Pm-3 1.27628,1.27628,1.27628,90,90,90 - - 21.41 X 43315
Al-Rh-Sm Sm2Rh3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3311,0.7685,0.9399,90,90,90 - - 5.89 A 43418
Al-Rh-Sm Sm4RhAl Gd4RhIn,cF96,216 F-43m 1.3697,1.3697,1.3697,90,90,90 - gray dark 7.56 A 57034
Al-Rh-Tb Tb2Rh3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3241,0.7644,0.9369,90,90,90 - - 6.09 A 43418
Al-Rh-Tb Tb4RhAl Gd4RhIn,cF96,216 F-43m 1.3501,1.3501,1.3501,90,90,90 - gray dark 8.27 A 57034
Al-Rh-Th ThRhAl ZrNiAl,hP9,189 P-62m 0.7192,0.7192,0.4116,90,90,120 Fe2P family - 9.78 A 43742
Al-Rh-Ti Ti0.12 Rh0.83 Al0.05 Cu,cF4,225 Fm-3m 0.382,0.382,0.382,90,90,90 close-packed structure - 11.02 X 49292
Al-Rh-Ti Ti0.16 Rh1.06 Al0.78 CsCl,cP2,221 Pm-3m 0.299,0.299,0.299,90,90,90 b.c.c. family - 8.56 X 49292
Al-Rh-Ti Ti0.96 Rh2.88 Al0.16 Cu3Au,cP4,221 Pm-3m 0.381,0.381,0.381,90,90,90 close-packed structure - 10.41 X 49292
Al-Rh-Ti Ti1.048 Rh0.212 Al2.74 Cu3Au,cP4,221 Pm-3m 0.39665,0.39665,0.39665,90,90,90 close-packed structure - 3.88 X 42939
Al-Rh-Ti Ti2.5 Rh5Al0.5 Rh5Ge3,oP16,55 Pbam 0.536,1.041,0.408,90,90,90 - - 9.45 A 49292
Al-Rh-Ti Ti8.3 Rh7Al14.7 (Ti0.42 Al0.58)15Pt7Al8,cF120,225 Fm-3m 1.21841,1.21841,1.21841,90,90,90 - - 5.56 X 42939
Al-Rh-Tm TmRhAl TiNiSi,oP12,62 Pnma 0.67761,0.41361,0.78996,90,90,90 AlB2 family - 8.97 X 33246
Al-Rh-Tm Tm2Rh3 Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.312,0.7575,0.9338,90,90,90 - - 6.37 A 43418
Al-Rh-Tm Tm4RhAl Gd4RhIn,cF96,216 F-43m 1.3289,1.3289,1.3289,90,90,90 - gray dark 9.12 A 57034
Al-Rh-U URhAl ZrNiAl,hP9,189 P-62m 0.6986,0.6986,0.4027,90,90,120 Fe2P family - 10.77 A 43742
Al-Rh-U U2Rh3Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.305,0.761,0.938,90,90,90 - - 7.33 A 33257
Al-Rh-Y Y2Rh3 Al9 Y2Co3Ga9 ,oS56,63 Cmcm 1.3082,0.7554,0.9427,90,90,90 - - 5.20 A 43418
Al-Rh-Y Y4RhAl Gd4RhIn,cF96,216 F-43m 1.355,1.355,1.355,90,90,90 - gray dark 5.19 A 57034
Al-Rh-Yb YbRhAl TiNiSi,oP12,62 Pnma 0.6763,0.4134,0.7906,90,90,90 AlB2 family - 9.10 X 36764
Al-Rh-Zr ZrRhAl MgZn2,hP12,194 P63 /mmc 0.526,0.526,0.834,90,90,120 Friauf-Laves phase - 7.35 A 8294
Al-Rh-Zr Zr6Rh7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.2323,1.2323,1.2323,90,90,90 - - 6.03 A 3206
Al-Ru-Sc ScRu0.5 Al1.5 MgZn2,hP12,194 P63 /mmc 0.527,0.527,0.857,90,90,120 Friauf-Laves phase - 4.38 X 8414
Al-Ru-Sc Sc6Ru7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.238,1.238,1.238,90,90,90 - - 4.93 A 7364
Al-Ru-Si Ru23Al86.9 Si10.1 Ru23(Al86.9 Si10.1)97,hP240,194 P63 /mmc 1.2649,1.2649,2.6756,90,90,120 - - 4.44 X 59195
Al-Ru-Sm SmRu2Al10 YbFe2Al10 ,oS52,63 Cmcm 0.9144,1.0238,0.9095,90,90,90 - - 4.86 A 34696
Al-Ru-Sm Sm3Ru4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.883,0.883,0.9573,90,90,120 - gray dark 6.06 A 40923
Al-Ru-Sm Sm4RuAl Gd4RhIn,cF96,216 F-43m 1.3609,1.3609,1.3609,90,90,90 - gray dark 7.69 A 57034
Al-Ru-Tb TbRu2 Al10 YbFe2Al10 ,oS52,63 Cmcm 0.9115,1.0212,0.9085,90,90,90 - - 4.96 A 34696
Al-Ru-Tb Tb3Ru4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.8775,0.8775,0.9527,90,90,120 - gray dark 6.30 A 40923
Al-Ru-Tb Tb4RuAl Gd4RhIn,cF96,216 F-43m 1.347,1.347,1.347,90,90,90 - gray dark 8.30 A 57034
Al-Ru-Ti Ti0.58 Ru0.01 Al1.41 ht CuAu,tP2,123 P4/mmm 0.27747,0.27747,0.4136,90,90,90 - - 3.49 X 41850
Al-Ru-Ti Ti0.66 Ru0.02 Al1.32 ht CuAu,tP2,123 P4/mmm 0.28405,0.28405,0.3959,90,90,90 close-packed structure - 3.60 X 41850
Al-Ru-Ti Ti0.78 Ru0.02 Al1.20 ht CuAu,tP2,123 P4/mmm 0.28136,0.28136,0.40538,90,90,90 close-packed structure - 3.71 X 41850
Al-Ru-Ti Ti1.04 Ru0.208 Al2.752 Cu3Au,cP4,221 Pm-3m 0.39667,0.39667,0.39667,90,90,90 close-packed structure - 3.86 X 42939
Al-Ru-Ti Ti9.15 Ru7Al13.85 (Ti0.42 Al0.58)15Pt7Al8,cF120,225 Fm-3m 1.22421,1.22421,1.22421,90,90,90 - - 5.50 X 41850
Al-Ru-Tm Tm3Ru4 Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.8725,0.8725,0.9468,90,90,120 - gray dark 6.57 A 40923
Al-Ru-U URuAl ZrNiAl,hP9,189 P-62m 0.6866,0.6866,0.4026,90,90,120 Fe2P family - 11.10 X 29640
Al-Ru-U URu2Al10 YbFe2Al10 ,oS52,63 Cmcm 0.9027,1.0245,0.912,90,90,90 - - 5.59 X 56238
Al-Ru-U U3Ru4Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.883,0.883,0.94296,90,90,120 - - 7.52 X 52617
Al-Ru-Y YRu2 Al10 YbFe2Al10 ,oS52,63 Cmcm 0.9122,1.0211,0.9087,90,90,90 - - 4.40 A 34696
Al-Ru-Y Y3Ru4 Al12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.8783,0.8783,0.9519,90,90,120 - gray dark 5.20 X 40923
Al-Ru-Yb YbRu2Al10 YbFe2Al10 ,oS52,63 Cmcm 0.9085,1.0215,0.9111,90,90,90 - - 5.07 X 58634
Al-Ru-Zr Zr6Ru7Al16 Mg6Cu16Si7,cF116,225 Fm-3m 1.24,1.24,1.24,90,90,90 - - 5.88 A 3206
Al-S-Sm Sm3Al1.67 S7 Ce3Al1.67 S7,hP24,173 P63 0.98,0.98,0.606,90,90,120 - gray green 4.75 A 5866
Al-S-Sr SrAl2S4 cub EuGa2S4,oF224,70 Fddd 1.2123,2.036,2.0817,90,90,90 - colorless 2.79 X 16533
Al-S-Sr SrAl2S4 orth *,o**,* - 0.6065,1.0227,1.0429,90,90,90 - white - N 8313
Al-S-Tb Tb3Al1.67 S7 Ce3Al1.67 S7,hP24,173 P63 0.967,0.967,0.607,90,90,120 - - 5.04 A 4521
Al-S-Tl TlAlS2 TlGaSe2,mS64,15 C12/c1 1.028,1.026,1.515,90,100.,90 - - 4.99 A 8664
Al-S-Tl Tl3Al13S21 Tl3Al13S21 ,mS148,8 C1m1 2.5242,1.49,0.9259,90,103.81,90 - yellow 3.22 X 24344
Al-S-Tl Tl3Al7S12 Tl3Al7S12,mP44,4 P1211 0.904,1.2381,0.9569,90,95.91,90 - yellow 3.70 X 26836
Al-S-Y Y3 Al1.67 S7 ht Ce3Al1.67 S7,hP24,173 P63 0.958,0.958,0.607,90,90,120 - beige gray 3.69 A 4521
Al-S-Yb YbAl2S4 *,o**,* - 0.602,1.0029,1.0045,90,90,90 - yellow - N 8313
Al-S-Zn ZnAl2S4 ht ZnAl2S4,oP32,33 Pna21 1.2825,0.75,0.6099,90,90,90 - white 2.80 X 3363
Al-S-Zn ZnAl2S4 rt MgAl2O4,cF56,227 Fd-3m 1.0009,1.0009,1.0009,90,90,90 spinel family white 3.28 X 16638
Al-S-Zn Zn0.29 Al0.28 S ZnO,hP4,186 P63 mc 0.3775,0.3775,0.6163,90,90,120 adamantane structure gray light 2.56 A 11723
Al-S-Zn Zn0.75 Al0.20 S1.05 rt ZnS,cF8,216 F-43m 0.539,0.539,0.539,90,90,90 adamantane structure - 3.74 X 11723
Al-Sb-Sc Sc5Al1.616 Sb1.384 Mn5Si3,hP16,193 P63 /mcm 0.82722,0.82722,0.59668,90,90,120 - - 4.10 X 38767
Al-Sb-Sr Sr14Al0.85 Sb11.15 Ca14AlSb11 ,tI208,142 I41/acd 1.7493,1.7493,2.348,90,90,90 - black 4.82 X 27799
Al-Sb-Sr Sr3AlSb3 Ba3AlSb3,oS56,64 Cmce 2.041,0.69,1.3501,90,90,90 - gray silver 4.58 X 17140
Al-Sb-Sr Sr5Al2Sb6 Sr5Al2Sb6,oP52,62 Pnma 1.2124,1.0341,1.3409,90,90,90 - gray light 4.83 X 22028
Al-Sb-Te Al0.75 Sb0.25 Te0.75 ZnS,cF8,216 F-43m 0.5985,0.5985,0.5985,90,90,90 adamantane structure - 4.54 X 1138
Al-Sb-Ti Ti5AlSb2 W5Si3,tI32,140 I4/mcm 1.0689,1.0689,0.5367,90,90,90 - - 5.52 X 41495
Al-Sb-V V3 Al0.5 Sb0.5 Cr3Si,cP8,223 Pm-3n 0.491,0.491,0.491,90,90,90 Frank-Kasper phase - 6.37 X 1965
Al-Sb-Y Y5 Al2.16 Sb0.84 Mn5Si3,hP16,193 P63 /mcm 0.8814,0.8814,0.6493,90,90,120 - - 4.60 A 41647
Al-Sb-Yb Yb11 AlSb9 Ca11InSb9,oI84,45 Iba2 1.17383,1.236,1.66796,90,90,90 - - 8.31 X 58023
Al-Sb-Yb Yb14 AlSb11 Ca14AlSb11 ,tI208,142 I41/acd 1.66616,1.66616,2.2234,90,90,90 - - 8.15 X 58023
Handbook of Inorganic Substances – Edition 2015 : Data 241

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Sb-Yb Yb5 Al2Sb6 Ca5Al2Bi6,oP26,55 Pbam 0.72971,2.278,0.44115,90,90,90 - black 7.47 X 52285


Al-Sb-Zr Zr5AlSb3 CuHf5Sn3,hP18,193 P63/mcm 0.85802,0.85802,0.58465,90,90,120 AlB2 family - 7.56 A 23372
Al-Sb-Zr Zr5Al2.2 Sb0.8 Mn5 Si3,hP16,193 P63/mcm 0.8276,0.8276,0.5694,90,90,120 - - 6.03 A 1835
Al-Sc-Si Sc2AlSi2 Mo2 FeB2,tP10,127 P4/mbm 0.6597,0.6597,0.3994,90,90,90 - - 3.31 X 21784
Al-Sc-Sm Sc0.1 Sm0.9 Al3 rt Mg3 Cd,hP8,194 P63/mmc 0.6371,0.6371,0.4595,90,90,120 close-packed structure - 4.54 A 7867
Al-Sc-Sm Sc0.884 Sm0.116 Al3 Cu3Au,cP4,221 Pm-3m 0.4124,0.4124,0.4124,90,90,90 close-packed structure - 3.27 X 52216
Al-Sc-Sn Sc5Al1.5 Sn1.5 Mn5 Si3,hP16,193 P63/mcm 0.8331,0.8331,0.6018,90,90,120 - - 4.07 A 38767
Al-Sc-Tb Sc0.1 Tb0.9 Al3 BaPb3,hR36,166 R-3m 0.6168,0.6168,2.117,90,90,120 close-packed structure - 4.90 A 4603
Al-Sc-Tb Sc0.45 Tb0.55 Al3 TiNi3,hP16,194 P63/mmc 0.606,0.606,0.948,90,90,120 close-packed structure - 4.15 A 4603
Al-Sc-Tb Sc0.57 Tb0.43 Al3 Cu3Au,cP4,221 Pm-3m 0.4196,0.4196,0.4196,90,90,90 close-packed structure - 3.93 X 4603
Al-Sc-Te Sc5Al2.17 Te0.83 Mn5 Si3,hP16,193 P63/mcm 0.82676,0.82676,0.59516,90,90,120 - - 3.67 X 38767
Al-Sc-Y Y0.4 Sc0.6 Al3 Cu3Au,cP4,221 Pm-3m 0.4168,0.4168,0.4168,90,90,90 close-packed structure - 3.29 X 4603
Al-Sc-Y Y0.5 Sc0.5 Al3 TiNi3,hP16,194 P63/mmc 0.6053,0.6053,0.948,90,90,120 close-packed structure - 3.27 A 4603
Al-Sc-Y Y0.87 Sc0.13 Al3 ht BaPb3,hR36,166 R-3m 0.6173,0.6173,2.114,90,90,120 close-packed structure - 3.52 A 4603
Al-Sc-Yb Sc0.5 Yb0.5 Al2 MgCu2,cF24,227 Fd-3m 0.77,0.77,0.77,90,90,90 Friauf-Laves phase - 4.74 X 18119
Al-Sc-Yb Sc0.5 Yb0.5 Al3 Cu3Au,cP4,221 Pm-3m 0.4131,0.4131,0.4131,90,90,90 close-packed structure - 4.47 X 52216
Al-Se-Sm Sm3 Al1.67 Se7 Ce3Al1.67 S7,hP24,173 P63 1.014,1.014,0.62,90,90,120 - - 6.31 A 4521
Al-Se-Sr SrAl2Se4 SrAl2Se4,oS28,66 Cccm 0.627,1.082,1.085,90,90,90 - red 4.13 X 12035
Al-Se-Tb Tb3Al1.67 Se7 Ce3Al1.67 S7,hP24,173 P63 1.003,1.003,0.619,90,90,120 - - 6.62 A 4521
Al-Se-Tl TlAlSe 2 mon TlGaSe 2,mS64,15 C12/c1 1.074,1.066,1.546,90,100.,90 - brown red 5.93 A 8664
Al-Se-Tl TlAlSe 2 tet TlGaTe 2,tI16,140 I4/mcm 0.8131,0.8131,0.6325,90,90,90 - - 6.18 X 11103
Al-Se-Tl TlAl3Se5 *,t**,* - 0.57,0.57,0.62,90,90,90 - yellow - N 11391
Al-Se-Zn ZnAl2Se4 hp MgAl2O4,cF56,227 Fd-3m 1.061,1.061,1.061,90,90,90 spinel family - 4.84 A 4320
Al-Se-Zn ZnAl2Se4 rt CdGa2S4,tI14,82 I-4 0.5503,0.5503,1.09,90,90,90 - black 4.38 X 710
Al-Si-Sm SmAlSi LaPtSi,tI12,109 I41md 0.41536,0.41536,1.44085,90,90,90 - - 5.49 X 43731
Al-Si-Sm SmAl0.5 Si0.5 TlI,oS8,63 Cmcm 0.44087,1.1045,0.39966,90,90,90 CrB(TlI)-FeB - 6.07 A 43109
Al-Si-Sm SmAl1.07 Si0.93 ThSi2,tI12,141 I41/amd 0.41577,0.41577,1.44098,90,90,90 - - 5.48 A 45163
Al-Si-Sm SmAl2Si2 Ce2SO2,hP5,164 P-3m1 0.4202,0.4202,0.6723,90,90,120 - gray 4.21 X 36596
Al-Si-Sm Sm6 Al3Si Tb6Al3Si,tI80,140 I4/mcm 1.1733,1.1733,1.5266,90,90,90 - - 6.39 X 48267
Al-Si-Sr SrAlSi LiBaSi,hP3,187 P-6m2 0.4225,0.4225,0.4745,90,90,120 AlB2 family - 3.23 X 49278
Al-Si-Sr SrAl2Si2 Ce2SO2,hP5,164 P-3m1 0.41834,0.41834,0.74104,90,90,120 - - 2.92 X 52907
Al-Si-Sr Sr3Al2Si2 Ba3Al2Ge2,oI14,71 Immm 0.407,0.4825,1.8991,90,90,90 - - 3.32 X 11102
Al-Si-Sr Sr4Al5Si18 Na4Si23,cP54,223 Pm-3n 1.04495,1.04495,1.04495,90,90,90 clathrate gray silver 2.88 X 58303
Al-Si-Ta TaAl0.9 Si1.1 CrSi2,hP9,180 P6222 0.481,0.481,0.6648,90,90,120 - - 8.83 A 1474
Al-Si-Ta Ta2Al0.3 Si0.7 CuAl2,tI12,140 I4/mcm 0.619,0.619,0.5058,90,90,90 - - 13.35 A 1474
Al-Si-Ta Ta5Al1.59 Si1.41 rt Cr5B3,tI32,140 I4/mcm 0.6563,0.6563,1.1991,90,90,90 - - 12.70 A 1474
Al-Si-Tb TbAl0.15 Si0.85 TlI,oS8,63 Cmcm 0.42715,1.05595,0.38393,90,90,90 CrB(TlI)-FeB - 7.17 X 47648
Al-Si-Tb TbAl2Si2 Ce2SO2,hP5,164 P-3m1 0.4184,0.4184,0.6596,90,90,120 - gray 4.47 X 36596
Al-Si-Tb Tb2Al3Si2 Y2 Al3Si2,mS14,12 C12/m1 1.01685,0.40355,0.65929,90,101.111,90 - gray 5.69 X 45163
Al-Si-Tb Tb6Al3Si Tb6Al3Si,tI80,140 I4/mcm 1.1581,1.1581,1.5039,90,90,90 - - 7.00 X 20706
Al-Si-Te AlSiTe 3 AlSiTe 3,hP10,147 P-3 0.6829,0.6829,0.6995,90,90,120 - - 5.15 X 28748
Al-Si-Th ThAl0.09 Si0.91 FeB-b,oP8,62 Pnma 0.79314,0.41395,0.59235,90,90,90 CrB(TlI)-FeB - 8.88 A 43087
Al-Si-Th ThAl0.712 Si1.068 ThSi2,tI12,141 I41/amd 0.41712,0.41712,1.43485,90,90,90 - - 7.48 X 43087
Al-Si-Ti TiAl0.24 Si1.76 (Zr0.75 Al0.25)(Al0.3 ...,tI24,141 I41/amd 0.35788,0.35788,2.7132,90,90,90 close-packed structure - 3.97 A 50375
Al-Si-Ti TiAl0.3 Si1.7 ZrSi2,oS12,63 Cmcm 0.359,1.352,0.359,90,90,90 close-packed structure - 3.95 A 1482
Al-Si-Ti Ti0.002 Al0.006 Si0.992 C,cF8,227 Fd-3m 0.54312,0.54312,0.54312,90,90,90 - - 2.33 X 50375
Al-Si-Ti Ti0.003 Al0.803 Si0.194 Cu,cF4,225 Fm-3m 0.40483,0.40483,0.40483,90,90,90 close-packed structure - 2.73 X 50375
Al-Si-Ti Ti0.43 Al0.52 Si0.05 m Cu,cF4,225 Fm-3m 0.4007,0.4007,0.4007,90,90,90 close-packed structure - 3.72 X 33136
Al-Si-Ti Ti0.847 Al0.131 Si0.022 rt Mg,hP2,194 P63/mmc 0.2922,0.2922,0.4675,90,90,120 close-packed structure - 4.30 X 50375
Al-Si-Ti Ti0.95 Al0.05 Si2 TiSi2,oF24,70 Fddd 0.48053,0.82736,0.85642,90,90,90 - - 4.02 A 50375
Al-Si-Ti Ti0.96 Al0.01 Si1.03 FeB-b,oP8,62 Pnma 0.65419,0.36406,0.50019,90,90,90 CrB(TlI)-FeB - 4.19 A 50375
Al-Si-Ti Ti1.03 Al1.95Si0.02 HfGa2,tI24,141 I41/amd 0.3976,0.3976,2.432,90,90,90 close-packed structure - 3.54 A 50375
Al-Si-Ti Ti1.09 Al0.87 Si0.04 CuAu,tP2,123 P4/mmm 0.28452,0.28452,0.4055,90,90,90 close-packed structure - 3.89 X 50375
Al-Si-Ti Ti1.12 Al2.4 Si0.48 TiAl3,tI8,139 I4/mmm 0.37795,0.37795,0.85209,90,90,90 close-packed structure - 3.60 X 46828
Al-Si-Ti Ti2Al0.85 Si0.15 ht1 Co1.75 Ge,hP6,194 P63/mmc 0.452,0.452,0.552,90,90,120 AlB2 family - 4.18 X 33136
Al-Si-Ti Ti2.43 Al1.33 Si0.24 Mg3 Cd,hP8,194 P63/mmc 0.5789,0.5789,0.46163,90,90,120 close-packed structure - 3.94 A 50375
Al-Si-Ti Ti5.12 Al0.32 Si2.56 ht1 Mn5 Si3,hP16,193 P63/mcm 0.7474,0.7474,0.5157,90,90,120 - - 4.34 A 50375
Al-Si-Tm TmAlSi YAlGe,oS12,63 Cmcm 0.39638,1.0116,0.56314,90,90,90 AlB2 family - 6.59 X 46656
Al-Si-Tm Tm2 AlSi2 W2CoB2,oI10,71 Immm 0.3984,0.5737,0.8454,90,90,90 - gray 7.24 X 38143
Al-Si-Tm Tm2 Al3Si2 Y2 Al3Si2,mS14,12 C12/m1 1.00094,0.39932,0.65282,90,100.458,90 - gray 6.15 X 45163
Al-Si-Tm Tm6 Al3Si Tb6Al3Si,tI80,140 I4/mcm 1.145,1.145,1.455,90,90,90 - - 7.82 A 18465
Al-Si-U UAl1.68 Si1.32 Cu3Au,cP4,221 Pm-3m 0.4145,0.4145,0.4145,90,90,90 close-packed structure - 7.47 X 18398
Al-Si-U UAl1.8 Si0.2 MgCu2,cF24,227 Fd-3m 0.7723,0.7723,0.7723,90,90,90 Friauf-Laves phase - 8.43 X 29217
Al-Si-U U3Al2Si3 U3Al2Ge3,tI32,79 I4 0.76292,0.76292,1.08502,90,90,90 - - 8.96 X 36071
Al-Si-V VAl0.26 Si1.74 CrSi2,hP9,180 P6222 0.46054,0.46054,0.64276,90,90,120 - - 4.51 A 54249
Al-Si-V VAl0.6 Si1.4 TiSi2,oF24,70 Fddd 0.4697,0.8091,0.8501,90,90,90 - - 4.38 X 54249
Al-Si-V V0.75 Al0.225 Si0.025 W,cI2,229 Im-3m 0.3049,0.3049,0.3049,90,90,90 b.c.c. family - 5.27 X 6919
Al-Si-V V3 Al0.16 Si0.84 rt Cr3Si,cP8,223 Pm-3n 0.4731,0.4731,0.4731,90,90,90 Frank-Kasper phase - 5.67 X 10889
Al-Si-V V7 Al43.1 Si1.9 V7 Al45,mS104,12 C12/m1 2.07468,0.76331,1.10433,90,106.872,90 - - 3.12 A 54249
Al-Si-W WAl0.5 Si1.5 MoSi2,tI6,139 I4/mmm 0.3217,0.3217,0.7941,90,90,90 b.c.c. family - 9.68 A 1474
Al-Si-W WAl1.4 Si0.6 CrSi2,hP9,180 P6222 0.4741,0.4741,0.6615,90,90,120 - - 9.23 A 1474
Al-Si-Y YAlSi YAlGe,oS12,63 Cmcm 0.39948,1.02983,0.57085,90,90,90 AlB2 family - 4.07 X 43107
Al-Si-Y YAl0.5 Si0.5 TlI,oS8,63 Cmcm 0.42765,1.0597,0.38662,90,90,90 CrB(TlI)-FeB - 4.41 X 48347
Al-Si-Y YAl2Si2 Ce2SO2,hP5,164 P-3m1 0.4195,0.4195,0.6581,90,90,120 - gray 3.30 X 36596
Al-Si-Y YAl2.8 Si0.2 Mg3 Cd,hP8,194 P63/mmc 0.6247,0.6247,0.459,90,90,120 close-packed structure - 3.64 A 5967
Al-Si-Y Y2 AlSi2 W2CoB2,oI10,71 Immm 0.405,0.5748,0.8663,90,90,90 - gray 4.30 X 38143
Al-Si-Y Y2 Al1.5 Si1.5 Mo2 FeB2,tP10,127 P4/mbm 0.69242,0.69242,0.4304,90,90,90 - - 4.19 X 48347
Al-Si-Y Y2 Al3Si2 Y2 Al3Si2,mS14,12 C12/m1 1.022,0.40354,0.6617,90,101.36,90 - grayish 3.91 X 28400
242 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Si-Y Y6 Al3Si Tb6Al3Si,tI80,140 I4/mcm 1.163,1.163,1.512,90,90,90 - - 4.17 A 18465


Al-Si-Yb YbAl2Si2 Ce2SO2,hP5,164 P-3m1 0.4156,0.4156,0.6914,90,90,120 - gray 4.55 X 36596
Al-Si-Yb Yb0.975 Al2.8 Si0.2 Yb0.98 Al2.8 Si0.2 ,hP30,194 P63 /mmc 0.6009,0.6009,1.4199,90,90,120 - - 5.61 X 40424
Al-Si-Yb Yb2 AlSi2 U3Si2,tP10,127 P4/mbm 0.6765,0.6765,0.4226,90,90,90 - gray 7.37 X 38143
Al-Si-Zr ZrAl0.5 Si0.5 TlI,oS8,63 Cmcm 0.3745,0.9863,0.3745,90,90,90 CrB(TlI)-FeB - 5.70 A 2857
Al-Si-Zr ZrAl2.4 Si0.6 TiAl3,tI8,139 I4/mmm 0.392,0.392,0.8938,90,90,90 close-packed structure - 4.18 X 2857
Al-Si-Zr Zr0.75 AlSi1.25 (Zr0.75 Al0.25)(Al0.3 ...,tI24,141 I41/amd 0.371,0.371,2.935,90,90,90 close-packed structure - 4.29 X 2857
Al-Si-Zr Zr0.75 Al1.02 Si1.23 ZrSi2,oS12,63 Cmcm 0.372,1.473,0.3663,90,90,90 close-packed structure - 4.32 A 2857
Al-Si-Zr Zr2.1 Al0.3 Si0.6 CuAl2,tI12,140 I4/mcm 0.6665,0.6665,0.5397,90,90,90 - - 6.00 A 1477
Al-Si-Zr Zr5Al1.5 Si1.5 Mn5Si3,hP16,193 P63 /mcm 0.8076,0.8076,0.5664,90,90,120 - - 5.59 A 1732
Al-Sm-Ta SmTa2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4747,1.4747,1.4747,90,90,90 - - 4.36 A 34455
Al-Sm-Ta Sm6Ta4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1127,1.1127,1.7954,90,90,120 - - 4.81 A 30591
Al-Sm-Tb Sm0.12 Tb0.88 Al3 BaPb3,hR36,166 R-3m 0.6187,0.6187,2.1178,90,90,120 close-packed structure - 5.08 A 7867
Al-Sm-Tb Sm0.18 Tb0.82 Al3 rt Mg3Cd,hP8,194 P63 /mmc 0.6298,0.6298,0.4599,90,90,120 close-packed structure - 5.01 A 7867
Al-Sm-Ti SmTi2 Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4705,1.4705,1.4705,90,90,90 - - 3.28 X 58994
Al-Sm-Ti Sm6Ti4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1093,1.1093,1.7993,90,90,120 - - 3.90 A 30591
Al-Sm-Tm Sm0.06 Tm0.94 Al3 Cu3Au,cP4,221 Pm-3m 0.4205,0.4205,0.4205,90,90,90 close-packed structure - 5.56 X 7867
Al-Sm-Tm Sm0.4 Tm0.6 Al3 TiNi3,hP16,194 P63 /mmc 0.6082,0.6082,0.9517,90,90,120 close-packed structure - 5.28 A 7867
Al-Sm-Tm Sm0.68 Tm0.32 Al3 rt Mg3Cd,hP8,194 P63 /mmc 0.6323,0.6323,0.4599,90,90,120 close-packed structure - 4.95 A 7867
Al-Sm-U U0.48 Sm0.52 Al2 MgCu2,cF24,227 Fd-3m 0.7865,0.7865,0.7865,90,90,90 Friauf-Laves phase - 6.73 X 3637
Al-Sm-V SmV2 Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.455,1.455,1.455,90,90,90 - - 3.42 X 58994
Al-Sm-V Sm6V4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1002,1.1002,1.7839,90,90,120 - - 4.03 A 30591
Al-Sm-W Sm6W4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1029,1.1029,1.784,90,90,120 - - 4.94 A 29673
Al-Sm-Y Y0.9 Sm0.1 Al3 rt Mg3Cd,hP8,194 P63 /mmc 0.6284,0.6284,0.4602,90,90,120 close-packed structure - 3.71 A 7867
Al-Sm-Y Y0.95 Sm0.05 Al3 ht BaPb3,hR36,166 R-3m 0.6204,0.6204,2.1156,90,90,120 close-packed structure - 3.66 A 7867
Al-Sm-Zn ZnSmAl KHg2,oI12,74 Imma 0.4539,0.7317,0.7789,90,90,90 AlB2 family - 6.23 A 24841
Al-Sm-Zn Zn1.68 SmAl2.32 CeAl2Ga2,tI10,139 I4/mmm 0.41683,0.41683,1.0998,90,90,90 - - 5.61 X 44889
Al-Sn-Sr Sr11Al4Sn3 Ca11Ga7,cF144,225 Fm-3m 1.7267,1.7267,1.7267,90,90,90 - - 3.68 X 50550
Al-Sn-Sr Sr3Al2Sn2 Ba3Al2Ge2 ,oI14,71 Immm 0.4465,0.4944,1.9795,90,90,90 - gray silver 4.21 X 12881
Al-Sn-Sr Sr9Al2.2 Sn5.8 Sr9Al2(Al0.2 Sn0.8 )Sn5,tP68,127 P4/mbm 1.3259,1.3259,1.2728,90,90,90 - gray silver 4.56 X 49577
Al-Sn-Sr Sr9Al4.1 Sn10.6 Ca9Al2.7 (Al0.5 Sn0.5 )4Sn8.0 ,mS108,12 C12/m1 2.231,1.247,1.042,90,103.42,90 - gray silver 5.08 X 49577
Al-Sn-Te Al6SnTe10 Al6SnTe10 ,hP102,152 P3121 1.4503,1.4503,1.775,90,90,120 - black 4.80 X 35256
Al-Sn-U UAl1.5 Sn1.5 Cu3Au,cP4,221 Pm-3m 0.445,0.445,0.445,90,90,90 close-packed structure - 8.60 X 10733
Al-Sn-V V0.75 Al0.225 Sn0.025 W,cI2,229 Im-3m 0.306,0.306,0.306,90,90,90 b.c.c. family - 5.48 X 6919
Al-Sn-V V3 Al0.5 Sn0.5 Cr3Si,cP8,223 Pm-3n 0.495,0.495,0.495,90,90,90 Frank-Kasper phase - 6.18 X 12442
Al-Sr-Te Sr0.5 AlTe2 Sr0.5 AlTe2 ,tI16,140 I4/mcm 0.825,0.825,0.672,90,90,90 - red light 4.73 X 7074
Al-Ta-Tb Tb6Ta4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.109,1.109,1.7851,90,90,120 - - 4.96 A 30591
Al-Ta-Ti Ti0.175 Ta0.4 Al0.425 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9987,0.9987,0.5263,90,90,90 Frank-Kasper phase - 8.75 A 25388
Al-Ta-Ti Ti0.30 Ta0.20 Al0.50 rt Mg,hP2,194 P63 /mmc 0.2935,0.2935,0.467,90,90,120 close-packed structure - 6.11 X 25388
Al-Ta-Ti Ti0.4 Ta0.4 Al1.2 CuAu,tP2,123 P4/mmm 0.27153,0.27153,0.399,90,90,90 close-packed structure - 6.99 X 3294
Al-Ta-Ti Ti0.5 Ta0.5 Al3 TiAl3,tI8,139 I4/mmm 0.3844,0.3844,0.8576,90,90,90 close-packed structure - 5.12 X 16743
Al-Ta-Tm Tm6 Ta4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1051,1.1051,1.7733,90,90,120 - - 5.13 A 30591
Al-Ta-U UTa2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4661,1.4661,1.4661,90,90,90 - - 4.80 A 30512
Al-Ta-U U6Ta4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1052,1.1052,1.7786,90,90,120 - - 5.85 A 30591
Al-Ta-Y Y6 Ta4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1086,1.1086,1.7842,90,90,120 - - 4.23 A 34455
Al-Ta-Yb Yb6 Ta4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1092,1.1092,1.7831,90,90,120 - - 5.11 X 39021
Al-Tb-Ti TbTi2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4682,1.4682,1.4682,90,90,90 - - 3.33 A 30512
Al-Tb-Ti Tb6Ti4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1051,1.1051,1.7894,90,90,120 - - 4.05 A 30591
Al-Tb-Tm Tb0.15 Tm0.85 Al3 Cu3Au,cP4,221 Pm-3m 0.4215,0.4215,0.4215,90,90,90 close-packed structure - 5.51 X 7867
Al-Tb-Tm Tb0.4 Tm0.6 Al3 HoAl3,hR60,166 R-3m 0.604,0.604,3.575,90,90,120 close-packed structure - 5.42 A 7867
Al-Tb-Tm Tb0.45 Tm0.55 Al3 TiNi3,hP16,194 P63 /mmc 0.6072,0.6072,0.9509,90,90,120 close-packed structure - 5.37 A 7867
Al-Tb-Tm Tb0.8 Tm0.2 Al3 BaPb3,hR36,166 R-3m 0.6157,0.6157,2.114,90,90,120 close-packed structure - 5.21 A 7867
Al-Tb-V TbV2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4538,1.4538,1.4538,90,90,90 - - 3.46 X 21900
Al-Tb-V Tb6V4 Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.096,1.096,1.7738,90,90,120 - - 4.17 A 30591
Al-Tb-W Tb6W4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.10031,1.10031,1.773,90,90,120 - - 5.09 A 29673
Al-Tb-Zn Zn3.6 Tb3Al7.4 La3Al11,oI28,71 Immm 0.42281,0.9966,1.2469,90,90,90 - - 5.76 X 45782
Al-Tb-Zr Tb0.65 Zr0.35 Al3 Cu3Au,cP4,221 Pm-3m 0.42,0.42,0.42,90,90,90 close-packed structure - 4.85 X 15104
Al-Tb-Zr Tb0.8 Zr0.2Al3 HoAl3,hR60,166 R-3m 0.604,0.604,3.575,90,90,120 close-packed structure - 4.99 A 15104
Al-Te-Zn ZnAl2Te4 tet1 CdGa2S4,tI14,82 I-4 0.5916,0.5916,1.205,90,90,90 - black 4.96 X 710
Al-Te-Zn ZnAl2Te4 tet2 CdIn2Se4,tP7,111 P-42m 0.59153,0.59153,0.6027,90,90,90 - - 4.96 X 710
Al-Th-U Th0.33 U0.67 Al3 Cu3Au,cP4,221 Pm-3m 0.432,0.432,0.432,90,90,90 close-packed structure - 6.53 X 3144
Al-Th-U Th0.5 U0.5 Al3 Mg3Cd,hP8,194 P63 /mmc 0.6399,0.6399,0.4606,90,90,120 close-packed structure - 6.43 A 18413
Al-Ti-Tm TmTi2 Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4661,1.4661,1.4661,90,90,90 - - 3.39 A 30512
Al-Ti-Tm Tm6 Ti4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1019,1.1019,1.7791,90,90,120 - - 4.20 A 30591
Al-Ti-U UTi2Al20 CeCr2Al20 ,cF184,227 Fd-3m 1.4619,1.4619,1.4619,90,90,90 - - 3.71 A 30512
Al-Ti-V Ti0.286 V4.714 Al8 Cu5Zn8,cI52,217 I-43m 0.9235,0.9235,0.9235,90,90,90 γ-brass - 3.96 A 19643
Al-Ti-V Ti0.5 V0.5 Al3 TiAl3,tI8,139 I4/mmm 0.382,0.382,0.85,90,90,90 close-packed structure - 3.49 X 22852
Al-Ti-V Ti0.64 V0.52 Al0.84 m CsCl,cP2,221 Pm-3m 0.318,0.318,0.318,90,90,90 b.c.c. family - 4.12 X 26691
Al-Ti-V Ti0.76 V0.18 Al0.06 W,cI2,229 Im-3m 0.3216,0.3216,0.3216,90,90,90 b.c.c. family - 4.71 X 56493
Al-Ti-V Ti0.8 V0.2 Al CuAu,tP2,123 P4/mmm 0.28214,0.28214,0.408,90,90,90 close-packed structure - 3.86 X 26691
Al-Ti-V Ti0.862 V0.036 Al0.102 rt Mg,hP2,194 P63 /mmc 0.2933,0.2933,0.4677,90,90,120 close-packed structure - 4.37 X 26470
Al-Ti-V Ti1.1 V0.20 Al2.70 Cu3Au,cP4,221 Pm-3m 0.3947,0.3947,0.3947,90,90,90 close-packed structure - 3.67 X 25209
Al-Ti-V Ti2.80 V0.04 Al1.16 Mg3Cd,hP8,194 P63 /mmc 0.5775,0.5775,0.4638,90,90,120 close-packed structure - 4.15 A 1532
Al-Ti-V Ti4.8 V0.05 Al1.15 *,hP*,* - 1.155,1.155,0.4655,90,90,120 - - - N 1532
Al-Ti-V Ti43.05 V3.85 Al53.1 prec *,c**,* - 0.69,0.69,0.69,90,90,90 - - - N 38887
Al-Ti-W Ti0.88 W0.12 Al3 TiAl3,tI8,139 I4/mmm 0.3857,0.3857,0.8528,90,90,90 close-packed structure - 3.80 X 25209
Al-Ti-W Ti1.1 W0.16 Al2.74 Cu3Au,cP4,221 Pm-3m 0.3928,0.3928,0.3928,90,90,90 close-packed structure - 4.28 X 25209
Al-Ti-Y Y6 Ti4Al43 Ho6Mo4Al43,hP106,193 P63 /mcm 1.1058,1.1058,1.7905,90,90,120 - - 3.30 A 30591
Handbook of Inorganic Substances – Edition 2015 : Data 243

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Al-Ti-Yb YbTi2 Al20 CeCr2Al20,cF184,227 Fd-3m 1.4689,1.4689,1.4689,90,90,90 - - 3.39 X 58994


Al-Ti-Yb Yb6 Ti4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1044,1.1044,1.7858,90,90,120 - - 4.21 A 30591
Al-Ti-Zn Zn0.16 TiAl2.84 Ti(Ti0.14 Al0.86)Al2,tP28,123 P4/mmm 0.39053,0.39053,2.91963,90,90,90 - - 3.52 A 51927
Al-Ti-Zn Zn0.25 TiAl2.75 Ti(Ti0.25 Al0.75)Al2,tI16,139 I4/mmm 0.389,0.389,1.663,90,90,90 - - 3.65 A 2856
Al-Ti-Zn Zn0.75 TiAl2.25 Cu3Au,cP4,221 Pm-3m 0.39589,0.39589,0.39589,90,90,90 close-packed structure - 4.22 X 58181
Al-Ti-Zr ZrTi2Al Mg3 Cd,hP8,194 P63/mmc 0.5961,0.5961,0.4793,90,90,120 close-packed structure - 4.82 X 37969
Al-Ti-Zr Zr0.05 Ti1.02 Al0.93 CuAu,tP2,123 P4/mmm 0.28461,0.28461,0.4076,90,90,90 close-packed structure - 3.95 X 21654
Al-Ti-Zr Zr0.08 Ti0.92 Al3 TiAl3,tI8,139 I4/mmm 0.3867,0.3867,0.8663,90,90,90 close-packed structure - 3.39 X 41496
Al-Ti-Zr Zr0.33 Ti0.67 Al3 ZrAl3,tI16,139 I4/mmm 0.3943,0.3943,1.6847,90,90,90 close-packed structure - 3.63 X 41496
Al-Ti-Zr Zr0.48 Ti0.4 Al0.12 *,hP*,194 P63/mmc 0.5329,0.5329,0.8691,90,90,120 - - - N 58178
Al-Ti-Zr Zr0.53 Ti0.15 Al0.32 *,tI*,139 I4/mmm 0.6809,0.6809,0.9173,90,90,90 - - - N 58178
Al-Ti-Zr Zr0.6 Ti0.4 Al3 Cu3Au,cP4,221 Pm-3m 0.4068,0.4068,0.4068,90,90,90 close-packed structure - 3.82 X 48368
Al-Ti-Zr Zr2TiAl Cu2MnAl,cF16,225 Fm-3m 0.684,0.684,0.684,90,90,90 b.c.c. family - 5.34 X 58178
Al-Tm-V Tm6 V4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0931,1.0931,1.761,90,90,120 - - 4.33 A 30591
Al-Tm-W Tm6 W4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0969,1.0969,1.7605,90,90,120 - - 5.27 A 29673
Al-Tm-Y Y0.12 Tm0.88 Al3 Cu3Au,cP4,221 Pm-3m 0.4204,0.4204,0.4204,90,90,90 close-packed structure - 5.37 X 7867
Al-Tm-Y Y0.35 Tm0.65 Al3 HoAl3,hR60,166 R-3m 0.6035,0.6035,3.576,90,90,120 close-packed structure - 4.90 A 7867
Al-Tm-Y Y0.6 Tm0.4 Al3 TiNi3,hP16,194 P63/mmc 0.6076,0.6076,0.9511,90,90,120 close-packed structure - 4.41 A 7867
Al-Tm-Y Y0.68 Tm0.32 Al3 ht BaPb3,hR36,166 R-3m 0.6161,0.6161,2.1128,90,90,120 close-packed structure - 4.21 A 7867
Al-Tm-Zn ZnTmAl CaIn2,hP6,194 P63/mmc 0.4467,0.4467,0.6943,90,90,120 AlB2 family - 7.23 X 24841
Al-Tm-Zn Zn4Tm3 Al7 La3Al11,oI28,71 Immm 0.41986,0.98741,1.22802,90,90,90 - - 6.24 A 44889
Al-Tm-Zn Zn5.64 TmAl2.36 Zn3(Zn0.4 Al0.6)5Ho,tI72,139 I4/mmm 0.85674,0.85674,1.63943,90,90,90 - - 6.64 X 47795
Al-U-V UV2 Al20 CeCr2Al20,cF184,227 Fd-3m 1.44775,1.44775,1.44775,90,90,90 - - 3.85 X 38835
Al-U-V U6V4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0922,1.0922,1.7691,90,90,120 - - 5.07 A 30591
Al-U-W UW2Al20 CeCr2Al20,cF184,227 Fd-3m 1.4505,1.4505,1.4505,90,90,90 - - 4.99 A 30512
Al-U-W U6W4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0959,1.0959,1.7726,90,90,120 - - 5.99 A 29673
Al-U-Y Y0.4 U0.6 Al2 MgCu2,cF24,227 Fd-3m 0.781,0.781,0.781,90,90,90 Friauf-Laves phase - 6.48 X 22939
Al-U-Zr U0.5 Zr0.5 Al2 MgCu2,cF24,227 Fd-3m 0.7642,0.7642,0.7642,90,90,90 Friauf-Laves phase - 6.51 X 1492
Al-V-Y YV2 Al20 CeCr2Al20,cF184,227 Fd-3m 1.451,1.451,1.451,90,90,90 - - 3.18 A 4015
Al-V-Yb Yb6 V4 Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.0951,1.0951,1.7695,90,90,120 - - 4.34 X 39021
Al-V-Zr ZrVAl MgZn2,hP12,194 P63/mmc 0.52979,0.52979,0.86581,90,90,120 Friauf-Laves phase - 5.34 X 53391
Al-V-Zr ZrV1.85 Al0.15 MgCu2,cF24,227 Fd-3m 0.7448,0.7448,0.7448,90,90,90 Friauf-Laves phase - 6.09 X 53391
Al-V-Zr Zr0.88 V0.36 Al2.76 Cu3Au,cP4,221 Pm-3m 0.4073,0.4073,0.4073,90,90,90 close-packed structure - 4.25 X 3294
Al-W-Y Y6W4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.1004,1.1004,1.7735,90,90,120 - - 4.34 A 29673
Al-W-Yb Yb6W4Al43 Ho6Mo 4Al43,hP106,193 P63/mcm 1.10079,1.10079,1.76878,90,90,120 - - 5.25 X 59675
Al-W-Zr Zr0.25 W0.5 Al0.25 ht W,cI2,229 Im-3m 0.3167,0.3167,0.3167,90,90,90 b.c.c. family - 12.70 X 16140
Al-W-Zr Zr0.5W2Al0.5 rt MgCu2,cF24,227 Fd-3m 0.7605,0.7605,0.7605,90,90,90 Friauf-Laves phase - 12.89 X 16140
Al-Y-Yb Y0.05 Yb0.95 Al3 Cu3Au,cP4,221 Pm-3m 0.4206,0.4206,0.4206,90,90,90 close-packed structure - 5.57 X 28820
Al-Y-Yb Y0.5 Yb0.5 Al2 MgCu2,cF24,227 Fd-3m 0.7875,0.7875,0.7875,90,90,90 Friauf-Laves phase - 5.03 X 18119
Al-Y-Yb Y0.5 Yb0.5 Al3 TiNi3,hP16,194 P63/mmc 0.6079,0.6079,0.9546,90,90,120 close-packed structure - 4.61 A 28820
Al-Y-Yb Y0.8 Yb0.2 Al3 ht BaPb3,hR36,166 R-3m 0.6174,0.6174,2.115,90,90,120 close-packed structure - 4.00 A 28820
Al-Y-Zn ZnYAl CaIn2,hP6,194 P63/mmc 0.4486,0.4486,0.7134,90,90,120 AlB2 family - 4.84 X 24841
Al-Y-Zn Zn10.8 YAl1.2 ThMn12,tI26,139 I4/mmm 0.88789,0.88789,0.52381,90,90,90 CaCu5-Zr4Al3 - 6.65 A 48342
Al-Y-Zn Zn16.15 Y2Al0.85 Zn17 Th2,hR57,166 R-3m 0.90006,0.90006,1.31388,90,90,120 CaCu5-Zr4Al3 - 6.79 A 48342
Al-Y-Zn Zn3.2 Y3Al7.8 La3Al11,oI28,71 Immm 0.42269,0.99868,1.24676,90,90,90 - - 4.33 X 44889
Al-Y-Zn Zn5.52 YAl2.48 Zn3(Zn0.4 Al0.6)5Ho,tI72,139 I4/mmm 0.8618,0.8618,1.65064,90,90,90 - - 5.60 X 47795
Al-Yb-Zn Zn0.8 YbAl0.2 CsCl,cP2,221 Pm-3m 0.3635,0.3635,0.3635,90,90,90 b.c.c. family - 7.98 X 52905
Al-Yb-Zn Zn0.88 YbAl1.12 MgCu2,cF24,227 Fd-3m 0.786,0.786,0.786,90,90,90 Friauf-Laves phase - 7.13 X 52905
Al-Yb-Zn Zn1.00 YbAl1.00 MgNi2,hP24,194 P63/mmc 0.5573,0.5573,1.8051,90,90,120 Friauf-Laves phase - 7.26 X 52905
Al-Yb-Zn Zn1.65 YbAl2.35 CeAl2Ga2,tI10,139 I4/mmm 0.41255,0.41255,1.14309,90,90,90 - - 5.88 X 44889
Al-Yb-Zn Zn1.67 YbAl0.33 MgZn2,hP12,194 P63/mmc 0.56,0.56,0.8847,90,90,120 Friauf-Laves phase - 8.05 A 52905
Al-Yb-Zn Zn1.7 YbAl2.3 BaAl4,tI10,139 I4/mmm 0.41255,0.41255,1.14309,90,90,90 - - 5.91 A 48342
Al-Yb-Zn Zn1.70 YbAl0.30 KHg2,oI12,74 Imma 0.4548,0.7266,0.768,90,90,90 AlB2 family - 7.65 A 52905
Al-Yb-Zn Zn1.92 YbAl1.08 PuNi3,hR36,166 R-3m 0.5499,0.5499,2.6134,90,90,120 Laves-CaCu5 - 7.16 X 52905
Al-Yb-Zn Zn17.70 Yb3Al4.30 rt Zn22 Ce3,tI100,141 I41/amd 0.892,0.892,2.1294,90,90,90 - - 7.03 X 46990
Al-Yb-Zn Zn2.50 YbAl0.50 CeNi3,hP24,194 P63/mmc 0.5496,0.5496,1.7336,90,90,120 Laves-CaCu5 - 7.69 X 52905
Al-Yb-Zn Zn24.25 Yb4Al8.75 (Cu0.65 Al0.35)13Yb4Al20,tI74,139 I4/mmm 0.8746,0.8746,1.6158,90,90,90 - - 6.75 X 48375
Al-Yb-Zn Zn30.94 Yb3.36 Al4.34 rt Zn30.94 Yb3.36 Al4.34 ,hP41,191 P6/mmm 0.9061,0.9061,0.8878,90,90,120 - - 7.16 X 46990
Al-Yb-Zn Zn46.8 Yb6.4 Al3.4 rt Zn46.8 Yb6.4 Al3.4 ,hP63,191 P6/mmm 0.9096,0.9096,1.3178,90,90,120 - - 7.49 X 46990
Al-Yb-Zn Zn6.16 Yb3Al4.84 La3Al11,oI28,71 Immm 0.42895,0.9755,1.2573,90,90,90 - - 6.64 X 48375
Al-Yb-Zn Zn69.1 Yb12.70 Al3.85 Zn6.95 (Zn0.94Al0.06)...,cI194,204 Im-3 1.4299,1.4299,1.4299,90,90,90 - - 7.75 X 51638
Al-Yb-Zn Zn7.7 YbAl3.3 BaHg11,cP36,221 Pm-3m 0.8463,0.8463,0.8463,90,90,90 - - 6.29 A 48342
Al-Yb-Zn Zn8.5 YbAl2.5 BaHg11,cP36,221 Pm-3m 0.8452,0.8452,0.8452,90,90,90 - - 6.57 X 54247
Al-Yb-Zn Zn96.8 Yb12.4 Al4.4 rt Zn96.8 Yb12.4 Al4.4 ,hP120,194 P63/mmc 0.9068,0.9068,2.6369,90,90,120 - - 7.60 X 46990
Al-Zn-Zr ZnZrAl2 Cu3Au,cP4,221 Pm-3m 0.403,0.403,0.403,90,90,90 close-packed structure - 5.34 X 2856
Al-Zn-Zr Zn0.5 ZrAl1.5 MgCu2,cF24,227 Fd-3m 0.7472,0.7472,0.7472,90,90,90 Friauf-Laves phase - 5.23 X 14794
Al-Zn-Zr Zn2Zr1.33 Al0.67 Cu3Au,cP4,221 Pm-3m 0.4073,0.4073,0.4073,90,90,90 close-packed structure - 6.64 X 14794
Am-As-O Am[AsO4] Ce[PO4],mP24,14 P121/c1 0.662,0.706,0.81803,90,125.744,90 - - 8.18 A 2690
Am-B-O Am[BO3] *,oP20,62 Pnma 0.5053,0.5738,0.8092,90,90,90 - rose - N 2689
Am-Br-O AmBrO PbClF,tP6,129 P4/nmm 0.3982,0.3982,0.7644,90,90,90 - - 9.29 X 12430
Am-Cl-K K2AmCl5 Y2HfS5,oP32,62 Pnma 1.26832,0.87038,0.79525,90,90,90 - tan yellow 3.77 A 20155
Am-Cl-O AmClO PbClF,tP6,129 P4/nmm 0.4,0.4,0.678,90,90,90 - - 9.01 X 513
Am-Cl-Rb Rb2AmCl5 Y2HfS5,oP32,62 Pnma 1.30854,0.88707,0.81629,90,90,90 - tan yellow 4.14 A 20155
Am-F-Li LiAmF5 LiUF5,tI112,88 I41/a 1.463,1.463,0.6449,90,90,90 - - 6.64 A 3124
Am-F-Na Na1.5 Am1.5 F6 Na2ThF6,hP9,150 P321 0.6109,0.6109,0.3731,90,90,120 Fe2P family - 7.06 A 2433
Am-F-Na Na7Am6F31 Na7Zr6F31,hR135,148 R-3 1.448,1.448,0.9665,90,90,120 - - 6.27 A 3126
Am-F-P AmPF6 tf KPF6,cF104,225 Fm-3m 0.791,0.791,0.791,90,90,90 - - 5.21 A 27
Am-F-Rb Rb2AmF6 K2ZrF6,oS36,63 Cmcm 0.6962,1.2001,0.7579,90,90,90 - orange 5.54 A 3565
244 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Am-H-O Am[OH]3 UCl3,hP8,176 P63 /m 0.6426,0.6426,0.3745,90,90,120 - - 7.29 A 3863


Am-I-O AmIO PbClF,tP6,129 P4/nmm 0.4011,0.4011,0.9204,90,90,90 - - 8.66 A 6782
Am-I-O Am[IO3]3 mon1 Gd[IO3 ]3,mP52,14 P121/c1 0.723,0.85511,1.35361,90,100.035,90 - yellow 6.19 X 44708
Am-I-O Am[IO3]3 mon2 Bi[IO3]3,mP52,14 P121/c1 0.8871,0.5933,1.67444,90,114.781,90 - - 6.37 X 46428
Am-Li-O Li4AmO5 *,tI20,87 I4/m 0.6666,0.6666,0.441,90,90,90 - - - N 2686
Am-Li-O Li7AmO6 *,hR42,146 R3 0.554,0.554,1.565,90,90,120 - - - N 2687
Am-Mo-O Am0.67 [MoO4] Ca[WO4],tI24,88 I41/a 0.524,0.524,1.152,90,90,90 - - 6.78 A 4579
Am-Mo-Se AmMo6Se 8 Mo6PbS8,hR45,148 R-3 0.9449,0.9449,1.1906,90,90,120 Chevrel phase - 7.85 A 14426
Am-Na-O Na0.75 Am0.25 O NaCl,cF8,225 Fm-3m 0.475,0.475,0.475,90,90,90 rocksalt family - 5.83 X 2687
Am-Nb-O AmNbO4 rt *,mP24,14 P121/c1 0.514,1.125,0.544,90,94.95,90 - - - N 2690
Am-Nb-O Am0.33 NbO3 SrZrO3,tI20,140 I4/mcm 0.5401,0.5401,0.7835,90,90,90 - - 6.43 A 2689
Am-Ni-Sn Am2Ni2Sn Mo2FeB2,tP10,127 P4/mbm 0.7315,0.7315,0.3765,90,90,90 - - 11.90 X 33518
Am-O-Pa Pa0.5 Am0.5 O2 CaF2,cF12,225 Fm-3m 0.5458,0.5458,0.5458,90,90,90 fluorite family - 10.99 X 2690
Am-O-Pu Pu0.8 Am0.2 O2 CaF2,cF12,225 Fm-3m 0.5392,0.5392,0.5392,90,90,90 fluorite family - 11.69 X 52771
Am-O-S Am2SO2 Ce2SO2,hP5,164 P-3m1 0.391,0.391,0.6772,90,90,120 - - 10.19 A 10776
Am-O-S Am2[SO4 ]O2 *,oI18,71 Immm 0.4103,0.4225,1.3328,90,90,90 - - - N 10776
Am-O-Si Am2[Si2O7] Nd2[Si2O7 ],oP44,19 P212121 0.5396,0.8639,1.294,90,90,90 - rose 7.20 A 16540
Am-O-Si Am4[SiO4 ]3 Pb4.5 [PO4]3,hP40,176 P63 /m 0.9556,0.9556,0.7024,90,90,120 apatite family rose 7.46 A 16540
Am-O-Si Am4.67 [SiO4]3O La4.67 [SiO4]3O,hP42,176 P63 /m 0.9555,0.9555,0.7015,90,90,120 apatite family rose 8.55 A 16540
Am-O-Ta AmTaO4 *,mP24,14 P121/c1 0.512,1.121,0.548,90,95.37,90 - - - N 2690
Am-O-Ta Am0.33 TaO3 SrZrO3,tI20,140 I4/mcm 0.55,0.55,0.782,90,90,90 - - 8.68 A 2689
Am-O-Th Th0.8 Am0.2 O1.9 CaF2,cF12,225 Fm-3m 0.5597,0.5597,0.5597,90,90,90 fluorite family - 10.03 X 58240
Am-O-U U0.85 Am0.15 O2 CaF2,cF12,225 Fm-3m 0.5479,0.5479,0.5479,90,90,90 fluorite family - 10.94 X 58965
Am-O-V AmVO3 GdFeO3,oP20,62 Pnma 0.558,0.776,0.545,90,90,90 perovskite family ochre 9.62 A 2689
Am-O-V Am[VO4] Zr[SiO4],tI24,141 I41/amd 0.7311,0.7311,0.6422,90,90,90 - brown red 6.93 A 45151
Am-O-W Am0.67 [WO4] Ca[WO4],tI24,88 I41/a 0.524,0.524,1.152,90,90,90 - - 8.62 A 4579
Am-O-Zr Am0.5 Zr0.5 O1.75 CaF2,cF12,225 Fm-3m 0.53233,0.53233,0.53233,90,90,90 fluorite family - 8.59 X 52292
Am-O-Zr Am2Zr2O7 Ca2Nb2O7 ,cF88,227 Fd-3m 1.06685,1.06685,1.06685,90,90,90 pyrochlore family - 8.54 X 50554
Am-Pd-Sn Am2Pd2Sn Mo2FeB2,tP10,127 P4/mbm 0.7603,0.7603,0.3851,90,90,90 - - 12.20 X 33518
Ar-D-O Ar[D2O]3 hp2 Ar[H2O]3,tP16,136 P42 /mnm 0.6342,0.6342,1.061,90,90,90 - - 1.56 X 43273
Ar-D-O Ar[D2O]3.4 hp1 Ar[H2O]3.4 ,hP47,191 P6/mmm 1.1979,1.1979,0.987,90,90,120 - - 1.46 X 43273
Ar-D-O Ar[D2O]4.5 rt Ar[H2O]4.5 ,cF184,227 Fd-3m 1.7075,1.7075,1.7075,90,90,90 - - 1.39 X 43273
As-Au-Ba BaAuAs BeZrSi,hP6,194 P63 /mmc 0.45353,0.45353,0.9027,90,90,120 AlB2 family black 8.45 X 53423
As-Au-Ba Ba4Au0.5 As2.5 Th3P 4,cI28,220 I-43d 0.99607,0.99607,0.99607,90,90,90 - - 5.61 X 41040
As-Au-Ca CaAuAs BeZrSi,hP6,194 P63 /mmc 0.4388,0.4388,0.7925,90,90,120 AlB2 family gray 7.84 X 32708
As-Au-Ce AuCeAs2 mon AuCeAs2,mP16,11 P121/m1 0.5804,0.5814,1.0179,90,90.09,90 - black 9.42 X 51871
As-Au-Ce AuCeAs2 tet CuHfSi2,tP8,129 P4/nmm 0.41135,0.41135,1.0153,90,90,90 - gray 9.41 X 42505
As-Au-Eu AuEuAs BeZrSi,hP6,194 P63 /mmc 0.4445,0.4445,0.8285,90,90,120 AlB2 family blue gray 9.93 X 14785
As-Au-Gd AuGdAs2 mon CuGdAs2,mP8,11 P121/m1 0.3957,0.406,1.0135,90,90.01,90 - black 10.28 X 51872
As-Au-Gd AuGdAs2 tet CuHfSi2,tP8,129 P4/nmm 0.4016,0.4016,1.0148,90,90,90 - gray 10.23 A 42505
As-Au-Ge AuGeAs PdP2,mS12,15 C12/c1 0.711,0.634,0.63377,90,119.175,90 - - 9.17 X 17380
As-Au-K K5AuAs2 K5CuAs2,hP16,194 P63 /mmc 0.573,0.573,1.9216,90,90,120 - black 3.30 X 26036
As-Au-La AuLaAs2 SrZnBi2,tI16,139 I4/mmm 0.4169,0.4169,2.0595,90,90,90 - gray 9.01 X 42505
As-Au-Na Na2AuAs Na2CuAs,oS16,63 Cmcm 0.8871,0.7129,0.576,90,90,90 - gray 5.80 X 13859
As-Au-Nd AuNdAs2 orth SrZnSb2,oP16,62 Pnma 2.0435,0.4058,0.4059,90,90,90 - black 9.69 X 55021
As-Au-Nd AuNdAs2 tet CuHfSi2,tP8,129 P4/nmm 0.4079,0.4079,1.019,90,90,90 - gray 9.62 A 42505
As-Au-Pr AuPrAs2 orth AgCeAs2,oP32,57 Pbcm 0.5757,2.0458,0.5766,90,90,90 - black 9.54 X 55021
As-Au-Pr AuPrAs2 tet CuHfSi2,tP8,129 P4/nmm 0.40897,0.40897,1.0212,90,90,90 - gray 9.48 A 42505
As-Au-Sm AuSmAs2 orth1 CuHfSi2,tP8,129 P4/nmm 0.40394,0.40394,1.0169,90,90,90 - gray 9.95 A 42505
As-Au-Sm AuSmAs2 orth2 SrZnSb2,oP16,62 Pnma 2.0331,0.4019,0.4049,90,90,90 - black 9.98 X 55021
As-Au-Sr SrAuAs BeZrSi,hP6,194 P63 /mmc 0.4454,0.4454,0.8451,90,90,120 AlB2 family gray 8.22 X 32708
As-Au-Tb AuTbAs2 mon CuGdAs2,mP8,11 P121/m1 0.3933,0.4089,1.0135,90,90,90 - black 10.31 X 51872
As-Au-Tb AuTbAs2 tet CuHfSi2,tP8,129 P4/nmm 0.39985,0.39985,1.0099,90,90,90 - gray 10.40 A 42505
As-B-Cl B2AsCl2 B2AsCl2,aP20,2 P-1 0.6862,0.7134,1.0692,99.42,99.44,118.19 - - 2.54 X 29937
As-B-Cs Cs3BAs2 K3BP 2,mS24,15 C12/c1 1.006,0.987,1.0171,90,110.62,90 - orange 3.93 X 24284
As-B-K K3BAs2 K3BP 2,mS24,15 C12/c1 0.9609,0.9109,0.9194,90,111.68,90 - yellow 2.47 X 24260
As-B-O B[AsO4] hp1 Al[AsO4],hP18,152 P3121 0.4547,0.4547,1.0304,90,90,120 - - 4.04 X 44046
As-B-O B[AsO4] hp2 *,hP54,* - 0.791,0.791,1.032,90,90,120 - - - N 1071
As-B-O B[AsO4] rt B[PO4],tI12,82 I-4 0.44658,0.44658,0.68139,90,90,90 - - 3.66 X 42208
As-B-Rb Rb3BAs2 K3BP 2,mS24,15 C12/c1 0.9772,0.9443,0.9649,90,111.08,90 - yellow 3.33 X 31185
As-Ba-Cd BaCd2 As2 Ce2SO2,hP5,164 P-3m1 0.4516,0.4516,0.7693,90,90,120 - - 6.26 X 17679
As-Ba-Cd Ba2CdAs2 CdYb2Sb2 ,oS20,36 Cmc21 0.45922,1.74047,0.80526,90,90,90 - black 5.54 X 56383
As-Ba-Cd Ba2Cd2As3 Ba2Cd2As3,mS28,12 C12/m1 1.7188,0.45472,1.2725,90,126.639,90 - black 6.03 X 54074
As-Ba-Cd Ba3Cd2As4 (Ba0.98 Ca0.02 )3Cd2Sb4,mS18,12 C12/m1 1.7089,0.46076,0.7304,90,112.312,90 - black 5.85 X 59683
As-Ba-Co BaCo10As6 SrNi10P6,oP68,62 Pnma 1.6405,0.6858,0.8955,90,90,90 - gray 7.75 X 38156
As-Ba-Co BaCo2As2 Cu2TlSe2,tI10,139 I4/mmm 0.3958,0.3958,1.267,90,90,90 - gray steel 6.78 A 13894
As-Ba-Cr BaCr2As2 Cu2TlSe2,tI10,139 I4/mmm 0.3963,0.3963,1.36,90,90,90 - gray steel 6.08 A 13894
As-Ba-Cu BaCuAs BeZrSi,hP6,194 P63 /mmc 0.4372,0.4372,0.9073,90,90,120 AlB2 family gray 6.10 X 12867
As-Ba-Cu BaCu2 As2 CeAl2Ga2,tI10,139 I4/mmm 0.44119,0.44119,1.0193,90,90,90 - gray steel 6.93 X 58922
As-Ba-Cu BaCu4 As2 CaCu4P 2,hR21,166 R-3m 0.4234,0.4234,2.4475,90,90,120 - gray steel 7.10 X 36662
As-Ba-Cu BaCu6 As2 BaCu6P 2,tP9,123 P4/mmm 0.4211,0.4211,0.8722,90,90,90 - - 7.18 X 30209
As-Ba-Cu BaCu7.67 As5 BaNi9P 5,hP30,194 P63 /mmc 0.67329,0.67329,1.16747,90,90,120 - gray silver 7.24 X 37056
As-Ba-Cu BaCu8 As4 BaCu8P 4,tI26,87 I4/m 1.0455,1.0455,0.3969,90,90,90 - - 7.24 X 24199
As-Ba-F BaAs2F12 BaAu2F12,cP60,215 P-43m 0.944,0.944,0.944,90,90,90 - - 4.07 A 23989
As-Ba-Fe BaFe2As2 lt SrRh2As2,oF20,69 Fmmm 0.55742,0.56146,1.29453,90,90,90 - - 6.54 X 51264
As-Ba-Fe BaFe2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.37796,0.37796,0.9593,90,90,90 - black 9.67 X 57131
As-Ba-Ga BaGa2 As2 BaGa2P 2,mP20,14 P121/c1 0.7495,0.9901,0.7643,90,115.381,90 - black 5.53 X 54386
As-Ba-Ga Ba2Ga5As5 Ba2Ga5As5,oP52,62 Pnma 1.6729,0.41042,1.7214,90,90,90 - - 5.61 X 56142
Handbook of Inorganic Substances – Edition 2015 : Data 245

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Ba-Ga Ba4Ga5As8 Ba4Ga5As8,mS100,15 C12/c1 2.0196,0.68895,1.33461,90,110.01,90 - - 5.70 X 56142


As-Ba-Ge BaGe2As2 BaGe2As2,tP20,105 P42mc 0.7786,0.7786,0.8664,90,90,90 - - 5.47 X 14805
As-Ba-Ge Ba2GeAs2 Ba2GeP2,mP20,14 P121/c1 0.8757,0.97,0.7667,90,106.03,90 - - 5.28 X 15749
As-Ba-Ge Ba4GeAs4 Ba4SiAs4,cP72,218 P-43n 1.3419,1.3419,1.3419,90,90,90 - - 5.07 X 14689
As-Ba-Hf Ba0.4 Hf6As8.85 Ba0.4 Hf6As8.85,hP40,176 P63/m 1.4997,1.4997,0.35526,90,90,120 - - 8.59 X 34361
As-Ba-I Ba2AsI NaFeO2,hR12,166 R-3m 0.47775,0.47775,2.45636,90,90,120 rocksalt family - 4.89 A 8090
As-Ba-In Ba2In5 As5 Ba2In5P 5,oP48,62 Pnma 1.7461,0.42905,1.7961,90,90,90 - gray silver 6.04 X 50175
As-Ba-In Ba3InAs3 Ca3AlAs3,oP28,62 Pnma 1.384,0.4601,1.445,90,90,90 - - 5.43 X 32574
As-Ba-K KBa2As5 KBa2As5,oS32,36 Cmc21 0.7872,1.0529,1.177,90,90,90 - black blue 4.69 X 43991
As-Ba-Li LiBaAs LiBaSi,hP3,187 P-6m2 0.4622,0.4622,0.4364,90,90,120 AlB2 family black 4.51 X 33892
As-Ba-Li Li4Ba3As4 Cu4Gd3Ge4,oI22,71 Immm 0.47034,0.71735,1.5643,90,90,90 - gray silver 4.65 X 35425
As-Ba-Mg BaMg2As2 Ce2SO2,hP5,164 P-3m1 0.448,0.448,0.7732,90,90,120 - brown red 4.15 X 17679
As-Ba-Mn BaMn2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4169,0.4169,1.3432,90,90,90 - gray steel 5.65 X 57170
As-Ba-Mn Ba14 MnAs11 Ca14 AlSb11,tI208,142 I41/acd 1.7433,1.7433,2.3264,90,90,90 - - 5.26 A 28583
As-Ba-Ni BaNi2As2 lt BaNi2As2,aP5,2 P-1 0.41586,0.41708,0.6444,108.668,107.915,90.085 - - 6.71 X 53181
As-Ba-Ni BaNi2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.4136,0.4136,1.166,90,90,90 - gray steel 6.74 X 54858
As-Ba-Ni BaNi9As5 BaNi9P 5,hP30,194 P63/mmc 0.676,0.676,1.1226,90,90,120 - gray silver 7.78 X 25516
As-Ba-O Ba2As6O11 Ba2As6O11,aP22,2 P-1 0.5258,0.7059,0.8951,71.49,86.36,82.57 - - 4.79 X 19699
As-Ba-O Ba3[AsO4]2 Ba3[PO4]2,hR39,166 R-3m 0.5767,0.5767,2.1163,90,90,120 - colorless 5.64 X 32693
As-Ba-O Ba4As2O K2NiF4,tI14,139 I4/mmm 0.51246,0.51246,1.7336,90,90,90 high-Tc family black 5.22 X 25524
As-Ba-O Ba4As2O9 *,o**,* - 0.794,1.049,1.354,90,90,90 - - - N 2849
As-Ba-Pd BaPdAs LiBaSi,hP3,187 P-6m2 0.4347,0.4347,0.4716,90,90,120 AlB2 family gray 6.86 X 32708
As-Ba-Pd BaPdAs2 CeNiSi2,oS16,63 Cmcm 0.4678,1.733,0.4574,90,90,90 - gray silver 7.05 X 32630
As-Ba-Pd BaPd2As2 ht CeAl2Ga2,tI10,139 I4/mmm 0.4486,0.4486,1.0315,90,90,90 - - 8.00 X 19686
As-Ba-Pd BaPd2As2 tet1 Mg2 CeSi2,tP5,123 P4/mmm 0.4346,0.4346,0.5758,90,90,90 - gray steel 7.63 X 17724
As-Ba-Pd BaPd2As2 tet2 BaPd2As2,tI20,139 I4/mmm 0.4487,0.4487,2.0635,90,90,90 - - 7.99 X 17724
As-Ba-Pt BaPtAs NiSbS,cP12,198 P213 0.6716,0.6716,0.6716,90,90,90 pyrite-marcasite family brown dark 8.93 X 19673
As-Ba-Pt BaPtAs2 CeNiSi2,oS16,63 Cmcm 0.466,1.7119,0.4608,90,90,90 - gray silver 8.71 X 32630
As-Ba-Pt BaPt0.85 As0.90 LiBaSi,hP3,187 P-6m2 0.4325,0.4325,0.4763,90,90,120 AlB2 family gray dark 7.98 X 19673
As-Ba-Pt BaPt2As2 CaBe2Ge2,tP10,129 P4/nmm 0.4564,0.4564,1.0021,90,90,90 - gray steel 10.78 A 49597
As-Ba-Pt BaPt4As6 BaPt4As6,mS44,15 C12/c1 0.8688,0.8333,1.1971,90,90.81,90 - gray 10.48 X 20919
As-Ba-Rb RbBa2 As5 RbBa2 As5,hP39,152 P3121 0.7784,0.7784,1.4309,90,90,120 - black blue 4.87 X 43991
As-Ba-Rh BaRh2 As2 CeAl2Ga2,tI10,139 I4/mmm 0.4053,0.4053,1.277,90,90,90 - gray silver 7.81 X 49746
As-Ba-Ru BaRu2 As2 CeAl2Ga2,tI10,139 I4/mmm 0.4152,0.4152,1.224,90,90,90 - - 7.70 A 55247
As-Ba-Ru BaRu4 As12 LaFe 4P 12,cI34,204 Im-3 0.85555,0.85555,0.85555,90,90,90 - - 7.64 X 54856
As-Ba-S Ba2As2S5 Ba2As2S5,oP72,29 Pca21 1.7345,0.9256,1.1946,90,90,90 - red ruby 4.05 X 16558
As-Ba-Se Ba2As2Se5 Ba2As2Se5,mP36,4 P1211 0.9499,1.2396,1.00687,90,117.506,90 - red dark 5.18 X 18512
As-Ba-Si Ba3Si2As4 Sr3Si2As4,mS36,15 C12/c1 0.9538,1.7425,0.7701,90,122.45,90 - - 4.72 X 15759
As-Ba-Si Ba4SiAs4 Ba4SiAs4,cP72,218 P-43n 1.3307,1.3307,1.3307,90,90,90 - gray steel 4.94 X 14689
As-Ba-Sn Ba3Sn2As4 Ca3Si2As4,mP36,14 P121/c1 0.8066,1.9861,0.7931,90,112.3,90 - - 5.36 X 17708
As-Ba-Sn Ba3Sn4As6 Ba3Sn4As6,mP64,14 P121/c1 0.86374,1.83536,1.29979,90,131.593,90 - gray dark 5.76 X 39382
As-Ba-Ti Ba4TiAs4 Ba4SiAs4,cP72,218 P-43n 1.3469,1.3469,1.3469,90,90,90 - violet 4.88 X 32424
As-Ba-Zn BaZn2 As2 ht Cu2TlSe 2,tI10,139 I4/mmm 0.412,0.412,1.3578,90,90,90 - gray silver 6.02 X 49746
As-Ba-Zn BaZn2 As2 rt BaCu2S2,oP20,62 Pnma 1.001,0.4246,1.091,90,90,90 - gray 5.99 X 12014
As-Ba-Zn Ba2ZnAs2 K2ZnO2,oI20,72 Ibam 0.6878,1.3399,0.6541,90,90,90 - black 5.40 X 54346
As-Ba-Zn Ba3Zn2As4 (Ba0.98 Ca0.02)3Cd2Sb4,mS18,12 C12/m1 1.6916,0.4497,0.7225,90,113.147,90 - black 5.54 X 59683
As-Be-K K4BeAs2 K4CdP 2,hR21,166 R-3m 0.5681,0.5681,2.58,90,90,120 - black 2.18 X 24268
As-Be-Li LiBeAs MnAlGe,tP6,129 P4/nmm 0.3749,0.3749,0.6219,90,90,90 - - 3.45 X 11097
As-Be-Na NaBeAs BeZrSi,hP6,194 P63/mmc 0.382,0.382,0.8948,90,90,120 AlB2 family red dark 3.14 X 11096
As-Bi-In InBi0.03 As0.97 ZnS,cF8,216 F-43m 0.60875,0.60875,0.60875,90,90,90 adamantane structure - 5.71 X 23476
As-Bi-O Bi[AsO4] mon Ce[PO4],mP24,14 P121/c1 0.6732,0.7159,0.83017,90,126.776,90 rooseveltite gray 7.21 X 14877
As-Bi-O Bi[AsO4] tet Ca[WO4],tI24,88 I41/a 0.508,0.508,1.17,90,90,90 tetrarooseveltite - 7.65 X 284
As-Bi-O Bi1.8696 As0.1304 O3.1304 ht *,mP*,* - 0.68842,0.9798,0.6888,90,119.655,90 - - - N 27688
As-Bi-O Bi11.95 As0.83 O20 rt Bi12 SiO20,cI66,197 I23 1.02094,1.02094,1.02094,90,90,90 - - 8.99 A 27688
As-Bi-O Bi4[AsO3][AsO4]O3 Bi4[AsO3][AsO4]O3,mS264,15 C12/c1 3.54776,0.5528,2.4372,90,123.661,90 - colorless 7.65 X 59668
As-Bi-Pd PdBi0.7 As0.3 NiAs,hP4,194 P63/mmc 0.403,0.403,0.5735,90,90,120 AlB2 family - 11.33 X 6345
As-Bi-Pd Pd3Bi0.4 As0.6 m BiF3 ,cF16,225 Fm-3m 0.6195,0.6195,0.6195,90,90,90 b.c.c. family - 12.51 X 23068
As-Br-Ca Ca0.86 As0.36 Br0.64 NaCl,cF8,225 Fm-3m 0.601,0.601,0.601,90,90,90 rocksalt family brown dark 3.44 X 17634
As-Br-Ca Ca3AsBr3 Mg3 NF3,cP7,221 Pm-3m 0.592,0.592,0.592,90,90,90 rocksalt family green 3.48 X 17634
As-Br-Cd Cd2As3Br rt Cd2As3I,mS24,15 C12/c1 0.8281,0.9411,0.7993,90,101.49,90 - - 5.76 X 29165
As-Br-Cd Cd4As2Br3 Cd4As2I3,cP72,205 Pa-3 1.265,1.265,1.265,90,90,90 - - 5.51 A 21191
As-Br-F [Br3 ]AsF6 tricl [I3]AsF6,aP20,2 P-1 0.5641,0.7644,0.981,86.61,80.84,79.89 - brown dark 3.46 X 25494
As-Br-F [Br5 ]AsF6 mon *,mS48,15 C12/c1 1.2687,0.8693,1.017,90,115.82,90 - brown dark - N 24491
As-Br-Ge Ge19 As4Br4 Ge19P4I4,cP54,218 P-43n 1.05161,1.05161,1.05161,90,90,90 clathrate gray silver 5.71 A 7795
As-Br-Hg Hg19 As10Br18 Hg19 As10Br18,aP47,2 P-1 1.1255,1.1348,1.2295,105.73,105.72,109.15 - brown dark 7.60 X 30955
As-Br-Hg Hg2 As3Br Cd2As3I,mS24,15 C12/c1 0.80914,0.93,0.81084,90,99.323,90 - black 7.79 X 29165
As-Br-Hg Hg4 As2Br3 Cd4As2I3,cP72,205 Pa-3 1.261,1.261,1.261,90,90,90 - gray dark 7.90 X 32122
As-Br-La La3AsBr3 Ca3PI3,cI56,214 I4132 1.209,1.209,1.209,90,90,90 - - 5.50 A 36169
As-Br-Pr Pr3AsBr3 Ca3PI3,cI56,214 I4132 1.202,1.202,1.202,90,90,90 - - 5.64 A 36169
As-C-Cr Cr3AsC Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.3057,1.0213,0.747,90,90,90 - - 6.92 A 4188
As-C-Cr Cr6As2.5 C0.5 ht K2UF6,hP9,189 P-62m 0.5304,0.5304,0.3408,90,90,120 Fe2P family - 10.11 X 6167
As-C-F AsCF3 PCF3,tP40,137 P42/nmc 1.0483,1.0483,0.6381,90,90,90 - colorless 2.73 X 5700
As-C-F As[C6F5]3F2 PC18 F17,oP144,60 Pbcn 0.8959,1.1214,1.8343,90,90,90 - colorless 2.21 X 18804
As-C-F [C60 ]As2F12 [C60 ]As2F12,mS60,12 C12/m1 3.37279,0.9993,1.045,90,108.039,90 fullerene family brown 2.18 X 54447
As-C-N As[CN]3 As[CN]3,mS28,5 C121 0.919,0.69,0.892,90,101.2,90 - white 1.83 X 1806
As-C-Nb Nb2 AsC Cr2AlC,hP8,194 P63/mmc 0.3317,0.3317,1.19,90,90,120 - - 7.99 X 4177
As-C-V V2 AsC Cr2AlC,hP8,194 P63/mmc 0.3113,0.3113,1.138,90,90,120 - - 6.57 X 3191
As-C-V V3 AsC Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.3128,1.014,0.7699,90,90,90 - - 6.52 X 3659
246 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-C-V V5 As3C0.7 CuHf5Sn3,hP18,193 P63 /mcm 0.7121,0.7121,0.4963,90,90,120 AlB2 family - 7.43 X 3191
As-Ca-Cd CaCd2 As2 Ce2SO2,hP5,164 P-3m1 0.4391,0.4391,0.7184,90,90,120 - - 5.74 X 11120
As-Ca-Cd Ca2CdAs2 ht Ca2CdAs2 ,mS50,8 C1m1 2.15152,0.43005,1.43761,90,110.017,90 - black 4.55 X 56383
As-Ca-Cd Ca2CdAs2 rt CdYb2Sb2 ,oS20,36 Cmc21 0.43163,1.65063,0.71418,90,90,90 - black 4.47 X 56383
As-Ca-Cl Ca3AsCl3 Mg3NF3,cP7,221 Pm-3m 0.576,0.576,0.576,90,90,90 rocksalt family colorless 2.62 X 15655
As-Ca-Co CaCo2As2 Cu2TlSe2,tI10,139 I4/mmm 0.3989,0.3989,1.033,90,90,90 - gray steel 6.22 A 13894
As-Ca-Co Ca2Co12As7 Ba7Cl2F12 ,hP28,176 P63 /m 0.9428,0.9428,0.3728,90,90,120 - gray 7.59 X 39440
As-Ca-Cu CaCuAs BeZrSi,hP6,194 P63 /mmc 0.4184,0.4184,0.7868,90,90,120 AlB2 family red ruby 4.97 X 12038
As-Ca-Cu CaCu1.75 As2 CeAl2Ga2,tI10,139 I4/mmm 0.4129,0.4129,1.0251,90,90,90 - black gray 5.72 X 24149
As-Ca-Cu CaCu3.9 As2 CaCu4P 2,hR21,166 R-3m 0.4163,0.4163,2.2554,90,90,120 - gray steel 6.44 X 36662
As-Ca-F CaAs2F12 CaAu2F12,tP15,81 P-4 0.4758,0.4758,0.7761,90,90,90 - - 3.95 A 23989
As-Ca-F CaAs3F15 CaAs3F15,oP80,62 Pnma 1.0349,1.0017,1.0884,90,90,90 - colorless 3.24 X 43267
As-Ca-Fe CaFe2As2 lt SrRh2As2,oF20,69 Fmmm 0.54577,0.55294,1.16625,90,90,90 - - 5.69 X 51296
As-Ca-Fe CaFe2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.36727,0.36727,0.93173,90,90,90 - - 7.97 X 57131
As-Ca-Fe CaFe4As3 rt CaFe4As3,oP32,62 Pnma 1.18953,0.3743,1.161,90,90,90 - black 6.27 X 52396
As-Ca-Ga CaGa2 As2 NaSn2 As2 ,hR15,166 R-3m 0.39906,0.39906,2.482,90,90,120 - - 4.79 X 56142
As-Ca-Ga Ca14GaAs11 *,tI208,142 I41/acd 1.562,1.562,2.1138,90,90,90 - - - N 24744
As-Ca-Ga Ca3GaAs3 Ca3AlAs3,oP28,62 Pnma 1.2171,0.4197,1.3414,90,90,90 - - 4.02 X 18707
As-Ca-Ga Ca5Ga2As6 Ca5Ga2As6,oP26,55 Pbam 1.1357,1.3224,0.4138,90,90,90 - black 4.22 X 9668
As-Ca-Ge Ca3Ge2As4 Ca3Si2As4 ,mP36,14 P121/c1 0.7308,1.7886,0.72396,90,111.75,90 - gray 4.27 X 15619
As-Ca-H Ca5As3H2 Mn5Si3,hP16,193 P63 /mcm 0.84412,0.84412,0.6774,90,90,120 - - 3.39 F 46240
As-Ca-I Ca2AsI NaFeO2,hR12,166 R-3m 0.4397,0.4397,2.229,90,90,120 rocksalt family brown 3.76 X 21924
As-Ca-I Ca3AsI3 Ca3PI3,cI56,214 I4132 1.242,1.242,1.242,90,90,90 - colorless 3.99 A 7331
As-Ca-In Ca3In2 As4 Sr3In2P 4,oP18,58 Pnnm 0.6595,1.6212,0.4306,90,90,90 - gray 4.69 X 19780
As-Ca-Ir Ca4Ir8As7 Ca4Ir8P 7,mP38,11 P121/m1 1.2987,0.407,1.347,90,98.14,90 - gray silver 10.47 X 43983
As-Ca-Li LiCaAs TiNiSi,oP12,62 Pnma 0.7245,0.4321,0.7892,90,90,90 AlB2 family green 3.28 A 33892
As-Ca-Mg CaMg2As2 Ce2SO2,hP5,164 P-3m1 0.434,0.434,0.713,90,90,120 - brown red 3.41 X 11115
As-Ca-Mn CaMn2As2 Ce2SO2,hP5,164 P-3m1 0.4239,0.4239,0.7027,90,90,120 - black gray 4.55 X 12026
As-Ca-Mn Ca14MnAs11 Ca14AlSb11 ,tI208,142 I41/acd 1.5714,1.5714,2.1141,90,90,90 - - 3.67 A 28583
As-Ca-N Ca3AsN ht CaTiO3,cP5,221 Pm-3m 0.477,0.477,0.477,90,90,90 perovskite family - 3.20 X 26375
As-Ca-N Ca3AsN rt GdFeO3,oP20,62 Pnma 0.67246,0.95402,0.67301,90,90,90 perovskite family - 3.22 X 26376
As-Ca-Ni CaNi2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4065,0.4065,0.9949,90,90,90 - gray steel 6.21 X 13883
As-Ca-Ni Ca2.3 Ni11.7 As7 Zr2Fe12P 7,hP21,174 P-6 0.9404,0.9404,0.3816,90,90,120 - gray 7.41 X 13889
As-Ca-O CaAs2O6 PbSb2O6,hP9,162 P-31m 0.48258,0.48258,0.50824,90,90,120 - - 4.63 X 30473
As-Ca-O Ca2[As2O7] Sc2[Si2O7],mS22,12 C12/m1 0.7049,0.9297,0.4885,90,101.27,90 - - 3.62 X 13545
As-Ca-O Ca3[AsO4 ]2 Ca3[AsO4]2,hR276,161 R3c 1.077,1.077,3.781,90,90,120 - - 3.65 X 5894
As-Ca-O Ca4As2O K2NiF4,tI14,139 I4/mmm 0.4537,0.4537,1.5449,90,90,90 high-Tc family yellow 3.41 X 21365
As-Ca-O Ca4As2O9 rt *,o**,* - 0.711,0.989,1.228,90,90,90 - - - N 2849
As-Ca-Pd CaPdAs CaPdAs,oP48,62 Pnma 0.7137,0.8646,1.659,90,90,90 AlB2 family gray 5.75 X 26866
As-Ca-Pd CaPd2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4299,0.4299,1.0102,90,90,90 - gray steel 7.16 X 17724
As-Ca-Pt CaPtAs CaPtAs,tI36,109 I41md 0.4183,0.4183,4.3711,90,90,90 - brown gray 8.08 X 19725
As-Ca-Rb RbCaAs PbClF,tP6,129 P4/nmm 0.5142,0.5142,0.7932,90,90,90 - red 3.17 X 35308
As-Ca-Rh CaRh6 As4 LiCo 6P 4,hP11,187 P-6m2 0.7201,0.7201,0.3755,90,90,120 - gray light 9.43 X 36645
As-Ca-Rh Ca4Rh13As9 Ca4Rh13As9,oP54,59 Pmmn 0.3903,1.1221,1.9411,90,90,90 - - 8.49 X 39495
As-Ca-Ru CaRu2 As2 CeAl2Ga2,tI10,139 I4/mmm 0.4173,0.4173,1.0293,90,90,90 - - 7.26 A 20401
As-Ca-Si Ca3Si2As4 mon1 Ca3Si2As4 ,mP36,14 P121/c1 0.7303,1.773,0.7155,90,111.66,90 - gray 3.67 X 15619
As-Ca-Si Ca5.75 Si4.5 As8 mon2 Ca5.75 Si4.5 As8,mP46,11 P121/m1 0.7134,1.7651,0.7267,90,111.74,90 - - 3.74 X 8837
As-Ca-Sn Ca5Sn2As6 Ca5Sn2As6 ,oP26,55 Pbam 1.183,1.3643,0.4121,90,90,90 - - 4.43 X 18651
As-Ca-Zn CaZn2 As2 Ce2SO2,hP5,164 P-3m1 0.4162,0.4162,0.701,90,90,120 - - 5.06 X 11120
As-Cd-Ce Cd3CeAs3 Zn3PrAs3,hP22,194 P63 /mmc 0.4405,0.4405,2.13511,90,90,120 - gray 6.50 X 56276
As-Cd-Cl Cd2AsCl2 Cd2AsCl2,mP20,14 P121/c1 0.7858,0.9193,0.8189,90,119.95,90 - red light 4.80 X 13086
As-Cd-Cl Cd3AsCl3 Cd3AsCl3,oP28,62 Pnma 1.3144,0.8102,0.7082,90,90,90 - green light 4.57 X 12976
As-Cd-Cl Cd4As2Cl3 Cd4As2I3,cP72,205 Pa-3 1.2391,1.2391,1.2391,90,90,90 - red dark 4.93 A 3271
As-Cd-Cl Cd8As7Cl Cd8As7Cl,cP20,195 P23 0.7266,0.7266,0.7266,90,90,90 - black 6.32 X 33530
As-Cd-Cs CsCd4As3 KCu4S3,tP8,123 P4/mmm 0.4499,0.4499,1.0787,90,90,90 - black 6.14 X 56388
As-Cd-Cs Cs4CdAs14 Cs4CdAs14 ,mP76,14 P121/c1 1.0608,1.6761,1.4363,90,91.785,90 - red 4.41 X 56031
As-Cd-Cs Cs4Cd9As14 K4(Zn0.39 As0.61 )23,cP70,223 Pm-3n 1.13281,1.13281,1.13281,90,90,90 clathrate brown 5.92 X 57941
As-Cd-Cu Cu1.72 CdAs0.28 MgCu2,cF24,227 Fd-3m 0.70779,0.70779,0.70779,90,90,90 Friauf-Laves phase gray 9.09 X 58379
As-Cd-Cu Cu2.17 Cd0.83 As8 Cu2.17 Cd0.83 As8,mS52,15 C12/c1 1.18324,1.04423,0.80903,90,110.48,90 - black 5.89 X 55722
As-Cd-Cu Cu7Cd4As Cu7Cd4As,oP24,58 Pnnm 0.71251,0.98833,0.50895,90,90,90 Friauf-Laves phase gray 8.98 X 58379
As-Cd-Eu CdEu2 As2 CdYb2Sb2 ,oS20,36 Cmc21 0.44418,1.6847,0.74985,90,90,90 - black 6.70 X 56383
As-Cd-Eu Cd2EuAs2 Ce2SO2,hP5,164 P-3m1 0.44499,0.44499,0.735,90,90,120 - gray 6.94 X 57410
As-Cd-Ge CdGeAs2 CuFeS2,tI16,122 I-42d 0.59432,0.59432,1.12163,90,90,90 adamantane structure gray silver 5.61 X 8310
As-Cd-Ge Cd2GeAs4 Cd2GeAs4 ,oP28,62 Pnma 0.7182,0.742,1.2671,90,90,90 - - 5.87 X 8430
As-Cd-I Cd0.75 As0.25 I0.75 ZnO,hP4,186 P63 mc 0.4466,0.4466,0.7302,90,90,120 adamantane structure brown dark 5.22 X 14592
As-Cd-I Cd2As3I rt Cd2As3I,mS24,15 C12/c1 0.8436,0.9594,0.7952,90,100.65,90 - - 6.05 X 21080
As-Cd-I Cd4As2I3 Cd4As2I3,cP72,205 Pa-3 1.2993,1.2993,1.2993,90,90,90 - red 5.94 X 8793
As-Cd-K KCdAs PbClF,tP6,129 P4/nmm 0.455,0.455,0.7894,90,90,90 - blue gray 4.60 A 10297
As-Cd-K KCd4As3 RbCd4As3 ,hR24,166 R-3m 0.44714,0.44714,3.591,90,90,120 - golden 5.72 X 56388
As-Cd-K K4CdAs2 K4CdP 2,hR21,166 R-3m 0.5797,0.5797,2.7724,90,90,120 - black 2.58 X 25665
As-Cd-La Cd3LaAs3 Zn3PrAs3,hP22,194 P63 /mmc 0.4419,0.4419,2.14407,90,90,120 - gray 6.42 X 56276
As-Cd-Li LiCdAs MgAgAs,cF12,216 F-43m 0.6263,0.6263,0.6263,90,90,90 - - 5.25 X 21621
As-Cd-Mn Cd2.7 Mn0.3 As2 Zn3P 2,tP40,137 P42 /nmc 0.892,0.892,1.26,90,90,90 fluorite family - 6.23 A 20538
As-Cd-Na NaCdAs TiNiSi,oP12,62 Pnma 0.7576,0.4471,0.8044,90,90,90 AlB2 family blue gray 5.13 X 12876
As-Cd-Na NaCd4As3 RbCd4As3 ,hR24,166 R-3m 0.44546,0.44546,3.3681,90,90,120 - golden 6.00 X 56388
As-Cd-O CdAs2O6 PbSb2O6,hP9,162 P-31m 0.48269,0.48269,0.4866,90,90,120 - brown 6.06 X 38425
As-Cd-O Cd2[As2O7] Sc2[Si2O7],mS22,12 C12/m1 0.69446,0.90365,0.4853,90,101.77,90 - brown light 5.42 X 38428
As-Cd-O Cd3[AsO4 ]2 Cd3[AsO4 ]2,mP52,14 P121/c1 0.9285,1.1936,0.6599,90,98.45,90 - - 5.65 X 5627
Handbook of Inorganic Substances – Edition 2015 : Data 247

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Cd-P CdAsP CdAs2,tI12,98 I4122 0.7817,0.7817,0.4566,90,90,90 - - 5.20 A 22772


As-Cd-P CdAs0.5 P 1.5 ht ZnP 2,tP24,92 P41212 0.5355,0.5355,1.9854,90,90,90 - - 4.58 A 18462
As-Cd-P CdAs0.5 P 3 CdP 4,mP10,14 P121/c1 0.5302,0.5198,0.7672,90,99.33,90 - - 3.86 A 28699
As-Cd-Pd CdPd5As TlPd5As,tP7,123 P4/mmm 0.3989,0.3989,0.6971,90,90,90 - - 10.77 A 5603
As-Cd-Pd Cd0.33Pd2As0.67 Fe2P,hP9,189 P-62m 0.653,0.653,0.37,90,90,120 Fe2P family - 10.94 A 5603
As-Cd-Pr Cd3PrAs3 Zn3PrAs3,hP22,194 P63/mmc 0.43923,0.43923,2.13004,90,90,120 - gray 6.56 X 56276
As-Cd-Pt CdPt5As TlPd5As,tP7,123 P4/mmm 0.3955,0.3955,0.6976,90,90,90 - - 17.70 A 5603
As-Cd-Rb RbCd4As3 RbCd4As3,hR24,166 R-3m 0.44752,0.44752,3.6946,90,90,120 - golden 5.91 X 56388
As-Cd-S CdAs0.10 S0.85 ZnO,hP4,186 P63mc 0.4133,0.4133,0.6744,90,90,120 adamantane structure - 4.90 A 8228
As-Cd-Se CdAs0.02 Se0.97 ZnO,hP4,186 P63mc 0.4285,0.4285,0.6995,90,90,120 adamantane structure black gray 5.69 A 7398
As-Cd-Se Cd2.83 As1.87 Se0.13 ht2 Zn3P 2,tP40,137 P42/nmc 0.898,0.898,1.274,90,90,90 fluorite family black gray 6.06 A 7398
As-Cd-Si CdSiAs2 CuFeS2,tI16,122 I-42d 0.5885,0.5885,1.0881,90,90,90 adamantane structure - 5.12 A 16073
As-Cd-Sn CdSnAs2 rt CuFeS2,tI16,122 I-42d 0.6092,0.6092,1.1922,90,90,90 adamantane structure - 5.72 X 933
As-Cd-Sn Cd0.5 Sn0.5 As ht ZnS,cF8,216 F-43m 0.6051,0.6051,0.6051,90,90,90 adamantane structure - 5.71 X 6701
As-Cd-Sr SrCd2As2 Ce2SO2,hP5,164 P-3m1 0.4452,0.4452,0.7416,90,90,120 - black gray 6.03 X 13897
As-Cd-Sr Sr2CdAs2 CdYb2Sb2,oS20,36 Cmc21 0.44459,1.6904,0.75885,90,90,90 - black 5.10 X 56383
As-Cd-Te CdAs0.03 Te0.955 ZnS,cF8,216 F-43m 0.6457,0.6457,0.6457,90,90,90 adamantane structure gray 5.84 X 6695
As-Cd-Te Cd2.93 As1.86 Te0.14 ht2 Zn3P 2,tP40,137 P42/nmc 0.9177,0.9177,1.2997,90,90,90 fluorite family gray 5.91 A 6695
As-Cd-Yb Cd2YbAs2 Ce2SO2,hP5,164 P-3m1 0.4388,0.4388,0.7149,90,90,120 - - 7.63 A 32486
As-Cd-Zn Zn0.03 Cd0.97 As2 CdAs2,tI12,98 I4122 0.794,0.794,0.467,90,90,90 - - 5.88 X 42538
As-Cd-Zn Zn0.6 Cd2.4 As2 Zn3P 2,tP40,137 P42/nmc 0.884,0.884,1.256,90,90,90 fluorite family - 6.21 A 2145
As-Cd-Zn Zn0.97 Cd0.03 As2 Zn0.97 Cd0.03 As2,mP28,14 P121/c1 0.9282,0.7675,0.7992,90,102.41,90 - - 5.18 X 44767
As-Cd-Zn Zn2.1 Cd0.9 As2 rt *,t*80,* - 0.855,0.855,2.4,90,90,90 - - - N 2145
As-Ce-Co CeCo 2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4026,0.4026,1.0216,90,90,90 - - 8.18 A 11706
As-Ce-Cu CuCeAs2 CuHfSi2,tP8,129 P4/nmm 0.40181,0.40181,1.0104,90,90,90 - - 7.20 A 30559
As-Ce-Cu Cu1.10 CeAs2 CaBe2Ge2,tP10,129 P4/nmm 0.40265,0.40265,1.0071,90,90,90 - gray silver 7.32 X 36265
As-Ce-Cu Cu1.19 CeAs2 Cu1.09 CeP1.87 ,tI28,139 I4/mmm 0.4065,0.4065,2.016,90,90,90 - - 7.29 X 40013
As-Ce-Fe CeFeAs PbClF,tP6,129 P4/nmm 0.39998,0.39998,0.8655,90,90,90 - - 6.50 A 27615
As-Ce-Fe CeFe 4As12 LaFe 4P 12,cI34,204 Im-3 0.8289,0.8289,0.8289,90,90,90 - black 7.36 X 51084
As-Ce-Fe Ce12 Fe57.5 As41 La12 Fe57.5 As41,oP236,59 Pmmn 1.08376,2.56389,1.24701,90,90,90 - black 7.63 X 54307
As-Ce-Ir CeIr2As2 CaBe2Ge2,tP10,129 P4/nmm 0.4289,0.4289,0.9915,90,90,90 - - 12.28 X 58042
As-Ce-Li Li2CeAs2 Ce2SO2,hP5,164 P-3m1 0.4311,0.4311,0.6984,90,90,120 - blackish 4.49 X 12860
As-Ce-Ni CeNiAs YPtAs,hP12,194 P63/mmc 0.4132,0.4132,1.6115,90,90,120 AlB2 family - 7.63 A 39663
As-Ce-Ni CeNi1.91 As1.94 CeNi1.91 As1.94 ,tI160,108 I4cm 1.16318,1.16318,1.92018,90,90,90 - - 8.13 X 41084
As-Ce-Ni CeNi2As2 ht CaBe2Ge2,tP10,129 P4/nmm 0.4222,0.4222,0.9407,90,90,90 - - 8.07 X 21623
As-Ce-Ni CeNi2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.4081,0.4081,0.9893,90,90,90 - - 8.21 X 21623
As-Ce-Ni Ce10 Ni19.5 As15 Ce10 Ni19.5 As15,hP92,176 P63/m 2.1148,2.1148,0.40331,90,90,120 - black 7.80 X 40705
As-Ce-Ni Ce2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9419,0.9419,0.3895,90,90,120 - black 8.37 A 35867
As-Ce-Ni Ce3Ni7As5 Ce3Ni7As5,oP30,59 Pmmn 0.40797,1.2421,0.96436,90,90,90 - gray 8.20 X 41899
As-Ce-Ni Ce6Ni13.39 As9.14 *,oI*,71 Immm 0.4136,0.9641,1.2213,90,90,90 - - - N 35867
As-Ce-Ni Ce6Ni20As13 Zr6Ni20P 13,hP39,174 P-6 1.3183,1.3183,0.397,90,90,120 - - 8.31 A 35867
As-Ce-O Ce[AsO4] Ce[PO4],mP24,14 P121/c1 0.6759,0.7177,0.83919,90,126.487,90 gasparite-(Ce) colorless 5.66 X 39826
As-Ce-Os CeOs4As12 LaFe 4P 12,cI34,204 Im-3 0.8519,0.8519,0.8519,90,90,90 - - 9.67 X 51084
As-Ce-Pd CePdAs hex1 BeZrSi,hP6,194 P63/mmc 0.4369,0.4369,0.7797,90,90,120 AlB2 family - 8.28 X 26089
As-Ce-Pd CePdAs hex2 CaIn2,hP6,194 P63/mmc 0.437,0.437,0.78,90,90,120 AlB2 family - 8.28 X 14266
As-Ce-Pd CePd1.76 As2 CeAl2Ga2,tI10,139 I4/mmm 0.4251,0.4251,1.0261,90,90,90 - - 8.55 X 30566
As-Ce-Pd CePd3As2 GdPd3As2,mS36,12 C12/m1 1.6667,0.4122,0.9994,90,108.05,90 - - 9.30 A 30566
As-Ce-Rh CeRhAs rt TiNiSi,oP12,62 Pnma 0.75351,0.43081,0.73653,90,90,90 AlB2 family - 8.83 X 37437
As-Ce-Rh CeRh2As2 CaBe2Ge2,tP10,129 P4/nmm 0.4283,0.4283,0.985,90,90,90 - - 9.11 A 20220
As-Ce-Ru CeRu4As12 LaFe 4P 12,cI34,204 Im-3 0.85004,0.85004,0.85004,90,90,90 - - 7.81 X 50711
As-Ce-S CeAsS CeAsS,mP12,14 P121/c1 0.39118,1.745,0.5616,90,133.895,90 - - 5.94 X 6570
As-Ce-S Ce3AsS3 Th3P 4,cI28,220 I-43d 0.873,0.873,0.873,90,90,90 - - 5.90 A 5837
As-Ce-Sb CeSb0.9 As0.1 NaCl,cF8,225 Fm-3m 0.63719,0.63719,0.63719,90,90,90 rocksalt family - 6.60 X 11559
As-Ce-Se CeAsSe GdPS,oP24,62 Pnma 0.57969,0.57664,1.78196,90,90,90 - - 6.56 X 52268
As-Ce-Si CeSiAs3 CeSiP3,oP40,33 Pna21 0.5988,2.6231,0.5906,90,90,90 - - 5.63 A 21366
As-Ce-Zn Zn0.67 CeAs2 CuHfSi2,tP8,129 P4/nmm 0.40298,0.40298,1.0222,90,90,90 - - 6.68 A 56883
As-Ce-Zn Zn2CeAs3 Zn2CeAs3,tP14,129 P4/nmm 0.40804,0.40804,1.6089,90,90,90 - - 6.15 X 59687
As-Ce-Zn Zn2Ce 0.67 As2 Ce2SO2,hP5,164 P-3m1 0.41717,0.41717,0.7037,90,90,120 - black 5.86 X 57506
As-Ce-Zn Zn3CeAs3 Zn3PrAs3,hP22,194 P63/mmc 0.41772,0.41772,2.0477,90,90,120 - - 6.02 A 56276
As-Cl-Cs Cs3As2Cl9 Cs3As2Cl9,hP14,150 P321 0.737,0.737,0.891,90,90,120 - - 3.44 X 91
As-Cl-F AsCl2F3 AsCl2F3,tP24,85 P4/n 0.86665,0.86665,0.62378,90,90,90 - - 2.88 X 25512
As-Cl-Hg Hg2 AsCl2 Hg2AsCl2,mS40,12 C12/m1 1.3914,0.821,0.8896,90,97.61,90 - brown 7.21 X 30955
As-Cl-Hg Hg7.5 As4Cl6 Hg7Sb4Br6,cP72,205 Pa-3 1.2189,1.2189,1.2189,90,90,90 - yellow 7.40 X 48299
As-Cl-O AsCl3O AsCl3O,mP20,14 P121/c1 0.8043,0.6131,1.0197,90,111.99,90 - colorless 2.81 X 38166
As-Cl-Sb SbAs2Cl13 SbAs2Cl13,oS64,36 Cmc21 1.002,1.62,1.167,90,90,90 - yellow 2.57 X 6321
As-Cl-Sr SrAs0.5 Cl0.5 NaCl,cF8,225 Fm-3m 0.6264,0.6264,0.6264,90,90,90 rocksalt family violet dark 3.86 X 10307
As-Co-Cr CrCoAs ZrNiAl,hP9,189 P-62m 0.6075,0.6075,0.3657,90,90,120 Fe2P family - 7.92 A 8121
As-Co-Cr Cr0.9 Co0.1As ht NiAs,hP4,194 P63/mmc 0.362,0.362,0.5707,90,90,120 AlB2 family - 6.54 X 8713
As-Co-Cr Cr0.95 Co0.05 As rt FeAs,oP8,62 Pnma 0.5633,0.3454,0.6211,90,90,90 AlB2 family - 7.00 X 8713
As-Co-Cr Cr1.8 Co0.2As Cu2Sb,tP6,129 P4/nmm 0.36,0.36,0.6325,90,90,90 - - 7.31 A 8121
As-Co-Cs CsCo 2As2 Cu2TlSe 2,tI10,139 I4/mmm 0.38265,0.38265,1.48499,90,90,90 - - 6.12 A 26787
As-Co-Dy DyCo 5As3 YCo 5P 3,oP36,62 Pnma 1.2233,0.3783,1.072,90,90,90 - - 9.13 A 59411
As-Co-Dy Dy2 Co12As7 Zr2Fe12P 7,hP21,174 P-6 0.93867,0.93867,0.37365,90,90,120 - - 9.07 A 55416
As-Co-Er ErCo 5As3 YCo 5P 3,oP36,62 Pnma 1.2202,0.3768,1.0692,90,90,90 - - 9.28 A 59411
As-Co-Er Er2Co12As7 Zr2Fe12P 7,hP21,174 P-6 0.93796,0.93796,0.37199,90,90,120 - - 9.18 A 55416
As-Co-Eu EuCo 2As2 CeAl2Ga2,tI10,139 I4/mmm 0.3934,0.3934,1.1511,90,90,90 - - 7.82 A 27615
As-Co-F CoAs4F18 FeAs4F18,mP46,14 P121/c1 0.7259,1.2929,1.01297,90,134.111,90 - pink 3.41 X 35506
As-Co-Fe FeCoAs ZrNiAl,hP9,189 P-62m 0.60805,0.60805,0.35789,90,90,120 Fe2P family - 8.25 X 26254
248 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Co-Fe Fe0.1 Co0.9 As ht NiAs,hP4,194 P63 /mmc 0.359,0.359,0.524,90,90,120 AlB2 family - 7.58 X 8713
As-Co-Fe Fe0.2 Co0.8 As3 CoAs3,cI32,204 Im-3 0.8208,0.8208,0.8208,90,90,90 skutterudite - 6.80 A 764
As-Co-Fe Fe0.6 Co0.4 As2 FeAs2,oP6,58 Pnnm 0.5248,0.5949,0.2925,90,90,90 safflorite - 7.53 A 6544
As-Co-Fe Fe0.95 Co0.05 As FeAs,oP8,62 Pnma 0.5416,0.3379,0.6011,90,90,90 AlB2 family - 7.91 X 8713
As-Co-Fe Fe1.2 Co1.8 As5 *,cI*,204 Im-3 0.82064,0.82064,0.82064,90,90,90 - - - N 6544
As-Co-Fe Fe1.6 Co0.4 As Cu2Sb,tP6,129 P4/nmm 0.36325,0.36325,0.59359,90,90,90 - - 7.97 X 30450
As-Co-Ga CoGa0.1 As0.9 rt FeAs,oP8,62 Pnma 0.526,0.348,0.587,90,90,90 AlB2 family - 8.24 A 23071
As-Co-Ga Co0.05 Ga0.95 As ZnS,cF8,216 F-43m 0.565,0.565,0.565,90,90,90 adamantane structure - 5.31 X 23071
As-Co-Ga Co0.908 Ga0.087 As0.005 rt Mg,hP2,194 P63 /mmc 0.252,0.252,0.411,90,90,120 close-packed structure - 8.81 X 23071
As-Co-Ga Co0.96 Ga1.02 As0.02 CsCl,cP2,221 Pm-3m 0.2874,0.2874,0.2874,90,90,90 b.c.c. family - 9.04 X 23071
As-Co-Ga Co1.95 Ga0.1 As0.95 *,o**,* - 0.358,0.598,1.038,90,90,90 - - - N 23071
As-Co-Ga Co2Ga0.5 As0.5 Co1.75 Ge,hP6,194 P63 /mmc 0.3968,0.3968,0.5021,90,90,120 AlB2 family - 9.23 X 19025
As-Co-Gd GdCo5As3 YCo5P 3,oP36,62 Pnma 1.2281,0.379,1.0722,90,90,90 - - 9.01 A 59411
As-Co-Gd Gd2Co12As7 Zr2Fe12P 7,hP21,174 P-6 0.94041,0.94041,0.37562,90,90,120 - - 8.92 A 55416
As-Co-Ge CoGe0.4 As0.6 FeAs,oP8,62 Pnma 0.526,0.345,0.59,90,90,90 AlB2 family - 8.25 A 34214
As-Co-Hf HfCoAs HoNiGa,oP12,62 Pnma 0.6433,0.3802,0.7249,90,90,90 AlB2 family - 11.70 X 35202
As-Co-Hf Hf5CoAs3 Hf5CoP3,oP36,62 Pnma 1.7327,0.3685,1.037,90,90,90 - - 11.80 X 34436
As-Co-Ho HoCo5As3 YCo5P 3,oP36,62 Pnma 1.2219,0.3775,1.0709,90,90,90 - - 9.20 A 59411
As-Co-Ho Ho2Co12As7 Zr2Fe12P 7,hP21,174 P-6 0.93805,0.93805,0.37317,90,90,120 - - 9.12 A 55416
As-Co-K KCo2As2 Cu2TlSe2,tI10,139 I4/mmm 0.3794,0.3794,1.357,90,90,90 - - 5.22 A 14799
As-Co-La LaCo2As2 CeAl2Ga2,tI10,139 I4/mmm 0.40536,0.40536,1.0324,90,90,90 - - 7.96 A 55906
As-Co-Li Li1.1 CoAs Li1.15 MnAs,tP8,129 P4/nmm 0.3753,0.3753,0.617,90,90,90 - black gray 5.41 X 4301
As-Co-Mg Mg2Co12As7 Mg2Co12As7,oP84,62 Pnma 1.2096,0.367,2.493,90,90,90 - gray 7.68 X 39440
As-Co-Mn MnCoAs TiNiSi,oP12,62 Pnma 0.6212,0.3722,0.7007,90,90,90 AlB2 family - 7.74 A 8460
As-Co-Mn Mn0.3 Co0.7 As ht NiAs,hP4,194 P63 /mmc 0.3582,0.3582,0.5301,90,90,120 AlB2 family - 7.48 X 9512
As-Co-Mn Mn0.3 Co0.7 As rt FeAs,oP8,62 Pnma 0.5309,0.347,0.5941,90,90,90 AlB2 family - 8.05 A 9512
As-Co-Mn Mn0.4 Co1.6 As Fe2P,hP9,189 P-62m 0.608,0.608,0.3573,90,90,120 Fe2P family - 8.33 A 8460
As-Co-Mn Mn0.90Co0.10 As rt NiAs,hP4,194 P63 /mmc 0.36764,0.36764,0.56702,90,90,120 AlB2 family - 6.52 X 9512
As-Co-Mn Mn0.95 Co0.05 As lt FeAs,oP8,62 Pnma 0.56875,0.36541,0.63494,90,90,90 AlB2 family - 6.55 X 9512
As-Co-Mn Mn1.25 Co0.75 As Fe2P,hP9,189 P-62m 0.6229,0.6229,0.367,90,90,120 Fe2P family - 7.59 A 8460
As-Co-Mn Mn1.6 Co0.4 As Cu2Sb,tP6,129 P4/nmm 0.3772,0.3772,0.6146,90,90,90 - - 7.08 A 8460
As-Co-Mo Mo0.35 Co1.65 As Fe2P,hP9,189 P-62m 0.6025,0.6025,0.3648,90,90,120 Fe2P family - 8.94 A 10865
As-Co-Mo Mo0.8Co1.2 As TiNiSi,oP12,62 Pnma 0.587,0.3764,0.6986,90,90,90 AlB2 family - 9.57 A 10865
As-Co-Nb NbCoAs TiNiSi,oP12,62 Pnma 0.6247,0.3724,0.7136,90,90,90 AlB2 family - 9.07 A 3421
As-Co-Nd NdCo2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4006,0.4006,1.0078,90,90,90 - - 8.46 A 11706
As-Co-Ni CoNiAs ht Fe2P,hP9,189 P-62m 0.6079,0.6079,0.3468,90,90,120 Fe2P family - 8.64 A 15560
As-Co-Ni Co0.4 Ni0.6 As NiAs,hP4,194 P63 /mmc 0.356,0.356,0.507,90,90,120 AlB2 family - 7.98 X 6544
As-Co-Ni Co0.4 Ni0.6 As2 FeS2,oP6,58 Pnnm 0.4871,0.5831,0.3435,90,90,90 pyrite-marcasite family - 7.10 A 6544
As-Co-Ni Co0.75 Ni0.25 As3 CoAs3,cI32,204 Im-3 0.8238,0.8238,0.8238,90,90,90 - - 6.74 A 764
As-Co-Ni Co0.9 Ni0.1 As rt FeAs,oP8,62 Pnma 0.527,0.351,0.591,90,90,90 AlB2 family - 8.13 X 16797
As-Co-O CoAs2O6 PbSb2O6,hP9,162 P-31m 0.47768,0.47768,0.44968,90,90,120 - - 5.70 X 30667
As-Co-O Co[AsO4] (Mn0.35 Fe0.65 )[PO4],oP24,62 Pnma 1.0416,0.59366,0.4883,90,90,90 - - 4.35 A 46834
As-Co-O Co1.75 As0.9 O4 Mg2[SiO4],oP28,62 Pnma 1.0526,0.5985,0.4871,90,90,90 - purple dark 5.08 X 8147
As-Co-O Co2As2O5 Co2As2O5 ,aP36,2 P-1 0.623,0.9169,0.9259,66.85,82.18,79.28 - blue 4.85 X 51526
As-Co-O Co2[As2O7] ht Sc2[Si2O7],mS22,12 C12/m1 0.66316,0.85541,0.47633,90,103.56,90 - purple dark 4.80 X 23731
As-Co-O Co2[As2O7] rt Co2[As2O7],aP55,2 P-1 0.53332,0.76789,1.60427,82.916,88.473,85.229 - purple 4.85 X 53853
As-Co-O Co3[AsO4 ]2 ht Cu3[AsO4 ]2,mP52,14 P121/c1 0.64574,0.85096,1.11867,90,90.73,90 - red 4.91 X 17626
As-Co-O Co3[AsO4 ]2 rt Co3[AsO4 ]2,mP52,14 P121/c1 0.583,0.9675,1.034,90,93.42,90 - - 5.19 X 5192
As-Co-O Co4.5 [AsO4]3 Mg4.5 [AsO4]3,tI80,122 I-42d 0.6858,0.6858,1.8872,90,90,90 - - 5.10 X 13447
As-Co-O Co7As2O12 Co7As2O12 ,oI84,74 Imma 0.5832,1.8041,0.8441,90,90,90 - blue green 5.64 X 33860
As-Co-O Co8As3O16 Co8As3O16 ,hR84,166 R-3m 0.6046,0.6046,2.8062,90,90,120 - purple dark 5.34 X 5188
As-Co-P Co1.95 As0.1 P0.9 Co2P,oP12,62 Pnma 0.5665,0.352,0.6626,90,90,90 - - 7.56 A 8450
As-Co-P Co1.95 As0.5 P0.5 Fe2P,hP9,189 P-62m 0.5924,0.5924,0.3436,90,90,120 Fe2P family - 8.01 A 8450
As-Co-Pd CoPdAs Cu2Sb,tP6,129 P4/nmm 0.3692,0.3692,0.61,90,90,90 - - 9.60 A 15560
As-Co-Pr PrCo 2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4017,0.4017,1.0169,90,90,90 - - 8.27 A 11706
As-Co-Rb RbCo2As2 CeAl2Ga2,tI10,139 I4/mmm 0.3833,0.3833,1.4269,90,90,90 - - 5.60 A 17714
As-Co-Re Re5Co2As12 Re5Ni2As12 ,oP38,58 Pnnm 1.2613,1.5593,0.3251,90,90,90 - - 10.12 A 16328
As-Co-Rh CoRhAs TiNiSi,oP12,62 Pnma 0.5918,0.3746,0.7029,90,90,90 AlB2 family - 10.09 A 9234
As-Co-Rh Co3Rh9As7 V12P 7,hP26,176 P63 /m 0.91847,0.91847,0.35602,90,90,120 - - 10.39 A 34128
As-Co-S CoAsS ht FeS2,cP12,205 Pa-3 0.5582,0.5582,0.5582,90,90,90 pyrite-marcasite family - 6.34 X 2529
As-Co-S CoAsS rt CoAsS,oP12,29 Pca21 0.55833,0.55812,0.55892,90,90,90 cobaltite O - 6.33 X 23281
As-Co-Sb CoSb0.05 As0.95 rt FeAs,oP8,62 Pnma 0.529,0.35,0.591,90,90,90 AlB2 family - 8.27 X 16797
As-Co-Sb CoSb0.6 As0.4 NiAs,hP4,194 P63 /mmc 0.374,0.374,0.519,90,90,120 AlB2 family - 8.56 X 16797
As-Co-Se CoAsSe ht FeS2,oP6,58 Pnnm 0.47562,0.57514,0.35628,90,90,90 pyrite-marcasite family - 7.25 X 12050
As-Co-Se CoAsSe rt CoSbS,oP24,61 Pbca 0.57285,0.57741,1.13653,90,90,90 pyrite-marcasite family - 7.52 X 12050
As-Co-Se CoAs0.45 Se 1.55 FeS2,cP12,205 Pa-3 0.5758,0.5758,0.5758,90,90,90 pyrite-marcasite family - 7.48 A 6345
As-Co-Sn Co1.5 Sn0.25 As0.25 CsCl,cP2,221 Pm-3m 0.2925,0.2925,0.2925,90,90,90 b.c.c. family - 9.08 X 20600
As-Co-Sr SrCo 2As2 Cu2TlSe2,tI10,139 I4/mmm 0.3935,0.3935,1.183,90,90,90 - gray steel 6.44 A 13894
As-Co-Ta TaCoAs TiNiSi,oP12,62 Pnma 0.6211,0.3706,0.7116,90,90,90 AlB2 family - 12.77 A 3421
As-Co-Tb TbCo5As3 YCo5P 3,oP36,62 Pnma 1.2239,0.3787,1.0727,90,90,90 - - 9.06 A 59411
As-Co-Tb Tb2Co12As7 Zr2Fe12P 7,hP21,174 P-6 0.93947,0.93947,0.3745,90,90,120 - - 8.99 A 55416
As-Co-Th ThCo2As2 CaBe2Ge2 ,tP10,129 P4/nmm 0.41824,0.41824,0.9354,90,90,90 - - 10.14 A 18628
As-Co-Th Th2Co12As7 Zr2Fe12P 7,hP21,174 P-6 0.943,0.943,0.3835,90,90,120 - - 9.53 A 54112
As-Co-Ti TiCoAs TiNiSi,oP12,62 Pnma 0.6221,0.3696,0.7084,90,90,90 AlB2 family - 7.41 A 3421
As-Co-U UCoAs2 CuHfSi2,tP8,129 P4/nmm 0.39615,0.39615,0.9149,90,90,90 - - 10.34 X 37333
As-Co-U U2Co12As7 Zr2Fe12P 7,hP21,174 P-6 0.9374,0.9374,0.3776,90,90,120 - - 9.87 A 54112
As-Co-V VCoAs TiNiSi,oP12,62 Pnma 0.6029,0.3678,0.6954,90,90,90 AlB2 family - 7.96 A 7673
As-Co-Y YCo5As3 YCo5P 3,oP36,62 Pnma 1.22358,0.37856,1.0725,90,90,90 - - 8.13 X 59411
Handbook of Inorganic Substances – Edition 2015 : Data 249

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Co-Y Y2Co 12As7 Zr2Fe12P 7,hP21,174 P-6 0.93887,0.93887,0.37385,90,90,120 - - 8.20 X 55416


As-Co-Zr ZrCoAs HoNiGa,oP12,62 Pnma 0.6377,0.3831,0.7306,90,90,90 AlB2 family - 8.38 A 35202
As-Co-Zr Zr6CoAs2 K2UF6,hP9,189 P-62m 0.7461,0.7461,0.3634,90,90,120 Fe2P family - 7.17 X 33148
As-Cr-Fe CrFeAs ZrNiAl,hP9,189 P-62m 0.6095,0.6095,0.3658,90,90,120 Fe2P family - 7.74 A 2995
As-Cr-Fe Cr0.36 Fe1.64 As Cu2Sb,tP6,129 P4/nmm 0.3632,0.3632,0.6012,90,90,90 - - 7.76 A 2995
As-Cr-Fe Cr0.79 Fe0.21 As2 FeAs2,oP6,58 Pnnm 0.54174,0.62433,0.29803,90,90,90 pyrite-marcasite family - 6.68 X 12048
As-Cr-Fe Cr0.95 Fe0.05 As FeAs,oP8,62 Pnma 0.56403,0.3435,0.62095,90,90,90 AlB2 family - 7.02 X 12054
As-Cr-Fe Cr1.76 Fe0.24 As rt Cu2Sb,tP6,129 P4/nmm 0.3606,0.3606,0.6302,90,90,90 - - 7.29 A 2995
As-Cr-Ge Cr10 Ge15.9 As1.1 Rh10 Ga17,tP108,116 P-4c2 0.5784,0.5784,4.733,90,90,90 chimney-ladder structure - 7.37 A 3662
As-Cr-Mn Cr0.25 Mn0.75 As rt FeAs,oP8,62 Pnma 0.56646,0.35865,0.62643,90,90,90 AlB2 family - 6.74 X 16782
As-Cr-Mn Cr0.37 Mn0.63 As ht NiAs,hP4,194 P63/mmc 0.368,0.368,0.577,90,90,120 AlB2 family - 6.32 X 21529
As-Cr-Mn Cr1.3Mn0.7 As Cu2Sb,tP6,129 P4/nmm 0.375,0.375,0.63,90,90,90 - - 6.78 X 11746
As-Cr-Mo Cr1.6Mo0.4 As Fe2P,hP9,189 P-62m 0.6348,0.6348,0.3466,90,90,120 Fe2P family - 8.09 A 10865
As-Cr-N Cr3AsN Cr3AsN,tI20,140 I4/mcm 0.536,0.536,0.8066,90,90,90 - - 7.02 X 4180
As-Cr-Ni CrNiAs ZrNiAl,hP9,189 P-62m 0.61128,0.61128,0.36585,90,90,120 Fe2P family - 7.81 X 50737
As-Cr-Ni Cr0.2 Ni0.8 As NiAs,hP4,194 P63/mmc 0.36,0.36,0.516,90,90,120 AlB2 family - 7.59 X 11160
As-Cr-Ni Cr0.98 Ni0.02 As FeAs,oP8,62 Pnma 0.56371,0.34513,0.61999,90,90,90 AlB2 family - 7.00 X 11160
As-Cr-Ni Cr1.8 Ni0.2 As Cu2Sb,tP6,129 P4/nmm 0.36,0.36,0.6335,90,90,90 - - 7.29 A 8121
As-Cr-O Cr[AsO4] m Cr[PO4],oI72,74 Imma 1.05466,1.32424,0.64612,90,90,90 - green 4.22 X 22256
As-Cr-O Cr[AsO4] rt Cu[SO4],oP24,62 Pnma 0.8955,0.6237,0.4755,90,90,90 - black 4.78 X 20045
As-Cr-O Cr0.67 As1.33 O4 *,hP108,180 P6222 1.445,1.445,0.7604,90,90,120 - brown - N 8062
As-Cr-O Cr0.9 As0.1O2 TiO2 ,tP6,136 P42/mnm 0.44159,0.44159,0.2915,90,90,90 - - 5.04 A 6143
As-Cr-P CrAs0.9P 0.1 ht NiAs,hP4,194 P63/mmc 0.361,0.361,0.5801,90,90,120 AlB2 family - 6.22 X 8709
As-Cr-P CrAs0.9P 0.1 rt FeAs,oP8,62 Pnma 0.5628,0.3398,0.62,90,90,90 AlB2 family - 6.86 X 8709
As-Cr-Pd CrPdAs ZrNiAl,hP9,189 P-62m 0.6495,0.6495,0.3683,90,90,120 Fe2P family - 8.64 A 24777
As-Cr-Rh CrRhAs ZrNiAl,hP9,189 P-62m 0.63985,0.63985,0.37265,90,90,120 Fe2P family - 8.67 A 30457
As-Cr-Ru CrRuAs orth1 TiNiSi,oP12,62 Pnma 0.71,0.6541,1.1063,90,90,90 AlB2 family - 2.95 A 24777
As-Cr-S CrAs0.84 S0.16 FeAs,oP8,62 Pnma 0.5692,0.355,0.614,90,90,90 AlB2 family - 6.43 A 30425
As-Cr-Sb CrSb0.28 As0.72 rt FeAs,oP8,62 Pnma 0.5735,0.3659,0.6355,90,90,90 AlB2 family - 6.97 X 8338
As-Cr-Sb CrSb0.5 As0.5 ht NiAs,hP4,194 P63/mmc 0.381,0.381,0.5718,90,90,120 AlB2 family - 6.95 X 7785
As-Cr-Se CrAsSe 3 ht *,oP*,* - 0.4574,0.8844,1.5262,90,90,90 - - - N 36494
As-Cr-Se CrAs0.2 Se0.8 ht2 NiAs,hP4,194 P63/mmc 0.36618,0.36618,0.59882,90,90,120 AlB2 family - 6.22 X 5731
As-Cr-Se CrAs0.8 Se0.2 FeAs,oP8,62 Pnma 0.57822,0.35453,0.62369,90,90,90 AlB2 family - 6.64 A 5731
As-Cr-Si Cr3Si0.43 As0.43 Cr3Si,cP8,223 Pm-3n 0.4587,0.4587,0.4587,90,90,90 Frank-Kasper phase - 6.89 X 3662
As-Cr-Sr SrCr2As2 Cu2TlSe 2,tI10,139 I4/mmm 0.3918,0.3918,1.305,90,90,90 - gray steel 5.66 A 13894
As-Cr-Ti TiCrAs ZrNiAl,hP9,189 P-62m 0.6504,0.6504,0.3477,90,90,120 Fe2P family - 6.84 A 7673
As-Cr-Ti Ti0.05 Cr0.95 As FeAs,oP8,62 Pnma 0.56732,0.34715,0.6219,90,90,90 AlB2 family - 6.87 X 18265
As-Cr-Ti Ti0.3 Cr0.7 As ht NiAs,hP4,194 P63/mmc 0.362,0.362,0.588,90,90,120 AlB2 family - 6.26 X 18265
As-Cr-V V0.10 Cr0.90 As ht NiAs,hP4,194 P63/mmc 0.3631,0.3631,0.5834,90,90,120 AlB2 family - 6.32 X 8702
As-Cr-V V0.10 Cr0.90 As rt FeAs,oP8,62 Pnma 0.5652,0.3411,0.6208,90,90,90 AlB2 family - 7.04 X 8702
As-Cs-F CsAsF4 CsAsF4,mP12,4 P1211 0.6597,0.4872,0.84922,90,111.92,90 - - 3.72 X 42760
As-Cs-F CsAsF6 ht CsPF6,cF152,225 Fm-3m 0.8384,0.8384,0.8384,90,90,90 - - 3.63 A 35383
As-Cs-F CsAsF6 rt KAsF6,hR24,148 R-3 0.7723,0.7723,0.805,90,90,120 - colorless 3.86 X 35383
As-Cs-F CsAs4F13 KSb4F13,tI36,82 I-4 0.9568,0.9568,0.6726,90,90,90 - - 3.67 X 41430
As-Cs-Fe CsFe 2As2 Cu2TlSe 2,tI10,139 I4/mmm 0.38943,0.38943,1.50997,90,90,90 - - 5.72 X 29530
As-Cs-Ga Cs3GaAs2 Cs3AlAs2,mP48,14 P121/c1 1.1371,0.8857,1.946,90,99.225,90 - black 4.25 X 24272
As-Cs-Ge Cs5GeAs3 Cs5SiP 3,oP36,62 Pnma 1.4615,0.6045,1.5964,90,90,90 - red garnet 4.53 X 23245
As-Cs-In Cs10 In6As8 K10In5Sb9,mP96,14 P121/c1 1.7037,1.2253,1.8105,90,117.24,90 - black 5.17 X 38707
As-Cs-In Cs6InAs3 Cs6AlSb3,mP20,11 P121/m1 1.0469,0.6356,1.2208,90,101.3,90 - gray steel 4.74 X 25595
As-Cs-Ir CsIr2As2 Cu2TlSe 2,tI10,139 I4/mmm 0.4011,0.4011,1.4473,90,90,90 - - 9.52 A 26787
As-Cs-Mn CsMnAs PbClF,tP6,129 P4/nmm 0.44632,0.44632,0.86941,90,90,90 - gray 5.04 X 24755
As-Cs-Na Cs2NaAs7 Cs2NaAs7,mP40,14 P121/c1 1.17671,1.08528,1.02115,90,90.213,90 - red dark 4.14 X 56031
As-Cs-Nb Cs6NbAs5 K6NbAs5,mP114,14 P121/c1 2.7405,0.99447,1.39964,90,101.21,90 - gray dark 4.49 X 40041
As-Cs-Nb Cs9Nb2As6 Cs9Nb2As6,oP136,61 Pbca 1.694,1.8183,1.75848,90,90,90 - black 4.49 X 40071
As-Cs-Ni Cs2NiAs2 K2PdAs2,oS20,63 Cmcm 0.69,1.4161,0.5974,90,90,90 - brass 5.40 A 26787
As-Cs-O CsAsO3 mon *,mP*,* - 1.298,1.252,1.463,90,103.2,90 - - - N 11855
As-Cs-O CsAs3O8 CsAs3O8,mS48,15 C12/c1 0.8515,1.169,0.7595,90,112.7,90 - white 4.63 X 48069
As-Cs-O Cs3As5O9 Cs3As5O9,hP17,157 P31m 0.8455,0.8455,0.6026,90,90,120 - colorless 4.08 X 42509
As-Cs-O Cs3[AsO4] K3[NO4],oP32,62 Pnma 1.2543,0.9029,0.6585,90,90,90 - colorless 4.79 X 41100
As-Cs-O Cs4[As2O7] mon *,mP52,* - 1.1945,0.595,1.5605,90,105.9,90 - - 4.94 N 12710
As-Cs-Pd Cs2PdAs2 K2PdAs2,oS20,63 Cmcm 0.7068,1.4766,0.6366,90,90,90 - golden 5.22 X 24169
As-Cs-Pt Cs2PtAs2 K2PdAs2,oS20,63 Cmcm 0.6999,1.4632,0.6511,90,90,90 - gray silver 6.08 A 26787
As-Cs-Rh CsRh2As2 CeAl2Ga2,tI10,139 I4/mmm 0.3993,0.3993,1.4668,90,90,90 - - 6.94 A 24169
As-Cs-Ru CsRu2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4008,0.4008,1.4802,90,90,90 - - 6.77 A 24169
As-Cs-S Cs2As8S13 Cs2As8S13,oP184,60 Pbcn 1.7738,1.195,2.3367,90,90,90 - red light 3.44 X 18731
As-Cs-Se CsAsSe 2 mon CsAsSe 2,mP32,14 P121/c1 0.71572,1.4862,1.12529,90,114.692,90 - red 4.47 X 46023
As-Cs-Se CsAsSe 2 orth CsAsSe 2,oP32,61 Pbca 0.6755,0.9689,1.6645,90,90,90 - red 4.46 X 21939
As-Cs-Se CsAs2Se3 CsAs2Se3,oP48,62 Pnma 1.4826,0.7462,1.3474,90,90,90 - black 4.63 X 47584
As-Cs-Se Cs3AsSe 4 [NH4]3AsS4,oP32,62 Pnma 1.0114,1.1983,1.0123,90,90,90 - red 4.27 X 32666
As-Cs-Se Cs5As5Se9 Cs5As5Se9,oP76,62 Pnma 0.7954,2.7031,1.2276,90,90,90 - red 4.40 X 55610
As-Cs-Si Cs2SiAs2 K2ZnO2,oI20,72 Ibam 0.7571,1.4425,0.642,90,90,90 - - 4.20 X 24899
As-Cs-Si Cs5SiAs3 Cs5SiP 3,oP36,62 Pnma 1.4467,0.6043,1.582,90,90,90 - red garnet 4.41 X 23245
As-Cs-Sn Cs2SnAs2 K2ZnO2,oI20,72 Ibam 0.7733,1.4657,0.6953,90,90,90 - - 4.50 X 24899
As-Cs-Te Cs2AsTe 3 Cs2AsTe 3,mP24,14 P121/c1 1.0742,0.9494,1.1299,90,118.23,90 - black gray 4.73 X 32631
As-Cs-Zn CsZn4As3 KCu4S3,tP8,123 P4/mmm 0.41789,0.41789,1.0571,90,90,90 - black 5.57 X 56388
As-Cs-Zn Cs4ZnAs14 Cs4ZnAs14,mP304,14 P121/c1 2.9067,1.04714,4.3039,90,128.092,90 - red dark 4.24 X 56031
As-Cs-Zn Cs4Zn9As14 K4(Zn0.39 As0.61 )23,cP70,223 Pm-3n 1.07731,1.07731,1.07731,90,90,90 clathrate black 5.76 X 57941
As-Cu-Dy CuDyAs2 CuHfSi2,tP8,129 P4/nmm 0.3884,0.3884,0.9847,90,90,90 - - 8.40 X 41052
250 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Cu-Er CuErAs2 CuHfSi2,tP8,129 P4/nmm 0.3865,0.3865,0.9802,90,90,90 - gray 8.63 X 41052


As-Cu-Eu CuEuAs BeZrSi,hP6,194 P63 /mmc 0.4254,0.4254,0.8274,90,90,120 AlB2 family blue gray 7.44 X 12038
As-Cu-Eu Cu1.75 EuAs2 CeAl2Ga2,tI10,139 I4/mmm 0.4215,0.4215,1.0185,90,90,90 - gray 7.58 X 31048
As-Cu-Eu Cu4EuAs2 CaCu4P 2,hR21,166 R-3m 0.4183,0.4183,2.3154,90,90,120 - gray steel 7.89 X 36662
As-Cu-F CuAsF7 CuAsF7,oI36,74 Imma 0.6941,1.0732,0.6814,90,90,90 - colorless 3.55 X 42774
As-Cu-Gd CuGdAs2 mon CuGdAs2,mP8,11 P121/m1 0.39041,0.3902,0.9908,90,90.05,90 - black 8.16 X 51872
As-Cu-Gd CuGdAs2 tet CuHfSi2,tP8,129 P4/nmm 0.3917,0.3917,0.9939,90,90,90 - - 8.07 X 37734
As-Cu-Ho CuHoAs2 CuHfSi2,tP8,129 P4/nmm 0.3874,0.3874,0.9827,90,90,90 - gray silver 8.52 X 39491
As-Cu-K KCu4As2 hex *,hP84,194 P63 /mmc 0.7185,0.7185,2.458,90,90,120 - - - N 19675
As-Cu-K KCu4As2 rhom CaCu4P 2,hR21,166 R-3m 0.412,0.412,2.5956,90,90,120 - blue 5.79 X 19675
As-Cu-K K2CuAs Na2CuAs,oS16,63 Cmcm 1.002,0.756,0.589,90,90,90 - - 3.23 X 10294
As-Cu-K K3Cu3As2 K3Cu3P2,hR24,166 R-3m 0.576,0.576,2.026,90,90,120 - - 3.92 X 12851
As-Cu-K K5CuAs2 K5CuAs2,hP16,194 P63 /mmc 0.5737,0.5737,1.8771,90,90,120 - black 2.54 X 26036
As-Cu-La CuLaAs2 CuHfSi2,tP8,129 P4/nmm 0.4048,0.4048,1.027,90,90,90 - - 6.95 A 30559
As-Cu-La Cu1.25 LaAs2 BaPd2As2,tI20,139 I4/mmm 0.4096,0.4096,2.0224,90,90,90 - gray silver 7.21 X 40196
As-Cu-Li LiCu0.93 As LiCu0.93 As,hP9,156 P3m1 0.4125,0.4125,0.9025,90,90,120 - - 5.28 X 11045
As-Cu-Li LiCu2As ht *,hP*,* - 0.421,0.421,1.384,90,90,120 - - - N 4909
As-Cu-Li Li0.78 Cu1.3 As0.92 *,hP24,194 P63 /mmc 0.4136,0.4136,2.5324,90,90,120 - - - N 4909
As-Cu-Li Li1.33 Cu0.74 As0.93 *,hP24,194 P63 /mmc 0.4168,0.4168,2.5911,90,90,120 - - - N 4909
As-Cu-Li Li2CuAs Li2CuAs,hP8,194 P63 /mmc 0.4185,0.4185,0.7923,90,90,120 - gray 4.21 X 4909
As-Cu-Li Li2Cu6.6 As3 ht *,hP*,* - 0.725,0.725,4.278,90,90,120 - - - N 4909
As-Cu-Lu CuLuAs2 CuHfSi2,tP8,129 P4/nmm 0.38342,0.38342,0.9742,90,90,90 - - 9.01 A 30559
As-Cu-Mg MgCuAs MgCuAs,oP24,62 Pnma 1.346,0.3954,0.73958,90,90,90 - gray silver 5.49 X 40832
As-Cu-Mn CuMnAs TiNiSi,oP12,62 Pnma 0.65773,0.3854,0.73096,90,90,90 AlB2 family gray 6.93 X 26979
As-Cu-Mn Cu0.15 Mn1.85 As Cu2Sb,tP6,129 P4/nmm 0.3788,0.3788,0.6284,90,90,90 - - 6.85 A 31661
As-Cu-Na NaCu4As2 hex *,hP84,194 P63 /mmc 0.7148,0.7148,2.3193,90,90,120 - - - N 19675
As-Cu-Na NaCu4As2 rhom CaCu4P 2,hR21,166 R-3m 0.41,0.41,2.3893,90,90,120 - blue 6.12 X 19675
As-Cu-Na Na2CuAs Na2CuAs,oS16,63 Cmcm 0.886,0.722,0.534,90,90,90 - red copper 3.59 X 10294
As-Cu-Nd CuNdAs2 CuHfSi2,tP8,129 P4/nmm 0.3967,0.3967,1.0055,90,90,90 - - 7.51 A 30559
As-Cu-Nd Cu1.06 NdAs2 Cu1.5 CeIn1.5 ,tP10,129 P4/nmm 0.3979,0.3979,1.0016,90,90,90 - gray silver 7.57 X 40196
As-Cu-O CuAs2O4 ZnSb2O4,tP28,135 P42 /mbc 0.8592,0.8592,0.5573,90,90,90 trippkeite - 4.48 X 9392
As-Cu-O Cu2[As2O7] ht Sc2[Si2O7],mS22,12 C12/m1 0.70987,0.82777,0.48666,90,110.206,90 - green dark 4.81 X 42777
As-Cu-O Cu2[As2O7] rt Cu2[P 2O7],mS44,15 C12/c1 0.7237,0.82557,0.978,90,111.03,90 - green olive 4.74 X 42777
As-Cu-O Cu3[AsO4 ]2 mon1 Cu3[AsO4 ]2,mP26,14 P121/c1 0.5394,1.1611,0.5079,90,111.72,90 lammerite - 5.27 X 18863
As-Cu-O Cu3[AsO4 ]2 mon2 Cu3[AsO4 ]2,mP52,14 P121/c1 0.6306,0.8643,1.131,90,92.26,90 lammerite-β green 5.05 X 58149
As-Cu-O Cu3[AsO4 ]2 tricl Cu3[PO4]2 ,aP13,2 P-1 0.5046,0.5417,0.6354,70.61,86.52,68.43 - green 5.12 X 21607
As-Cu-O Cu4[AsO4 ]2O orth Cu4[AsO4 ]2O,oP60,62 Pnma 0.8253,0.64122,1.3789,90,90,90 kozyrevskite green 4.99 X 30098
As-Cu-O Cu4[AsO4 ]2O tricl Cu4[PO4]2 O,aP30,2 P-1 0.64148,0.76549,0.82241,98.52,112.39,98.38 - green 5.05 X 32634
As-Cu-Pr CuPrAs2 CuHfSi2,tP8,129 P4/nmm 0.39942,0.39942,1.0068,90,90,90 - - 7.33 A 30559
As-Cu-Pr Cu1.09PrAs2 Cu1.5 CeIn1.5 ,tP10,129 P4/nmm 0.40086,0.40086,1.00496,90,90,90 - gray silver 7.40 X 36265
As-Cu-S CuAsS CuAsS,oP12,62 Pnma 1.1347,0.37533,0.5453,90,90,90 lautite gray steel 4.88 X 49855
As-Cu-S Cu12As4S13 Cu6(Cu0.083 Fe0.917)6As4S13,cI58,217 I-43m 1.019,1.019,1.019,90,90,90 tennantite - 4.64 X 83
As-Cu-S Cu3AsS3 rt *,hR*,* - 1.44239,1.44239,1.75132,90,90,120 - - - N 17515
As-Cu-S Cu3AsS4 ena Cu3AsS4,oP16,31 Pmn21 0.74127,0.64404,0.61577,90,90,90 enargite black 4.45 X 40660
As-Cu-S Cu3AsS4 luz Cu3SbS4,tI16,121 I-42m 0.5332,0.5332,1.057,90,90,90 luzonite - 4.35 A 5908
As-Cu-S Cu4As2S5 *,mS*,12 C12/m1 1.035,1.465,3.334,90,96.,90 - - - N 22426
As-Cu-S Cu6As4S9 Cu6As4S9,aP38,1 P1 0.9064,0.9078,0.983,90.,107.8,109.5 sinnerite - 4.46 X 8885
As-Cu-Se CuAsSe CuAsSe,oP72,60 Pbcn 1.175,0.679,1.921,90,90,90 - - 5.65 X 14415
As-Cu-Se CuAsSe2 mon *,mP*,* - 0.5117,1.2293,0.9464,90,98.546,90 - - - N 17275
As-Cu-Se CuAsSe2 tf CuAsSe2,hR12,160 R3m 0.405,0.405,1.972,90,90,120 - - 5.27 X 4256
As-Cu-Se Cu0.5 As0.5 Se ht ZnS,cF8,216 F-43m 0.575,0.575,0.575,90,90,90 adamantane structure - 5.18 X 4256
As-Cu-Se Cu0.75 As0.25 Se ht ZnS,cF8,216 F-43m 0.5502,0.5502,0.5502,90,90,90 adamantane structure - 5.80 X 17994
As-Cu-Se Cu3AsSe3 ht *,cP7,221 Pm-3m 0.5758,0.5758,0.5758,90,90,90 - - 4.37 N 20110
As-Cu-Se Cu3AsSe4 rt Cu3SbS4,tI16,121 I-42m 0.553,0.553,1.083,90,90,90 adamantane structure - 5.83 A 17994
As-Cu-Se Cu7As6Se 13 Cu7As6Se13 ,hR78,146 R3 1.4025,1.4025,0.961,90,90,120 - - 5.85 X 7087
As-Cu-Sm CuSmAs2 CuHfSi2,tP8,129 P4/nmm 0.3935,0.3935,0.9972,90,90,90 - - 7.82 A 30559
As-Cu-Sm Cu1.05 SmAs2 Cu1.5 CeIn1.5 ,tP10,129 P4/nmm 0.3944,0.3944,0.9944,90,90,90 - gray silver 7.88 X 40196
As-Cu-Sr SrCuAs BeZrSi,hP6,194 P63 /mmc 0.4273,0.4273,0.8452,90,90,120 AlB2 family red ruby 5.62 X 12038
As-Cu-Sr SrCu2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4279,0.4279,1.0215,90,90,90 - gray steel 6.47 X 31048
As-Cu-Sr SrCu4As2 CaCu4P 2,hR21,166 R-3m 0.4203,0.4203,2.3452,90,90,120 - gray steel 6.83 X 36662
As-Cu-Tb CuTbAs2 CuHfSi2,tP8,129 P4/nmm 0.3901,0.3901,0.9901,90,90,90 - gray 8.21 X 41052
As-Cu-Te CuAsTe CuAsS,oP12,62 Pnma 1.266,0.364,0.565,90,90,90 - - 6.79 A 3502
As-Cu-Tm CuTmAs2 CuHfSi2,tP8,129 P4/nmm 0.3854,0.3854,0.9778,90,90,90 - gray 8.74 X 41052
As-Cu-U CuUAs2 CuHfSi2,tP8,129 P4/nmm 0.3948,0.3948,0.9533,90,90,90 - - 10.09 X 20199
As-Cu-U Cu2UAs2 Ce2SO2,hP5,164 P-3m1 0.4103,0.4103,0.6544,90,90,120 - - 8.96 A 19128
As-Cu-U Cu4U2As5 Cu4U2As5 ,tI22,139 I4/mmm 0.399,0.399,2.4299,90,90,90 - - 9.49 X 24855
As-Cu-Y CuYAs2 CuHfSi2,tP8,129 P4/nmm 0.3888,0.3888,0.9881,90,90,90 - - 6.72 X 41052
As-Cu-Yb CuYbAs2 CuHfSi2,tP8,129 P4/nmm 0.3842,0.3842,0.9743,90,90,90 - gray silver 8.92 X 40196
As-Cu-Yb Cu4Yb2 As3 Hf2Co4P 3,hP36,189 P-62m 1.33072,1.33072,0.40091,90,90,120 - - 8.91 X 41593
As-Dy-Ni DyNiAs hex1 LiBaSi,hP3,187 P-6m2 0.4052,0.4052,0.3805,90,90,120 AlB2 family - 9.09 X 35867
As-Dy-Ni DyNiAs hex2 YPtAs,hP12,194 P63 /mmc 0.4052,0.4052,1.519,90,90,120 AlB2 family - 9.11 A 39663
As-Dy-Ni DyNi4As2 ZrFe4Si2,tP14,136 P42 /mnm 0.7239,0.7239,0.376,90,90,90 - black 9.22 X 23540
As-Dy-Ni Dy10Ni21As15 Sm10Ni20.8 P15,hP98,176 P63 /m 2.106,2.106,0.3903,90,90,120 - - 8.82 A 35867
As-Dy-Ni Dy2NiAs2 rt Ho2NiAs2 ,hP10,194 P63 /mmc 0.4095,0.4095,1.3944,90,90,120 - - 8.75 A 21646
As-Dy-Ni Dy2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9352,0.9352,0.3814,90,90,120 - black 8.93 A 14272
As-Dy-Ni Dy6Ni15As10 Tb6Ni15As10,hP78,176 P63 /m 1.6984,1.6984,0.3883,90,90,120 - - 8.92 A 46615
As-Dy-Ni Dy6Ni15As10.5 Dy6Ni15As10.5 ,hP72,176 P63 /m 1.6985,1.6985,0.3877,90,90,120 - black 9.06 X 39519
As-Dy-Ni Dy7Ni19As13 Zr6Ni20P 13 ,hP39,174 P-6 1.3121,1.3121,0.3869,90,90,120 - - 9.29 A 18213
Handbook of Inorganic Substances – Edition 2015 : Data 251

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Dy-O Dy[AsO4] lt Dy[AsO4],oI24,74 Imma 0.7026,0.7056,0.6297,90,90,90 - - 6.41 X 10580


As-Dy-O Dy[AsO4] rt Zr[SiO4],tI24,141 I41/amd 0.7063,0.7063,0.6304,90,90,90 - - 6.37 X 10580
As-Dy-Pd DyPdAs TiNiSi,oP12,62 Pnma 0.7,0.4106,0.7869,90,90,90 AlB2 family - 10.10 A 26089
As-Dy-Pt DyPtAs YPtAs,hP12,194 P63/mmc 0.4254,0.4254,1.516,90,90,120 AlB2 family gray 12.09 A 19746
As-Dy-Rh Dy2 Rh12As7 Zr2Rh12P 7,hP22,176 P63/m 0.9894,0.9894,0.3866,90,90,120 - grayish 10.56 A 16937
As-Dy-S DyAsS CeAsS,mP12,14 P121/c1 0.38131,1.688,0.544,90,134.05,90 - - 7.11 A 10745
As-Dy-Se DyAsSe CeAsS,mP12,14 P121/c1 0.3888,1.7335,0.55237,90,134.719,90 - - 7.94 A 14806
As-Dy-Te DyAsTe TiNiSi,oP12,62 Pnma 0.74951,0.40246,0.98288,90,90,90 AlB2 family black 8.18 X 37205
As-Er-Ni ErNiAs hex1 LiBaSi,hP3,187 P-6m2 0.40444,0.40444,0.37657,90,90,120 AlB2 family - 9.37 X 49729
As-Er-Ni ErNiAs hex2 YPtAs,hP12,194 P63/mmc 0.4033,0.4033,1.5035,90,90,120 AlB2 family - 9.44 A 39663
As-Er-Ni ErNi4As2 ZrFe 4Si2,tP14,136 P42/mnm 0.72162,0.72162,0.37573,90,90,90 - black 9.37 X 49729
As-Er-Ni Er13 Ni25As19 Tm13 Ni25As19,hP57,174 P-6 1.6208,1.6208,0.38847,90,90,120 - - 9.52 X 54973
As-Er-Ni Er2NiAs2 rt Ho2NiAs2,hP10,194 P63/mmc 0.4081,0.4081,1.3753,90,90,120 - - 9.09 A 49729
As-Er-Ni Er2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.93505,0.93505,0.37981,90,90,120 - black 9.03 X 49729
As-Er-Ni Er6Ni20As13 Zr6Ni20P 13,hP39,174 P-6 1.30798,1.30798,0.38308,90,90,120 - - 9.22 A 49729
As-Er-O Er[AsO4] Zr[SiO4],tI24,141 I41/amd 0.7021,0.7021,0.6272,90,90,90 - - 6.58 A 2034
As-Er-Pd ErPdAs TiNiSi,oP12,62 Pnma 0.696,0.4082,0.7862,90,90,90 AlB2 family black 10.37 X 49705
As-Er-Pt ErPtAs YPtAs,hP12,194 P63/mmc 0.4242,0.4242,1.4952,90,90,120 AlB2 family gray 12.47 A 19746
As-Er-Rh Er2Rh12As7 Zr2Rh12P 7,hP22,176 P63/m 0.989,0.989,0.3858,90,90,120 - grayish 10.64 A 16937
As-Er-S ErAsS CeAsS,mP12,14 P121/c1 0.37636,1.663,0.536,90,134.242,90 - - 7.58 A 10745
As-Er-Se ErAsSe CeAsS,mP12,14 P121/c1 0.3859,1.7234,0.54825,90,134.729,90 - - 8.23 A 14806
As-Er-Te ErAsTe TiNiSi,oP12,62 Pnma 0.74478,0.40078,0.97552,90,90,90 AlB2 family black 8.44 X 37205
As-Eu-Fe EuFe 2As2 lt SrRh2As2,oF20,69 Fmmm 0.54983,0.55546,1.2059,90,90,90 - - 7.46 X 50748
As-Eu-Fe EuFe 2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.39062,0.39062,1.21247,90,90,90 - - 7.42 X 50748
As-Eu-Ga EuGa2 As2 EuGa2P 2,mP22,10 P12/m1 0.94953,0.40294,1.24237,90,95.304,90 - gray silver 6.19 X 52022
As-Eu-Ga Eu3Ga2As4 Ca3Al2As4,mS36,15 C12/c1 1.3386,1.0426,0.6732,90,89.258,90 - black 6.33 X 58898
As-Eu-In EuIn2 As2 EuIn2P 2,hP10,194 P63/mmc 0.42055,0.42055,1.7887,90,90,120 - - 6.44 A 50175
As-Eu-Li LiEuAs TiNiSi,oP12,62 Pnma 0.7543,0.4485,0.7978,90,90,90 AlB2 family black 5.75 A 33892
As-Eu-Mg Mg2 EuAs2 Ce2SO2,hP5,164 P-3m1 0.4393,0.4393,0.7321,90,90,120 - gray 4.76 A 41079
As-Eu-Mn EuMn2As2 Ce2SO2,hP5,164 P-3m1 0.4287,0.4287,0.7225,90,90,120 - black 5.94 X 12612
As-Eu-Mn Eu14 MnAs11 Sr14GaAs11,tI216,142 I41/acd 1.6318,1.6318,2.1684,90,90,90 - - 6.92 X 38532
As-Eu-Na Na2Eu3As4 Na2Sr3P4,oP36,62 Pnma 0.7459,1.5421,0.8132,90,90,90 - - 5.69 X 26381
As-Eu-Nb Eu13 NbAs11 Sr14GaAs11,tI216,142 I41/acd 1.6329,1.6329,2.1973,90,90,90 - gray 6.56 X 32467
As-Eu-Ni EuNi2As2 lt CeAl2Ga2,tI10,139 I4/mmm 0.4115,0.4115,1.0086,90,90,90 - - 8.15 X 21303
As-Eu-Ni EuNi5As3 LaCo 5P3,oS36,63 Cmcm 0.3742,1.2215,1.1839,90,90,90 - gray silver 8.23 X 25516
As-Eu-Ni Eu10 Ni21As15.5 Eu10 Ni21As15.5 ,hP92,176 P63/m 2.11496,2.11496,0.40734,90,90,120 - - 8.24 X 52547
As-Eu-O Eu[AsO4] Zr[SiO4],tI24,141 I41/amd 0.71617,0.71617,0.6375,90,90,90 - colorless 5.91 X 53553
As-Eu-O Eu4As2O K2NiF4,tI14,139 I4/mmm 0.47924,0.47924,1.61933,90,90,90 high-Tc family - 6.91 X 10441
As-Eu-P EuAs1.8P 1.2 SrAs3,mS16,12 C12/m1 0.9294,0.7222,0.5691,90,112.79,90 - - 6.11 A 21688
As-Eu-Pd EuPdAs rt (Eu0.5 Gd0.5 )PtP,hP10,194 P63/mmc 0.4264,0.4264,0.8531,90,90,120 AlB2 family gray 8.24 X 26089
As-Eu-Pd EuPd2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4313,0.4313,1.0142,90,90,90 - - 9.06 A 18318
As-Eu-Pd Eu2Pd12As7 Ho2Rh12As7,hP24,176 P63/m 1.004,1.004,0.41,90,90,120 - - 9.77 X 39495
As-Eu-Pd Eu3Pd4As4 Eu3Pd4As4,oP11,47 Pmmm 0.4205,0.4308,1.264,90,90,90 - - 8.57 X 31094
As-Eu-Pt EuPtAs LaPtSi,tI12,109 I41md 0.423,0.423,1.4878,90,90,90 - brown gray 10.53 X 19725
As-Eu-Pt EuPt0.55 As1.45 AlB2 ,hP3,191 P6/mmm 0.4181,0.4181,0.4319,90,90,120 AlB2 family - 9.34 X 19725
As-Eu-Pt EuPt2As2 ht CaBe2Ge2,tP10,129 P4/nmm 0.4464,0.4464,0.9832,90,90,90 - gray steel 11.73 X 49597
As-Eu-Pt EuPt2As2 rt SrPt2As2,oP14,59 Pmmn 0.4435,0.4467,0.9784,90,90,90 - gray steel 11.86 X 49597
As-Eu-Rh EuRh2 As2 CeAl2Ga2,tI10,139 I4/mmm 0.4067,0.4067,1.1319,90,90,90 - gray silver 9.00 X 49746
As-Eu-Rh Eu3Rh15As9.5 Sm3 Rh15Si9.5 ,hP58,176 P63/m 1.6124,1.6124,0.3903,90,90,120 - gray 10.25 X 40964
As-Eu-Ru EuRu2 As2 CeAl2Ga2,tI10,139 I4/mmm 0.4167,0.4167,1.0778,90,90,90 - - 8.94 A 20401
As-Eu-S EuAsS CeAsS,mP12,14 P121/c1 0.38632,1.73,0.55,90,133.06,90 - - 6.40 A 28710
As-Eu-S Eu3As2S8 Eu3As2S8,hR78,167 R-3c 0.9254,0.9254,2.7698,90,90,120 - red dark 4.18 X 48479
As-Eu-S Eu4As2S Th3P 4,cI28,220 I-43d 0.9199,0.9199,0.9199,90,90,90 - - 6.74 A 12608
As-Eu-Se Eu4As2Se Th3P 4,cI28,220 I-43d 0.9289,0.9289,0.9289,90,90,90 - - 6.93 A 12608
As-Eu-Sn Eu5Sn2As6 Ca5Sn2As6,oP26,55 Pbam 1.2281,1.3941,0.42029,90,90,90 - black 6.68 X 58334
As-Eu-Te Eu4As2Te Th3P 4,cI28,220 I-43d 0.9453,0.9453,0.9453,90,90,90 - - 6.96 A 12608
As-Eu-Zn Zn2Eu2As3 Ba2Cd2As3,mS28,12 C12/m1 1.6032,0.4255,1.1871,90,126.525,90 - gray 6.73 X 58279
As-Eu-Zn Zn6Eu11As12 Sr11Cd6Sb12,mS58,12 C12/m1 3.031,0.43318,1.1774,90,109.746,90 - black 6.76 X 53689
As-F-Fe FeAs4F18 FeAs4F18,mP46,14 P121/c1 0.7338,1.303,1.02584,90,134.221,90 - colorless 3.30 X 35506
As-F-Hg Hg2 AsF6 Hg2AsF6,mP36,14 P121/c1 0.5489,1.1633,0.985,90,92.2,90 - red 6.24 X 16040
As-F-Hg Hg2.86 AsF6 Hg2.86 AsF6,tI92,141 I41/amd 0.7538,0.7538,1.2339,90,90,90 - gray silver 7.22 X 8148
As-F-Hg Hg3 As2F12 Hg3As2F12,mP34,14 P121/c1 0.5981,0.8551,1.1282,90,91.16,90 - - 5.64 X 7371
As-F-I AsI2 F6 AsI2 F6,mS36,12 C12/m1 1.2411,0.981,0.5876,90,104.06,90 - red dark 4.24 X 21174
As-F-I AsI5 F6 AsI5 F6,mS48,15 C12/c1 1.0529,1.8568,0.832,90,128.51,90 - black green 4.30 X 18964
As-F-I [IF6]AsF6 TlCoCl6[NH3]6,cP56,205 Pa-3 0.9409,0.9409,0.9409,90,90,90 - colorless 3.43 X 45932
As-F-I [I3]AsF6 [I3]AsF6,aP20,2 P-1 0.5942,0.8054,1.0503,88.95,76.92,79.65 - - 3.93 X 14154
As-F-In InAsF6 KAsF6,hR24,148 R-3 0.75029,0.75029,0.77462,90,90,120 - - 4.01 X 51407
As-F-K KAsF6 KAsF6,hR24,148 R-3 0.7348,0.7348,0.7274,90,90,120 - colorless 3.34 X 34159
As-F-K KAs2F7 KAs2F7,mP40,14 P121/c1 1.099,0.739,0.875,90,110.8,90 - - 3.22 X 13298
As-F-Kr KrAsF7 KrAsF7,mP36,14 P121/c1 0.51753,1.02019,1.05763,90,95.298,90 - colorless 3.48 X 38674
As-F-Kr Kr3As2F16 Kr3As2F16,mP84,14 P121/c1 0.6247,2.4705,0.88616,90,90.304,90 - - 3.43 X 38674
As-F-Li LiAsF6 LiSbF6,hR24,148 R-3 0.5016,0.5016,1.3028,90,90,120 - - 3.44 X 29729
As-F-Mn MnAs2F12 rt MnAs2F12,tI60,122 I-42d 0.75076,0.75076,1.54444,90,90,90 - - 3.30 X 33068
As-F-N [N2F]AsF6 [NS2 ]AsF6,mS20,12 C12/m1 0.9184,0.5882,0.516,90,90.47,90 - - 2.81 X 24740
As-F-Na NaAsF6 ht NaSbF6,cF32,225 Fm-3m 0.78608,0.78608,0.78608,90,90,90 - - 2.90 X 58788
As-F-Na NaAsF6 rt LiSbF6,hR24,148 R-3 0.53375,0.53375,1.39645,90,90,120 - - 3.06 X 58788
As-F-Pb PbAsF7 PbAsF7,aP18,2 P-1 0.4661,0.7237,0.7474,105.93,101.49,90.66 - colorless 5.82 X 38977
As-F-Rb RbAsF6 ht CsPF6,cF152,225 Fm-3m 0.8246,0.8246,0.8246,90,90,90 - - 3.25 A 35383
252 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-F-Rb RbAsF6 rt KAsF6,hR24,148 R-3 0.7497,0.7497,0.7589,90,90,120 - colorless 3.70 X 35383


As-F-S AsSF9 *,oS24,36 Cmc21 2.0375,0.8508,1.1224,90,90,90 - - 2.85 P 6663
As-F-S AsS4F6 AsS4F6,mP176,14 P121/c1 1.5005,1.3401,1.6489,90,107.96,90 - blue 2.67 X 5938
As-F-S As2S19F12 As2S19F12,aP70,2 P-1 0.7536,1.3406,1.40244,90.081,103.999,93.24 - red dark 2.39 X 13226
As-F-S As2S2F3 As2S2F3,oP56,57 Pbcm 0.593,1.9962,0.9441,90,90,90 - yellow 3.22 X 14162
As-F-S As3S4F15 As3S4F15,mP104,14 P121/c1 0.7886,0.9261,1.9191,90,92.82,90 - blue pale 3.03 X 37184
As-F-Sb SbAsF8 SbAsF8,mP20,11 P121/m1 0.551,0.815,0.692,90,95.,90 - - 3.74 X 6061
As-F-Sn SnAsF7 SnAsF7,hR81,155 R32 0.9123,0.9123,1.6983,90,90,120 - - 3.99 X 10398
As-F-Sr SrAs2F12 BaAu2F12,cP60,215 P-43m 0.923,0.923,0.923,90,90,90 - - 3.93 A 23989
As-F-Te AsTeF5 AsTeF5,mS168,15 C12/c1 1.4832,1.2242,1.5301,90,96.59,90 - - 4.30 X 12339
As-F-Te As2Te7F12 As2Te7F12 ,oP84,62 Pnma 1.6208,1.13,0.962,90,90,90 - black 4.79 X 31611
As-F-Tl TlAsF6 KAsF6,hR24,148 R-3 0.75084,0.75084,0.76743,90,90,120 - - 5.23 X 51407
As-F-Xe XeAsF11 XeAsF11,mP52,14 P121/c1 0.5886,1.6564,0.8051,90,91.57,90 - green 3.51 X 8210
As-F-Xe XeAsF7 XeAsF7,mP36,14 P121/c1 0.62109,0.61686,1.5932,90,102.544,90 - colorless 3.78 X 54390
As-F-Xe Xe2AsF9 lt1 Xe2AsF9,hP57,152 P3121 0.8602,0.8602,1.0665,90,90,120 - colorless 3.71 X 37471
As-F-Xe Xe2AsF9 lt2 Xe2AsF9,mS168,15 C12/c1 2.5756,0.8556,1.5356,90,126.592,90 - colorless 3.73 X 37471
As-F-Xe Xe2AsF9 mon Xe2AsF9,mS144,15 C12/c1 2.59486,0.8678,1.5443,90,126.392,90 - green 3.62 X 8210
As-Fe-Ga Fe1.5 Ga0.5 As0.5 Co1.75 Ge,hP6,194 P63 /mmc 0.3981,0.3981,0.50312,90,90,120 AlB2 family - 7.51 X 28085
As-Fe-Ga Fe6Ga3.4 As0.6 Fe6.5 Ge4,hP22,194 P63 /mmc 0.8156,0.8156,0.5006,90,90,120 AlB2 family - 7.11 X 23495
As-Fe-Ge FeGe0.4As0.6 FeAs,oP8,62 Pnma 0.5495,0.3321,0.606,90,90,90 AlB2 family - 7.80 A 37311
As-Fe-Ge Fe12Ge3.35 As1.65 Fe5(Fe0.82 Ru0.18)7As5,hR51,146 R3 0.67747,0.67747,1.6209,90,90,120 - - 8.02 A 16383
As-Fe-Hf HfFeAs HoNiGa,oP12,62 Pnma 0.64139,0.38175,0.7236,90,90,90 AlB2 family - 11.59 A 35202
As-Fe-K KFe2As2 Cu2TlSe2,tI10,139 I4/mmm 0.3842,0.3842,1.3861,90,90,90 - - 4.88 X 14799
As-Fe-La LaFeAs PbClF,tP6,129 P4/nmm 0.40308,0.40308,0.8742,90,90,90 - - 6.31 A 27615
As-Fe-La LaFe4As12 LaFe4P 12,cI34,204 Im-3 0.83273,0.83273,0.83273,90,90,90 - black 7.25 X 53215
As-Fe-La La12Fe57.5 As41 La12Fe57.5 As41,oP236,59 Pmmn 1.08881,2.5753,1.25436,90,90,90 - black 7.51 X 54307
As-Fe-Li LiFeAs PbClF,tP6,129 P4/nmm 0.37712,0.37712,0.63396,90,90,90 - brown dark 5.07 X 58586
As-Fe-Mn MnFeAs ht-hp ZrNiAl,hP9,189 P-62m 0.6254,0.6254,0.3615,90,90,120 Fe2P family - 7.56 A 10071
As-Fe-Mn Mn0.15 Fe0.85 As rt FeAs,oP8,62 Pnma 0.5435,0.3404,0.6041,90,90,90 AlB2 family - 7.76 X 7885
As-Fe-Mn Mn0.85 Fe0.15 As ht1 FeAs,oP8,62 Pnma 0.55918,0.35538,0.62466,90,90,90 AlB2 family - 6.96 X 21390
As-Fe-Mn Mn0.85 Fe0.15 As ht2 NiAs,hP4,194 P63 /mmc 0.367,0.367,0.567,90,90,120 AlB2 family - 6.53 X 21390
As-Fe-Mn Mn1.28 Fe0.72 As rt MnAlGe,tP6,129 P4/nmm 0.3749,0.3749,0.6206,90,90,90 - - 7.06 X 33356
As-Fe-Mo Mo0.4Fe1.6 As Fe2P,hP9,189 P-62m 0.618,0.618,0.3571,90,90,120 Fe2P family - 8.55 A 10865
As-Fe-Mo Mo0.8Fe0.2 As FeAs,oP8,62 Pnma 0.5977,0.3364,0.64,90,90,90 AlB2 family - 8.41 X 9243
As-Fe-Mo Mo1.7Fe10.3 As5 Fe5(Fe0.82 Ru0.18)7As5,hR51,146 R3 0.68298,0.68298,1.6474,90,90,120 - - 8.33 A 16383
As-Fe-Na NaFeAs rt PbClF,tP6,129 P4/nmm 0.39463,0.39463,0.70408,90,90,90 - - 4.66 X 53988
As-Fe-Na Na0.985 FeAs lt Na0.985 FeAs,oS12,67 Cmme 0.55695,0.55891,0.69919,90,90,90 - - 4.68 X 53224
As-Fe-Na Na0.99 Fe1.62 As2 Cu2TlSe2,tI10,139 I4/mmm 0.3831,0.3831,1.252,90,90,90 - gray 4.75 X 58380
As-Fe-Nb NbFeAs TiNiSi,oP12,62 Pnma 0.6258,0.3734,0.7181,90,90,90 AlB2 family - 8.85 A 3421
As-Fe-Nd NdFeAs PbClF,tP6,129 P4/nmm 0.39655,0.39655,0.8575,90,90,90 - - 6.77 A 27615
As-Fe-Nd NdFe4As12 LaFe4P 12,cI34,204 Im-3 0.8309,0.8309,0.8309,90,90,90 - black 7.33 A 38122
As-Fe-Nd Nd6Fe13As La6Co9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.8049,0.8049,2.2665,90,90,90 - - 7.54 A 27706
As-Fe-Ni FeNiAs ZrNiAl,hP9,189 P-62m 0.6071,0.6071,0.358,90,90,120 Fe2P family - 8.26 A 2310
As-Fe-Ni Fe0.2 Ni0.8 As rt NiAs,hP4,194 P63 /mmc 0.357,0.357,0.512,90,90,120 AlB2 family - 7.82 X 11160
As-Fe-Ni Fe0.4 Ni0.6 As3 CoAs3,cI32,204 Im-3 0.8271,0.8271,0.8271,90,90,90 - - 6.63 A 764
As-Fe-Ni Fe0.75 Ni0.25 As2 FeAs2,oP6,58 Pnnm 0.52309,0.59555,0.29693,90,90,90 pyrite-marcasite family - 7.41 X 12048
As-Fe-Ni Fe0.8 Ni0.2 As FeAs,oP8,62 Pnma 0.536,0.344,0.596,90,90,90 AlB2 family - 7.94 A 11160
As-Fe-O Fe[AsO4] ht LiAlH4,mP24,14 P121/c1 0.5012,0.8081,0.79625,90,113.142,90 - brown 4.36 X 27794
As-Fe-O Fe[AsO4] orth1 Cu[SO4],oP24,62 Pnma 0.8998,0.6475,0.4851,90,90,90 - - 4.58 A 6622
As-Fe-O Fe[AsO4] orth2 Cr[PO4],oI72,74 Imma 1.0768,1.3468,0.6525,90,90,90 - brown 4.10 X 41346
As-Fe-O Fe[AsO4] trig Al[AsO4],hP18,152 P3121 0.5154,0.5154,1.147,90,90,120 - - 3.68 A 4003
As-Fe-O Fe2As[AsO4]3 Fe2As[AsO4]3,hP110,173 P63 1.466,1.466,0.7632,90,90,120 - - 4.23 X 12118
As-Fe-O Fe4As5O13 Fe4As5O13 ,aP44,2 P-1 0.8924,0.9103,0.91446,94.26,115.981,112.41 schneiderhöhnite - 4.53 X 17878
As-Fe-O Fe4[AsO4]2O3 Fe4[AsO4]2O3,aP17,2 P-1 0.5036,0.6461,0.6594,108.86,106.21,98.35 - - 4.84 X 11789
As-Fe-O Fe4[As2O7 ]3 *,tP124,* - 1.171,1.171,1.443,90,90,90 - - 3.39 N 33693
As-Fe-O Fe7[AsO4]6 Fe7[PO4]6 ,aP37,2 P-1 0.65738,0.80973,0.9619,104.843,107.936,101.842 - black 4.54 X 42622
As-Fe-P FeAs0.1P 0.9 FeAs,oP8,62 Pnma 0.52,0.3121,0.5796,90,90,90 AlB2 family - 6.44 X 7890
As-Fe-P Fe2As0.3P0.7 Fe2P,hP9,189 P-62m 0.602,0.602,0.3418,90,90,120 Fe2P family - 7.24 X 7588
As-Fe-Pr PrFeAs PbClF,tP6,129 P4/nmm 0.39857,0.39857,0.8618,90,90,90 - - 6.59 A 27615
As-Fe-Pr PrFe4As12 LaFe4P 12,cI34,204 Im-3 0.831,0.831,0.831,90,90,90 - - 7.31 X 51084
As-Fe-Pr Pr6Fe13As La6Co9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.8059,0.8059,2.2767,90,90,90 - - 7.40 A 27706
As-Fe-Rb RbFe2As2 CeAl2Ga2,tI10,139 I4/mmm 0.3888,0.3888,1.4534,90,90,90 - - 5.25 A 17714
As-Fe-Re Re5Fe2As12 Re5Ni2As12 ,oP38,58 Pnnm 1.2723,1.5632,0.3282,90,90,90 - - 9.88 A 16328
As-Fe-Rh FeRhAs Fe2P,hP9,189 P-62m 0.6323,0.6323,0.3618,90,90,120 Fe2P family - 9.29 A 8106
As-Fe-Rh Fe10.3 Rh1.7 As5 Fe5(Fe0.82 Ru0.18)7As5,hR51,146 R3 0.68485,0.68485,1.6449,90,90,120 - - 8.39 A 16383
As-Fe-Ru Fe10.77 Ru1.23 As5 Fe5(Fe0.82 Ru0.18)7As5,hR51,146 R3 0.68234,0.68234,1.6364,90,90,120 - - 8.31 X 16383
As-Fe-S FeAsS mon FeAsS,mP12,14 P121/c1 0.57612,0.56841,0.57674,90,111.721,90 arsenopyrite M - 6.16 X 57822
As-Fe-S FeAs0.03 S1.97 FeS2,cP12,205 Pa-3 0.5428,0.5428,0.5428,90,90,90 pyrite - 5.04 X 48376
As-Fe-S FeAs0.38 S1.62 FeS2,oP6,58 Pnnm 0.4449,0.5432,0.3391,90,90,90 marcasite - 5.52 X 48376
As-Fe-S FeAs1.1 S0.9 tricl FeAsS,aP12,2 P-1 0.572,0.5792,0.5828,113.2,90.,90. arsenopyrite A - 6.25 X 1411
As-Fe-Sb FeSb0.17 As1.58 FeAs2,oP6,58 Pnnm 0.525,0.601,0.293,90,90,90 löllingite blue gray 7.00 A 5753
As-Fe-Se FeAsSe FeAsS,mP12,14 P121/c1 0.595,0.589,0.595,90,112.7,90 pyrite-marcasite family - 7.24 A 2758
As-Fe-Se FeAs1.87 Se 0.13 FeAs2,oP6,58 Pnnm 0.5281,0.5986,0.2918,90,90,90 pyrite-marcasite family - 7.42 A 8346
As-Fe-Si Fe5SiAs m Pd5Sb2,hP42,185 P63 cm 0.6877,0.6877,1.2596,90,90,120 - - 7.38 X 26106
As-Fe-Sr SrFe2As2 lt SrRh2As2,oF20,69 Fmmm 0.55175,0.55783,1.22965,90,90,90 - - 6.13 X 50748
As-Fe-Sr SrFe2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.39289,0.39289,1.23172,90,90,90 - gray steel 6.10 X 56788
As-Fe-Ta TaFeAs TiNiSi,oP12,62 Pnma 0.6233,0.3732,0.7162,90,90,90 AlB2 family - 12.43 A 3421
As-Fe-Te FeAsTe FeAsS,mP12,14 P121/c1 0.619,0.61,0.621,90,113.6,90 pyrite-marcasite family - 7.99 A 2758
Handbook of Inorganic Substances – Edition 2015 : Data 253

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Fe-Th ThFe 4As12 LaFe 4P 12,cI34,204 Im-3 0.8314,0.8314,0.8314,90,90,90 - - 7.83 X 51084


As-Fe-Ti TiFeAs ZrNiAl,hP9,189 P-62m 0.6321,0.6321,0.35903,90,90,120 Fe2P family - 7.16 A 7673
As-Fe-V VFeAs ZrNiAl,hP9,189 P-62m 0.621,0.621,0.3533,90,90,120 Fe2P family - 7.67 A 6909
As-Fe-Zr ZrFeAs HoNiGa,oP12,62 Pnma 0.6488,0.3885,0.7351,90,90,90 AlB2 family - 7.96 A 35202
As-Ga-Ge Ga0.33 Ge0.33 As0.34 C,cF8,227 Fd-3m 0.566,0.566,0.566,90,90,90 - - 5.31 X 12361
As-Ga-In Ga0.8 In0.2 As m ZnS,cF8,216 F-43m 0.572,0.572,0.572,90,90,90 adamantane structure - 5.45 X 8262
As-Ga-K K10Ga3As6.33 K10Ga3Sb6.33 ,hP40,176 P63/m 1.678,1.678,0.5245,90,90,120 - - 2.79 X 24317
As-Ga-K K2GaAs2 K2GaAs2,mP40,14 P121/c1 0.8884,1.4393,1.11534,90,118.177,90 - red 3.15 X 25592
As-Ga-K K2Ga2As3 Na2Al2Sb3,mP56,14 P121/c1 1.3782,0.6739,1.5644,90,90.4,90 - - 4.05 X 25673
As-Ga-K K3Ga3As4 K3Ga3As4,oP40,52 Pnna 0.6597,1.4792,1.0589,90,90,90 - black 4.03 X 23376
As-Ga-Mn Mn0.06 Ga0.94As tf ZnS,cF8,216 F-43m 0.5671,0.5671,0.5671,90,90,90 adamantane structure - 5.24 X 51280
As-Ga-Mn Mn2 Ga0.5 As0.5 m Co1.75 Ge,hP6,194 P63/mmc 0.4062,0.4062,0.5048,90,90,120 AlB2 family - 8.39 X 19025
As-Ga-N GaAs0.0625 N0.9375 ZnS,cF8,216 F-43m 0.4529,0.4529,0.4529,90,90,90 adamantane structure - 6.26 X 46757
As-Ga-Na Na2Ga2As3 Na2Al2Sb3,mP56,14 P121/c1 1.3175,0.6705,1.4459,90,90.2,90 - - 4.27 X 25672
As-Ga-Na Na6GaAs3 K6InAs3,aP44,2 P-1 0.8202,0.817,1.7287,94.8,94.2,119.8 - - 2.89 X 28283
As-Ga-Ni Ni1.16 Ga0.16 As0.83 *,hP*,* - 1.1026,1.1026,1.008,90,90,120 - - - N 22333
As-Ga-Ni Ni1.5 Ga0.25As0.75 Co1.75 Ge,hP6,194 P63/mmc 0.3826,0.3826,0.5109,90,90,120 AlB2 family - 8.29 X 22333
As-Ga-Ni Ni1.78 Ga0.5 As0.5 ht1 Co1.75 Ge,hP6,194 P63/mmc 0.3941,0.3941,0.506,90,90,120 AlB2 family - 8.63 X 22333
As-Ga-Ni Ni3GaAs *,hP*,* - 0.6689,0.6689,1.5184,90,90,120 - - - N 22333
As-Ga-Ni Ni3Ga1.75 As0.25 *,hP*,* - 0.7898,0.7898,2.0022,90,90,120 - - - N 22333
As-Ga-O Ga[AsO4] hp *,aP18,* - 0.4035,0.5387,0.852,87.8,88.8,88.4 - - 5.62 N 30883
As-Ga-O Ga[AsO4] ht Al[PO4],oS24,20 C222 1 0.70592,0.70893,0.70977,90,90,90 - - 3.90 X 59065
As-Ga-O Ga[AsO4] rt Al[AsO4],hP18,152 P3121 0.49942,0.49942,1.13816,90,90,120 - - 4.23 X 36230
As-Ga-O Ga1.5 As1.5 O6 ht-hp Ga(Ga0.5 As0.5)AsO6,hP27,143 P3 0.82033,0.82033,0.43941,90,90,120 - white 6.09 X 46100
As-Ga-P GaAs0.065P 0.935 ZnS,cF8,216 F-43m 0.5462,0.5462,0.5462,90,90,90 adamantane structure - 4.22 X 24245
As-Ga-Pd Pd12 Ga4.5As2.5 Th7S12,hP20,176 P63/m 0.9425,0.9425,0.3708,90,90,120 - - 10.35 X 24877
As-Ga-Pd Pd2Ga0.45 As0.55 ht Fe2P,hP9,189 P-62m 0.667,0.667,0.335,90,90,120 Fe2P family - 11.01 A 5603
As-Ga-Pd Pd25 Ga4.5As4.5 Pd25 Ge9,hP34,147 P-3 0.7368,0.7368,1.0603,90,90,120 - - 11.03 A 23542
As-Ga-Pd Pd5GaAs TlPd5As,tP7,123 P4/mmm 0.3949,0.3949,0.6876,90,90,90 - - 10.48 A 5603
As-Ga-Rb Rb2GaAs2 K2GaAs2,mP40,14 P121/c1 0.8992,1.4751,1.17158,90,118.342,90 - red 3.79 X 25593
As-Ga-Rh Rh5Ga2As La2SnS5,oP16,55 Pbam 0.5463,1.0215,0.4019,90,90,90 - - 10.79 X 24877
As-Ga-Sb GaSb0.5 As0.5 lt ZnS,cF8,216 F-43m 0.5875,0.5875,0.5875,90,90,90 adamantane structure - 5.50 X 19471
As-Ga-Si Ga0.45 Si1.10 As0.45 tf ZnS,cF8,216 F-43m 0.553,0.553,0.553,90,90,90 adamantane structure - 3.77 X 8264
As-Ga-Sn Ga0.9973 Sn0.0054 As0.9973 ZnS,cF8,216 F-43m 0.56538,0.56538,0.56538,90,90,90 adamantane structure - 5.33 X 3562
As-Ga-Sr SrGa2As2 SrGa2As2,mP20,10 P12/m1 0.95905,0.40474,1.2525,90,95.699,90 - - 5.18 X 56142
As-Ga-Sr Sr14 GaAs11 Sr14GaAs11,tI216,142 I41/acd 1.6498,1.6498,2.2132,90,90,90 - black 4.68 X 24546
As-Ga-Sr Sr3Ga2As4 Ca3Al2As4,mS36,15 C12/c1 1.3497,1.0497,0.67903,90,89.725,90 - black 4.85 X 58898
As-Gd-Ni GdNiAs hex1 LiBaSi,hP3,187 P-6m2 0.4079,0.4079,0.3874,90,90,120 AlB2 family - 8.65 X 35867
As-Gd-Ni GdNiAs hex2 YPtAs,hP12,194 P63/mmc 0.4071,0.4071,1.545,90,90,120 AlB2 family - 8.71 A 39663
As-Gd-Ni GdNi2As2 lt CeAl2Ga2,tI10,139 I4/mmm 0.3986,0.3986,0.9816,90,90,90 - - 9.04 A 21623
As-Gd-Ni GdNi4As2 ZrFe 4Si2,tP14,136 P42/mnm 0.7285,0.7285,0.3768,90,90,90 - black 9.00 A 22394
As-Gd-Ni Gd10 Ni21As15 Sm10 Ni20.8P15,hP98,176 P63/m 2.0974,2.0974,0.392,90,90,120 - - 8.74 A 35867
As-Gd-Ni Gd2 Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9361,0.9361,0.3835,90,90,120 - black 8.81 A 14272
As-Gd-Ni Gd6 Ni15As10 Tb6Ni15As10,hP78,176 P63/m 1.7035,1.7035,0.39183,90,90,120 - - 8.68 X 46615
As-Gd-Ni Gd7 Ni19As13 Zr6Ni20P 13,hP39,174 P-6 1.3128,1.3128,0.3894,90,90,120 - - 9.11 A 18213
As-Gd-O Gd[AsO4] Zr[SiO4],tI24,141 I41/amd 0.7138,0.7138,0.6353,90,90,90 - - 6.08 A 2034
As-Gd-Pd GdPd3As2 GdPd3As2,mS36,12 C12/m1 1.6563,0.4046,0.9937,90,107.85,90 - - 9.84 X 30566
As-Gd-Pt GdPtAs YPtAs,hP12,194 P63/mmc 0.4269,0.4269,1.5344,90,90,120 AlB2 family gray 11.72 A 19746
As-Gd-S GdAsS CeAsS,mP12,14 P121/c1 0.38445,1.7,0.548,90,134.181,90 - - 6.83 A 10745
As-Gd-Se GdAsSe CeAsS,mP12,14 P121/c1 0.3925,1.7432,0.5585,90,134.65,90 - golden 7.60 X 14806
As-Gd-Te GdAsTe TiNiSi,oP12,62 Pnma 0.75611,0.4051,0.992,90,90,90 AlB2 family black 7.86 X 37205
As-Ge-I Ge12.5 As10.5 I4 Na4Si23,cP54,223 Pm-3n 1.05963,1.05963,1.05963,90,90,90 clathrate colorless 6.15 X 51725
As-Ge-I Ge19 As4I4 Ge19P4I4,cP54,218 P-43n 1.06158,1.06158,1.06158,90,90,90 clathrate gray silver 6.07 X 7795
As-Ge-K K2GeAs2 K2ZnO2,oI20,72 Ibam 0.7028,1.3292,0.6548,90,90,90 - - 3.26 X 24899
As-Ge-La La5Ge 3As0.9 CuHf5Sn3,hP18,193 P63/mcm 0.9104,0.9104,0.7121,90,90,120 AlB2 family black 6.37 A 27301
As-Ge-Li Li1.67 Ge0.33 As CaF2 ,cF12,225 Fm-3m 0.609,0.609,0.609,90,90,90 fluorite family black gray 3.25 X 642
As-Ge-Na Na5GeAs3 Na5GeP3,mP36,14 P121/c1 0.8298,0.7544,1.58974,90,121.664,90 - red dark 3.23 X 25661
As-Ge-Nb NbGeAs PbClF,tP6,129 P4/nmm 0.35519,0.35519,0.79485,90,90,90 - - 7.96 A 7555
As-Ge-Ni NiGe 0.725 As2.275 CoAs3,cI32,204 Im-3 0.82873,0.82873,0.82873,90,90,90 - - 6.58 X 40302
As-Ge-Pd Pd0.82 Ge0.13 As0.05 m W,cI2,229 Im-3m 0.3071,0.3071,0.3071,90,90,90 b.c.c. family - 11.52 X 23068
As-Ge-Pd Pd2Ge0.6 As0.4 Fe2P,hP9,189 P-62m 0.668,0.668,0.346,90,90,120 Fe2P family - 10.67 A 5603
As-Ge-Re Re3GeAs6 Nb3(Sb0.5 Te0.5 )4Te3,cI40,229 Im-3m 0.87318,0.87318,0.87318,90,90,90 - - 10.78 X 48212
As-Ge-Se GeAsSe GeAsSe,oP24,52 Pnna 0.5062,1.0117,1.1687,90,90,90 - red 5.03 X 14479
As-Ge-Se Ge0.15 As0.7 Se0.15 As,hR6,166 R-3m 0.37299,0.37299,1.07187,90,90,120 - - 5.80 A 1544
As-Ge-Sr Sr3Ge2As4 Ca3Si2As4,mP36,14 P121/c1 0.7625,1.8514,0.747,90,111.76,90 - gray 4.80 X 15619
As-Ge-Sr Sr4GeAs4 Ba4SiAs4,cP72,218 P-43n 1.2792,1.2792,1.2792,90,90,90 - - 4.59 A 14689
As-Ge-Te GeAs2Te4 GeAs2Te4,hR21,166 R-3m 0.4083,0.4083,4.038,90,90,120 - - 6.26 X 21499
As-Ge-Te GeAs4Te7 m *,hP13,164 P-3m1 0.4069,0.4069,2.331,90,90,120 - - - N 21499
As-Ge-Te Ge0.17 As0.66 Te0.17 As,hR6,166 R-3m 0.37298,0.37298,1.07003,90,90,120 - - 6.45 A 1544
As-Ge-Te Ge0.625 As0.25 Te ht NaCl,cF8,225 Fm-3m 0.5996,0.5996,0.5996,90,90,90 rocksalt family - 5.91 X 20398
As-Ge-Te Ge2 As2Te5 Pb2Bi2Se5,hP9,164 P-3m1 0.4084,0.4084,1.701,90,90,120 - - 6.31 X 21499
As-Ge-Te Ge3 As2Te6 Ge3As2Te6,hR33,166 R-3m 0.4102,0.4102,6.159,90,90,120 - - 6.29 X 21499
As-Ge-Te Ge4 As2Te7 rt Ge4As2Te7,hR39,166 R-3m 0.4106,0.4106,7.217,90,90,120 - - 6.30 X 21499
As-Ge-Te Ge5 As2Te8 rt Ge5As2Te8,hP15,164 P-3m1 0.4114,0.4114,2.756,90,90,120 - black 6.30 X 19885
As-Ge-Te Ge8 As2Te11 *,hP21,164 P-3m1 0.4117,0.4117,3.794,90,90,120 - - - N 21499
As-Ge-Zn ZnGeAs2 rt CuFeS2,tI16,122 I-42d 0.56676,0.56676,1.11359,90,90,90 adamantane structure - 5.34 X 21721
As-Ge-Zn Zn0.235 Ge1.294 As0.471 ZnS,cF8,216 F-43m 0.5654,0.5654,0.5654,90,90,90 adamantane structure - 5.31 X 28926
As-Ge-Zn Zn0.5 Ge0.5 As ht ZnS,cF8,216 F-43m 0.5644,0.5644,0.5644,90,90,90 adamantane structure - 5.32 X 6701
254 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Ge-Zr ZrGe0.33 As1.67 PbCl2,oP12,62 Pnma 0.6738,0.3668,0.91202,90,90,90 - - 7.08 X 54584


As-H-O As3O5[OH] As3O5[OH],mP36,14 P121/c1 1.21499,0.4593,1.0976,90,114.769,90 - colorless 3.84 X 15753
As-H-O H5As3O10 ht1 H5As3O10,aP13,2 P-1 0.467,0.57,0.727,99.7,98.,99.8 - - 3.50 X 2939
As-H-O H6As14O31 H6As14O31 ,hP46,173 P63 1.20525,1.20525,0.47344,90,90,120 - - 4.32 X 49667
As-H-O H6[AsO4]2 [H2O] H6[AsO4]2 [H2O],mP44,14 P121/c1 0.76,1.329,0.824,90,109.6,90 - colorless 2.56 X 3864
As-H-Sr Sr5As3H CuHf5Sn3,hP18,193 P63 /mcm 0.8917,0.8917,0.7302,90,90,120 AlB2 family - 4.39 X 46240
As-H-Yb Yb5 As3H2 Mn5Si3,hP16,193 P63 /mcm 0.84438,0.84438,0.65825,90,90,120 - - 8.92 F 46240
As-Hf-Li Li2.6Hf0.1 As BiF3,cF16,225 Fm-3m 0.6192,0.6192,0.6192,90,90,90 b.c.c. family - 3.10 X 25521
As-Hf-Mo Hf9Mo4As Hf9Mo4B,hP28,194 P63 /mmc 0.86551,0.86551,0.86672,90,90,120 - - 12.20 A 18234
As-Hf-Na Na5HfAs3 Na5GeP3,mP36,14 P121/c1 0.8433,0.7549,1.62568,90,121.617,90 - gray 3.91 X 24321
As-Hf-Nb HfNbAs TiNiSi,oP12,62 Pnma 0.6994,0.35866,0.8489,90,90,90 AlB2 family - 10.80 X 59110
As-Hf-Nb Hf0.15 Nb0.85 As NbAs,tI8,109 I41md 0.34731,0.34731,1.17868,90,90,90 - - 8.44 A 59110
As-Hf-Nb Hf0.85 Nb0.15 As TiP,hP8,194 P63 /mmc 0.37723,0.37723,1.26768,90,90,120 - - 10.23 A 59110
As-Hf-Nb Hf0.85 Nb6.15 As4 Nb7P 4,mS44,12 C12/m1 1.53823,0.35489,1.42421,90,104.473,90 - - 9.02 A 59110
As-Hf-Nb Hf1.25 Nb2.75 As3 Nb4As3,oS56,63 Cmcm 0.35814,1.4727,1.9114,90,90,90 - - 9.27 A 59110
As-Hf-Nb Hf1.7 Nb1.3 As (Hf0.57 Nb0.43 )3As,oP16,62 Pnma 0.7142,0.3583,1.164,90,90,90 - - 11.13 X 52990
As-Hf-Nb Hf1.8 Nb0.2 As Zr2P,oS108,65 Cmmm 1.9258,2.9615,0.36004,90,90,90 - - 12.08 X 59110
As-Hf-Nb Hf2.27 Nb0.73 As Ti3P,tP32,86 P42 /n 1.06739,1.06739,0.53676,90,90,90 - - 11.90 X 52990
As-Hf-Nb Hf2.5 Nb2.5 As3 Nb5P 3,oP64,62 Pnma 2.65822,0.35895,1.19228,90,90,90 - - 10.55 A 59110
As-Hf-Nb Hf3.3 Nb3.7 As3 Zr3Pd4P3,oP40,62 Pnma 1.7964,0.35869,1.1262,90,90,90 - - 10.60 X 55024
As-Hf-Nb Hf7.2 Nb3.8 As4 Zr6(Zr0.55 Nb0.45)Nb4P4,oI30,71 Immm 0.35825,0.96162,1.6103,90,90,90 - - 11.60 X 55024
As-Hf-Ni HfNiAs HoNiGa,oP12,62 Pnma 0.6421,0.376,0.7331,90,90,90 AlB2 family - 11.71 A 35202
As-Hf-Ni HfNi0.75 As2 CuHfSi2,tP8,129 P4/nmm 0.3718,0.3718,0.8759,90,90,90 - - 10.21 A 21295
As-Hf-Ni HfNi4As2 ZrFe4Si2,tP14,136 P42 /mnm 0.7054,0.7054,0.3713,90,90,90 - - 10.12 A 22394
As-Hf-Ni Hf2Ni3As3 Zr2Ni3P3,oP32,62 Pnma 1.2504,0.3668,1.0032,90,90,90 - - 10.94 A 18035
As-Hf-Os HfOsAs ZrNiAl,hP9,189 P-62m 0.6569,0.6569,0.3808,90,90,120 Fe2P family - 15.53 A 16394
As-Hf-Pd HfPdAs ZrNiAl,hP9,189 P-62m 0.6654,0.6654,0.3848,90,90,120 Fe2P family - 12.15 A 38136
As-Hf-Ru HfRuAs ht ZrNiAl,hP9,189 P-62m 0.6568,0.6568,0.3842,90,90,120 Fe2P family - 12.30 X 15932
As-Hf-Ru HfRuAs rt TiFeSi,oI36,46 Ima2 0.7527,1.1416,0.6631,90,90,90 - - 12.40 A 15932
As-Hf-S HfAs1.33 S0.67 UAs2,tP6,129 P4/nmm 0.362,0.362,0.805,90,90,90 - gray 9.43 A 4537
As-Hf-Se HfAs1.69 Se 0.21 UAs2,tP6,129 P4/nmm 0.37084,0.37084,0.80496,90,90,90 - gray 9.65 X 49717
As-Hf-Si HfSi0.5 As1.5 UAs2,tP6,129 P4/nmm 0.3641,0.3641,0.8155,90,90,90 - - 9.37 X 49031
As-Hf-Te HfAs1.33 Te 0.67 UAs2,tP6,129 P4/nmm 0.374,0.374,0.818,90,90,90 - gray 10.55 A 4537
As-Hf-Ti Hf0.84 Ti1.16 As TiNiSi,oP12,62 Pnma 0.6843,0.36134,0.8322,90,90,90 AlB2 family - 9.05 X 42866
As-Hf-V Hf0.92 V1.08 As TiNiSi,oP12,62 Pnma 0.6697,0.35706,0.8021,90,90,90 AlB2 family - 10.19 X 42866
As-Hg-I Hg4AsI5 Hg4AsI5,oS80,64 Cmce 1.1927,1.2128,1.9766,90,90,90 - red 7.02 X 47399
As-Hg-I Hg4As2I3 Cd4As2I3,cP72,205 Pa-3 1.2999,1.2999,1.2999,90,90,90 - black 8.06 X 23039
As-Hg-K KHgAs BeZrSi,hP6,194 P63 /mmc 0.4506,0.4506,0.9976,90,90,120 AlB2 family gray silver 5.96 X 13860
As-Hg-K K4HgAs2 K4CdP 2,hR21,166 R-3m 0.5763,0.5763,2.7696,90,90,120 - black 3.17 X 33935
As-Hg-O HgAsO3 HgAsO3,hP10,162 P-31m 0.48411,0.48411,0.75961,90,90,120 - colorless 6.97 X 38344
As-Hg-O HgAs2O6 PbSb2O6,hP9,162 P-31m 0.48502,0.48502,0.49853,90,90,120 - yellow 7.30 X 38326
As-Hg-O Hg3[AsO4 ] mon1 Hg3[AsO4 ],mP32,14 P121/c1 0.87915,0.50699,1.44859,90,122.408,90 - brown 9.03 X 44115
As-Hg-O Hg3[AsO4 ] mon2 Hg3[AsO4 ],mP64,14 P121/c1 1.02034,0.85875,1.35172,90,101.016,90 - yellow 8.46 X 44115
As-Hg-O Hg3[AsO4 ]2 Cd3[AsO4 ]2,mP52,14 P121/c1 1.00049,1.17555,0.65374,90,99.687,90 - yellow 7.71 X 27057
As-Hg-O Hg4[As2O7] Hg4[As2O7],oP52,62 Pnma 0.99803,1.22039,0.72374,90,90,90 - yellow 8.02 X 43961
As-Hg-O Hg9[AsO4 ]4 Hg9[AsO4 ]4,hR174,161 R3c 1.6603,1.6603,1.083,90,90,120 - - 9.10 X 33976
As-Hg-Pd Hg0.25Pd2As0.75 Fe2P,hP9,189 P-62m 0.6813,0.6813,0.34892,90,90,120 atheneite black gray 11.34 X 53876
As-Hg-Pd Hg1.5 Pd5As0.5 TlPd5As,tP7,123 P4/mmm 0.399,0.399,0.695,90,90,90 - - 13.06 A 5603
As-Hg-S HgAsS2 HgAsS2,cI54,217 I-43m 1.0422,1.0422,1.0422,90,90,90 galkhaite orange 5.98 X 8989
As-Ho-Ni HoNiAs YPtAs,hP12,194 P63 /mmc 0.4036,0.4036,1.5166,90,90,120 AlB2 family - 9.27 A 39663
As-Ho-Ni HoNi4As2 ZrFe4Si2,tP14,136 P42 /mnm 0.7225,0.7225,0.3756,90,90,90 - black 9.31 A 34999
As-Ho-Ni Ho10Ni21As15.5 Eu10Ni21As15.5 ,hP92,176 P63 /m 2.1048,2.1048,0.38861,90,90,120 - - 9.01 A 52547
As-Ho-Ni Ho2NiAs2 ht Ho2NiAs2 ,hP10,194 P63 /mmc 0.4091,0.4091,1.3857,90,90,120 - - 8.90 X 21646
As-Ho-Ni Ho2NiAs2 rt Tm2NiAs2 ,hP10,186 P63 mc 0.4095,0.4095,1.3864,90,90,120 - - 8.88 A 39663
As-Ho-Ni Ho2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.935,0.935,0.3805,90,90,120 - black 8.99 A 34999
As-Ho-Ni Ho7Ni19As13 Zr6Ni20P 13 ,hP39,174 P-6 1.3083,1.3083,0.3843,90,90,120 - - 9.46 A 18213
As-Ho-O Ho[AsO4] Zr[SiO4],tI24,141 I41/amd 0.70499,0.70499,0.62928,90,90,90 - - 6.45 X 45650
As-Ho-Pd HoPdAs TiNiSi,oP12,62 Pnma 0.6977,0.4096,0.7856,90,90,90 AlB2 family - 10.24 X 26089
As-Ho-Pt HoPtAs YPtAs,hP12,194 P63 /mmc 0.425,0.425,1.5064,90,90,120 AlB2 family gray 12.26 A 19746
As-Ho-Rh Ho2Rh12As7 Ho2Rh12As7,hP24,176 P63 /m 0.9892,0.9892,0.3859,90,90,120 - grayish 10.61 X 18066
As-Ho-S HoAsS CeAsS,mP12,14 P121/c1 0.37863,1.683,0.54,90,134.372,90 - - 7.34 A 10745
As-Ho-Se HoAsSe CeAsS,mP12,14 P121/c1 0.3873,1.7278,0.5503,90,134.693,90 - - 8.09 A 14806
As-I-La La2AsI2 Ta2CS2,hP5,164 P-3m1 0.43795,0.43795,1.091,90,90,120 - - 5.56 A 49734
As-I-La La3AsI3 Ca3PI3,cI56,214 I4132 1.2533,1.2533,1.2533,90,90,90 - bronze 5.89 X 39490
As-I-S AsI3[S8 ]3 SbI3[S8]3,hR84,160 R3m 2.4739,2.4739,0.4412,90,90,120 - yellow 2.61 X 39828
As-I-S AsSI *,mP12,4 P1211 0.861,0.422,0.995,90,97.2,90 - orange 4.33 N 14079
As-I-Se AsSeI ht *,cF48,210 F4132 1.105,1.105,1.105,90,90,90 - red dark 5.53 N 14079
As-I-Se AsSeI rt AsSeI,mP12,14 P121/c1 0.8839,0.4189,1.27285,90,129.985,90 - red dark 5.16 X 13173
As-I-Sn Sn10.3 As11 I4 Sn10.3 As11 I4,cP128,223 Pm-3n 1.1092,1.1092,1.1092,90,90,90 - - 6.22 X 48141
As-I-Sn Sn24As19.3 I8 *,cF*,* - 2.2179,2.2179,2.2179,90,90,90 - black - N 35749
As-I-Sr Sr2AsI NaFeO2,hR12,166 R-3m 0.46004,0.46004,2.33372,90,90,120 rocksalt family - 4.39 A 8090
As-I-Te AsTeI mon *,mP12,4 P1211 0.8965,0.4042,1.0341,90,90.75,90 - black 5.84 N 14079
As-I-Te As0.5 Te0.5 I0.5 m *,cF*,225 Fm-3m 0.5791,0.5791,0.5791,90,90,90 - black 5.63 N 14079
As-I-Te As5Te7I As5Te4(Te 0.75 I0.25)4,mS26,12 C12/m1 1.45661,0.40353,1.38633,90,110.581,90 - gray 6.07 X 18672
As-In-K K2In2As3 Na2Al2Sb3 ,mP56,14 P121/c1 1.4323,0.7106,1.5795,90,90.3,90 - gray 4.40 X 24940
As-In-K K3In2As3 K3In2As3,oS64,64 Cmce 1.9764,0.6784,1.4871,90,90,90 - gray 3.81 X 25675
As-In-K K6InAs3 K6InAs3,aP44,2 P-1 0.9112,0.913,1.9609,94.5,94.2,119.9 - - 2.73 X 28281
As-In-Na Na3InAs2 Na3InAs2,mP48,14 P121/c1 0.9677,0.7547,1.5731,90,92.6,90 - red 3.86 X 25589
Handbook of Inorganic Substances – Edition 2015 : Data 255

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-In-P InAs0.5 P0.5 ZnS,cF8,216 F-43m 0.5962,0.5962,0.5962,90,90,90 adamantane structure - 5.26 X 19001
As-In-Pd Pd2In0.33 As0.67 ht Fe2P,hP9,189 P-62m 0.681,0.681,0.336,90,90,120 Fe2P family - 11.11 A 5603
As-In-Pd Pd3In0.2 As0.8 m BiF3 ,cF16,225 Fm-3m 0.6103,0.6103,0.6103,90,90,90 b.c.c. family - 11.75 X 23068
As-In-Pd Pd5InAs TlPd5As,tP7,123 P4/mmm 0.3966,0.3966,0.6931,90,90,90 - - 10.99 A 5603
As-In-Pd Pd6In3As *,hP100,* - 0.8842,0.8842,2.1601,90,90,120 - - 12.01 N 5603
As-In-Pt Pt5InAs TlPd5As,tP7,123 P4/mmm 0.3997,0.3997,0.7055,90,90,90 - - 17.17 A 5603
As-In-Rh Rh3In5As2 Ru3Sn7,cI40,229 Im-3m 0.91653,0.91653,0.91653,90,90,90 - - 8.91 A 28840
As-In-S InAsS3 ht *,mS10,12 C12/m1 0.65,0.38,0.93,90,109.,90 - - - N 10129
As-In-S In1.7 As0.3 S3 rt In1.7 As0.3 S3,hP7,164 P-3m1 0.3806,0.3806,0.9044,90,90,120 - red 4.59 X 9527
As-In-S In3AsS3 Fe3O4,cF56,227 Fd-3m 1.0796,1.0796,1.0796,90,90,90 spinel family - 5.44 A 9226
As-In-Sb InSb0.5 As0.5 ZnS,cF8,216 F-43m 0.627,0.627,0.627,90,90,90 adamantane structure - 5.74 X 2219
As-In-Se InAs0.5 Se0.5 ZnS,cF8,216 F-43m 0.6023,0.6023,0.6023,90,90,90 adamantane structure - 5.83 X 1328
As-In-Se InAs0.75 Se0.25 ZnS,cF8,216 F-43m 0.586,0.586,0.586,90,90,90 adamantane structure - 6.30 X 21757
As-In-Se InAs0.95 Se0.05 ZnS,cF8,216 F-43m 0.6042,0.6042,0.6042,90,90,90 adamantane structure - 5.72 X 21757
As-In-Se InAs2Se4 tet1 *,tP*,* - 0.473,0.473,1.182,90,90,90 - - - N 4001
As-In-Se InAs2Se4 tet2 *,t**,* - 0.782,0.782,0.69,90,90,90 - - - N 24012
As-In-Se In0.1 As1.9 Se2.95 As2S3,mP20,14 P121/c1 0.436,0.993,1.28,90,109.1,90 - - 4.91 A 24012
As-In-Se In0.73 As0.2 Se0.8 ZnS,cF8,216 F-43m 0.58,0.58,0.58,90,90,90 adamantane structure - 5.51 X 1445
As-In-Se In0.90 As0.07 Se GaS-a,hP8,194 P63/mmc 0.414,0.414,1.664,90,90,120 - - 5.04 A 24012
As-In-Se In1.9 As0.1 Se3 rt *,hP10,* - 0.397,0.397,1.89,90,90,120 - - - N 11697
As-In-Sr SrIn2As2 EuIn2P 2,hP10,194 P63/mmc 0.42145,0.42145,1.8067,90,90,120 - - 5.58 A 50175
As-In-Te InAs0.5 Te0.5 ZnS,cF8,216 F-43m 0.60702,0.60702,0.60702,90,90,90 adamantane structure - 6.42 X 8286
As-In-Te InAs2Te4 *,hP*,* - 0.672,0.672,0.914,90,90,120 - - - N 21759
As-In-Te In0.05 As1.95 Te3 As2Te3,mS20,12 C12/m1 1.41,0.4,0.96,90,97.,90 - - 6.61 A 21759
As-In-Te In0.667 As0.667 Te0.667 ZnS,cF8,216 F-43m 0.613,0.613,0.613,90,90,90 adamantane structure - 6.10 X 3704
As-In-Te In0.75 As0.25 Te0.75 ZnS,cF8,216 F-43m 0.6123,0.6123,0.6123,90,90,90 adamantane structure - 5.80 X 1328
As-In-Te In0.82 As0.18 Te TlSe,tI16,140 I4/mcm 0.848,0.848,0.73,90,90,90 - - 5.95 A 21759
As-Ir-K KIr2 As2 CeAl2Ga2,tI10,139 I4/mmm 0.4007,0.4007,1.3311,90,90,90 - - 8.91 A 17714
As-Ir-La LaIr2As2 CaBe2Ge2,tP10,129 P4/nmm 0.43146,0.43146,0.9939,90,90,90 - - 12.08 X 58042
As-Ir-Mg Mg4 Ir7As6 U4Re7Si6,cI34,229 Im-3m 0.8082,0.8082,0.8082,90,90,90 - gray 11.91 X 39428
As-Ir-Nd NdIr2As2 CaBe2Ge2,tP10,129 P4/nmm 0.4268,0.4268,0.9905,90,90,90 - - 12.49 A 58042
As-Ir-Pr PrIr2As2 CaBe2Ge2,tP10,129 P4/nmm 0.4279,0.4279,0.9935,90,90,90 - - 12.33 A 58042
As-Ir-Rb RbIr2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4006,0.4006,1.3902,90,90,90 - - 9.23 A 17714
As-Ir-S IrAsS FeS2 ,cP12,205 Pa-3 0.5791,0.5791,0.5791,90,90,90 irarsite - 10.23 A 1975
As-Ir-Se IrAsSe FeS2 ,cP12,205 Pa-3 0.594,0.594,0.594,90,90,90 pyrite-marcasite family - 10.97 A 1975
As-Ir-Sr SrIr2As2 CaBe2Ge2,tP10,129 P4/nmm 0.4458,0.4458,0.9823,90,90,90 - gray steel 10.58 A 49597
As-Ir-Te IrAs0.7 Te1.3 FeS2 ,cP12,205 Pa-3 0.6306,0.6306,0.6306,90,90,90 pyrite-marcasite family - 10.87 A 6345
As-K-Li KLi2As Li2BaSi,oP8,59 Pmmn 0.4458,0.6715,0.627,90,90,90 - gray silver 2.26 X 32448
As-K-Mg KMgAs PbClF,tP6,129 P4/nmm 0.4546,0.4546,0.7716,90,90,90 - red light 2.88 A 12878
As-K-Mn KMnAs PbClF,tP6,129 P4/nmm 0.4415,0.4415,0.782,90,90,90 - black 3.68 X 19704
As-K-Na K2NaAs Li2CuAs,hP8,194 P63/mmc 0.534,0.534,1.049,90,90,120 - gray 2.26 X 35321
As-K-Nb K4.5 NbAs3 K4.5 NbAs3,mP36,14 P121/c1 0.9348,0.9113,1.2798,90,95.98,90 - gray 3.02 X 41590
As-K-Nb K6NbAs5 K6NbAs5,mP114,14 P121/c1 2.5774,0.9335,1.3012,90,101.05,90 - gray dark 3.04 X 40041
As-K-Nb K7NbAs4 K7NbAs4,oP24,31 Pmn21 1.0192,0.9162,0.8306,90,90,90 - red dark 2.85 X 32422
As-K-Ni K2NiAs2 K2PdAs2,oS20,63 Cmcm 0.6607,1.387,0.5745,90,90,90 - yellow 3.62 X 24283
As-K-Ni K2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9429,0.9429,0.3743,90,90,120 - red dark 7.53 X 25611
As-K-O KAsO2 KAsO2,oP16,57 Pbcm 0.7151,0.748,0.5392,90,90,90 - colorless 3.36 X 42509
As-K-O KAsO3 cyclo *,mP*,* - 1.1045,1.224,1.4592,90,102.5,90 - - - N 11855
As-K-O KAsO3 ht2 *,mP*,* - 1.0802,1.239,1.4607,90,102.7,90 - - - N 11855
As-K-O K3[AsO4] K3[AsO4],oS128,66 Cccm 1.0601,1.1352,1.694,90,90,90 - colorless 3.34 X 41100
As-K-O K4[As2O7] *,mP52,* - 1.0705,0.5815,1.4183,90,105.5,90 - - 3.27 N 12710
As-K-O K5As3O10 K5As3O10,oP72,19 P212121 0.797,0.798,1.93,90,90,90 - - 3.14 X 12970
As-K-Pb K5Pb3As3 K5Pb3As3,oP44,62 Pnma 1.9451,1.2164,0.6581,90,90,90 - black 4.44 X 43001
As-K-Pd K2PdAs2 K2PdAs2,oS20,63 Cmcm 0.6536,1.4121,0.6025,90,90,90 - red copper 3.99 X 12859
As-K-Pt K2PtAs2 K2PdAs2,oS20,63 Cmcm 0.6465,1.4106,0.6096,90,90,90 - gray silver 5.06 A 14798
As-K-Rh KRh2As2 Cu2TlSe 2,tI10,139 I4/mmm 0.3987,0.3987,1.3267,90,90,90 - - 6.22 X 14799
As-K-Ru KRu2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4035,0.4035,1.3118,90,90,90 - - 6.08 A 17714
As-K-S K3AsS3 Na3AsS3,cP28,198 P213 0.9374,0.9374,0.9374,90,90,90 - - 2.33 A 11035
As-K-S K3AsS4 K3AsS4,oP32,33 Pna21 0.911,0.928,1.058,90,90,90 - - 2.38 X 7960
As-K-Sb K3Sb0.4 As6.6 K3Sb0.4 As6.6 ,oP168,61 Pbca 1.3102,2.5737,1.5199,90,90,90 - gray 3.42 X 41069
As-K-Sb K3Sb4.5 As2.5 K3As7,oP160,61 Pbca 1.333,2.6042,1.5983,90,90,90 - gray 4.08 X 41069
As-K-Se KAsSe 2 mon KAsSe 2,mS32,9 C1c1 0.775,1.0576,1.26267,90,107.862,90 - - 3.67 X 22087
As-K-Se KAsSe 2 tricl KAsSe 2,aP16,1 P1 0.6554,0.6558,1.26271,100.435,100.461,107.53 - red 3.67 X 21939
As-K-Se K3AsSe 3 Na3AsS3,cP28,198 P213 0.9683,0.9683,0.9683,90,90,90 - yellow 3.14 X 35206
As-K-Se K3AsSe 4 K3VS4,oP32,62 Pnma 0.94169,1.09695,0.97568,90,90,90 - red 3.35 X 59574
As-K-Se K4As2Se5 K4As2Se5,mP44,14 P121/c1 0.76167,2.28733,0.95654,90,122.267,90 - black 3.30 X 59574
As-K-Si KSi3As3 KSi3 As3,oP28,55 Pbam 1.001,1.9139,0.3664,90,90,90 - purple 3.29 X 20040
As-K-Si K2SiAs2 K2ZnO2,oI20,72 Ibam 0.6999,1.3372,0.634,90,90,90 - golden 2.87 X 22273
As-K-Sn KSnAs KSnAs,hP6,186 P63mc 0.4102,0.4102,1.2816,90,90,120 - - 4.14 X 21639
As-K-Sn K2SnAs2 K2SnAs2,oS120,66 Cccm 1.4653,2.5415,0.6953,90,90,90 - black 3.56 X 55455
As-K-Sn K5SnAs3 Na5GeP3,mP36,14 P121/c1 0.9219,0.82988,1.77737,90,121.244,90 - - 3.08 X 38320
As-K-Sn K6Sn3As5 K6Sn3As5,oP56,59 Pmmn 1.0728,1.48,1.0934,90,90,90 - - 3.69 X 21639
As-K-Ta K7TaAs4 K7NbAs4,oP24,31 Pmn21 1.0173,0.9155,0.8305,90,90,90 - red dark 3.24 X 32422
As-K-Te K2AsTe 2 K2AsTe 2,oP40,62 Pnma 1.9981,0.829,0.9081,90,90,90 - gray dark 3.61 X 25658
As-K-Zn KZnAs hex1 LiBaSi,hP3,187 P-6m2 0.4229,0.4229,0.5117,90,90,120 AlB2 family violet 3.76 X 10297
As-K-Zn KZnAs hex2 BeZrSi,hP6,194 P63/mmc 0.423,0.423,1.0234,90,90,120 AlB2 family gray dark 3.76 X 13860
As-K-Zn KZn4As3 KCu4S3,tP8,123 P4/mmm 0.4154,0.4154,1.0159,90,90,90 - - 4.98 A 56388
As-K-Zn K2Zn5As4 K2Zn5As4,oS44,63 Cmcm 1.15758,0.70476,1.16352,90,90,90 - - 4.93 X 58404
256 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-K-Zn K4ZnAs2 K4CdP 2,hR21,166 R-3m 0.57529,0.57529,2.6866,90,90,120 - black 2.40 X 49708


As-K-Zn K4Zn9As14 K4(Zn0.39 As0.61 )23,cP70,223 Pm-3n 1.07173,1.07173,1.07173,90,90,90 clathrate brown 4.84 X 57941
As-La-Ni LaNiAs YPtAs,hP12,194 P63 /mmc 0.4162,0.4162,1.6361,90,90,120 AlB2 family - 7.38 A 39663
As-La-Ni LaNi2As2 ht CaBe2Ge2 ,tP10,129 P4/nmm 0.4254,0.4254,0.947,90,90,90 - - 7.87 X 21623
As-La-Ni LaNi2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.412,0.412,0.9939,90,90,90 - - 8.00 X 21623
As-La-Ni LaNi5As3 LaNi5As3,oP72,62 Pnma 1.1179,0.39133,2.4443,90,90,90 - black 8.16 X 44096
As-La-Ni La10Ni21As15 Sm10Ni20.8 P15,hP98,176 P63 /m 2.1269,2.1269,0.4101,90,90,120 - - 7.74 A 35867
As-La-Ni La3Ni7As5 Ce3Ni7As5 ,oP30,59 Pmmn 0.41765,1.2371,0.9672,90,90,90 - gray 7.99 A 41899
As-La-Ni La6Ni13.4 As9 *,oI*,71 Immm 0.4182,0.969,1.2381,90,90,90 - - - N 35867
As-La-Ni La6Ni20As13 Zr6Ni20P 13 ,hP39,174 P-6 1.3202,1.3202,0.4058,90,90,120 - - 8.08 A 35867
As-La-O La[AsO3] K[ClO3],mP10,11 P121/m1 0.44291,0.5314,0.62283,90,105.564,90 - colorless 6.16 X 59423
As-La-O La[AsO4] Ce[PO4],mP24,14 P121/c1 0.67646,0.72184,0.84305,90,126.458,90 - colorless 5.57 X 45650
As-La-Os LaOs4As12 LaFe4P 12,cI34,204 Im-3 0.8542,0.8542,0.8542,90,90,90 - - 9.58 X 51084
As-La-Pb La5Pb3As CuHf5Sn3,hP18,193 P63 /mcm 0.9553,0.9553,0.7024,90,90,120 AlB2 family - 8.32 A 29066
As-La-Pd LaPdAs BeZrSi,hP6,194 P63 /mmc 0.4388,0.4388,0.7923,90,90,120 AlB2 family - 8.05 X 26089
As-La-Pd LaPd2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4296,0.4296,1.0257,90,90,90 - - 8.80 A 18318
As-La-Pd LaPd3As2 GdPd3As2 ,mS36,12 C12/m1 1.6698,0.415,1.0003,90,108.12,90 - - 9.19 A 30566
As-La-Rh LaRhAs LaPtSi,tI12,109 I41md 0.4187,0.4187,1.495,90,90,90 - - 8.03 X 40255
As-La-Ru LaRu2 As2 CeAl2Ga2,tI10,139 I4/mmm 0.418,0.418,1.0623,90,90,90 - - 8.78 A 20401
As-La-Ru LaRu4 As12 LaFe4P 12,cI34,204 Im-3 0.85081,0.85081,0.85081,90,90,90 - - 7.78 A 13452
As-La-S LaAsS CeAsS,mP12,14 P121/c1 0.40169,1.767,0.57,90,133.866,90 - - 5.60 A 10745
As-La-Si LaSiAs3 orth1 LaSiAs3,oP40,61 Pbca 0.5986,2.6235,0.6084,90,90,90 - black 5.45 X 17372
As-La-Si LaSiAs3 orth2 CeSiP3,oP40,33 Pna21 0.60498,2.6383,0.59545,90,90,90 - - 5.48 X 21366
As-La-Te LaAsTe TiNiSi,oP12,62 Pnma 0.78354,0.41721,1.02985,90,90,90 AlB2 family black 6.74 X 37205
As-La-U La0.4 U0.6 As NaCl,cF8,225 Fm-3m 0.5965,0.5965,0.5965,90,90,90 rocksalt family - 8.55 X 28010
As-La-Zn Zn0.67 LaAs2 SrZnBi2,tI16,139 I4/mmm 0.4077,0.4077,2.0533,90,90,90 - - 6.47 X 56883
As-La-Zn Zn2LaAs3 Zn2LaAs3,tI28,139 I4/mmm 0.41133,0.41133,3.21246,90,90,90 - - 6.04 X 59687
As-La-Zn Zn2La0.67 As2 Ce2SO2,hP5,164 P-3m1 0.418,0.418,0.7093,90,90,120 - black 5.78 A 57506
As-La-Zn Zn3LaAs3 Zn3LaAs3,oP28,62 Pnma 1.25935,0.41054,1.15968,90,90,90 - gray 6.20 X 56276
As-Li-Mg LiMgAs MgAgAs,cF12,216 F-43m 0.619,0.619,0.619,90,90,90 - - 2.97 X 1276
As-Li-Mn LiMnAs LaOF,tP6,129 P4/nmm 0.4267,0.4267,0.6178,90,90,90 - gray 4.04 X 19704
As-Li-Mn Li1.15 MnAs rt Li1.15 MnAs,tP8,129 P4/nmm 0.4257,0.4257,0.6167,90,90,90 - - 4.10 X 4283
As-Li-Mn Li2.35 Mn0.35 As ht BiF3,cF16,225 Fm-3m 0.6167,0.6167,0.6167,90,90,90 b.c.c. family - 3.13 X 4283
As-Li-Mn Li3.225 Mn1.5 As2 rt Li2.7(Li0.5Mn0.5)MnAs2,oP16,49 Pccm 0.6129,0.62,0.5928,90,90,90 - - 3.75 X 4283
As-Li-Mn Li4.15 MnAs2 rt Li2.15 (Li0.67 Mn0.33)3As2,tP16,132 P42 /mcm 0.6178,0.6178,0.6042,90,90,90 - - 3.36 X 4283
As-Li-Mn Li7.93 Mn2.2 As4 rt *,cP*,* - 0.6125,0.6125,0.6125,90,90,90 - - - N 4283
As-Li-Nb Li0.5 Nb0.5As ZnS,cF8,216 F-43m 0.6309,0.6309,0.6309,90,90,90 adamantane structure - 3.30 X 39088
As-Li-Nd Li2NdAs2 Ce2SO2,hP5,164 P-3m1 0.4287,0.4287,0.6922,90,90,120 - blackish 4.64 X 13866
As-Li-Nd Li3NdAs2 Li3LaSb2,hP6,164 P-3m1 0.4287,0.4287,0.6922,90,90,120 - - 4.75 X 17606
As-Li-Ni Li3.2 Ni10.8 As7 Zr2Fe12P 7,hP21,174 P-6 0.9386,0.9386,0.3701,90,90,120 - gray silver 6.94 X 25620
As-Li-O LiAsO3 hp TiFeO3,hR30,148 R-3 0.4808,0.4808,1.421,90,90,120 - - 4.55 X 22525
As-Li-O LiAsO3 LiAsO3,mS40,15 C12/c1 1.018,0.943,0.525,90,110.53,90 - - 3.66 X 752
As-Li-O Li3[AsO4] ht Li3[AsO4],oP36,62 Pnma 1.09076,0.63694,0.51488,90,90,90 - - 2.97 X 29083
As-Li-O Li3[AsO4] rt Cu3AsS4,oP16,31 Pmn21 0.62856,0.53902,0.49616,90,90,90 adamantane structure - 3.16 X 27902
As-Li-O Li4[As2O7 ] Li4[As2O7 ],aP26,2 P-1 0.52851,0.78547,0.81613,63.609,89.592,89.481 - - 3.17 X 59439
As-Li-Pr Li2PrAs2 Ce2SO2,hP5,164 P-3m1 0.4299,0.4299,0.696,90,90,120 - blackish 4.54 X 13866
As-Li-S LiAsS2 LiAsSe2,mS16,9 C1c1 1.1847,0.54076,0.53508,90,113.25,90 - - 3.08 X 49795
As-Li-S Li3AsS3 Li3AsS3,oP28,33 Pna21 0.8052,0.6632,0.9815,90,90,90 - colorless 2.43 X 34088
As-Li-Se LiAsSe2 m LiAsSe2,aP8,2 P-1 0.555,0.5577,0.558,92.7,91.5,90.8 - black 4.62 X 54451
As-Li-Se LiAsSe2 LiAsSe2,mS16,9 C1c1 1.22872,0.55419,0.55533,90,113.117,90 - black 4.58 X 54451
As-Li-Si Li1.67 Si0.33 As CaF2,cF12,225 Fm-3m 0.605,0.605,0.605,90,90,90 fluorite family black gray 2.87 X 642
As-Li-Ti Li1.67 Ti0.33 As CaF2,cF12,225 Fm-3m 0.615,0.615,0.615,90,90,90 fluorite family black 2.92 X 642
As-Li-Ti Li2.20 Ti0.20 As BiF3,cF16,225 Fm-3m 0.6132,0.6132,0.6132,90,90,90 b.c.c. family - 2.87 X 25521
As-Li-Ti Li8TiAs4 *,c*104,* - 1.2169,1.2169,1.2169,90,90,90 - - 2.97 N 4302
As-Li-V Li1.135 V0.305 As MgAgAs,cF12,216 F-43m 0.6167,0.6167,0.6167,90,90,90 - - 2.78 X 39088
As-Li-V Li1.75 V0.25 As CaF2,cF12,225 Fm-3m 0.6162,0.6162,0.6162,90,90,90 fluorite family - 2.83 X 920
As-Li-V Li2.35 V0.35 As BiF3,cF16,225 Fm-3m 0.6146,0.6146,0.6146,90,90,90 b.c.c. family black 3.12 X 4302
As-Li-Yb LiYbAs TiNiSi,oP12,62 Pnma 0.723,0.4328,0.7881,90,90,90 AlB2 family black 6.87 A 33892
As-Li-Zn LiZnAs cub1 CaF2,cF12,225 Fm-3m 0.594,0.594,0.594,90,90,90 fluorite family gray 4.67 X 20591
As-Li-Zn LiZnAs cub2 MgAgAs,cF12,216 F-43m 0.5939,0.5939,0.5939,90,90,90 - gray 4.67 X 28360
As-Li-Zr Li2.44 Zr0.145 As BiF3,cF16,225 Fm-3m 0.62,0.62,0.62,90,90,90 b.c.c. family - 2.93 X 25521
As-Lu-Ni LuNi4As2 ZrFe4Si2,tP14,136 P42 /mnm 0.7191,0.7191,0.375,90,90,90 - black 9.58 A 22394
As-Lu-Ni Lu13Ni25As19 Tm13Ni25As19,hP57,174 P-6 1.6209,1.6209,0.38605,90,90,120 - black 9.77 A 39483
As-Lu-Ni Lu2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9377,0.9377,0.371,90,90,120 - black 9.28 A 14272
As-Lu-O Lu[AsO4] Zr[SiO4],tI24,141 I41/amd 0.6949,0.6949,0.6227,90,90,90 - - 6.93 X 7108
As-Lu-Pd LuPdAs ZrNiAl,hP9,189 P-62m 0.6971,0.6971,0.3891,90,90,120 Fe2P family - 10.84 A 26089
As-Lu-Pt LuPtAs YPtAs,hP12,194 P63 /mmc 0.4225,0.4225,1.4759,90,90,120 AlB2 family gray 12.95 A 19746
As-Lu-Se LuAsSe CeAsS,mP12,14 P121/c1 0.3834,1.7092,0.54403,90,134.759,90 - - 8.63 A 14806
As-Mg-Mn Mg2MnAs2 Ce2SO2,hP5,164 P-3m1 0.4209,0.4209,0.6694,90,90,120 - - 4.10 X 2408
As-Mg-Na NaMgAs PbClF,tP6,129 P4/nmm 0.4417,0.4417,0.713,90,90,90 - reddish 2.92 X 32575
As-Mg-Ni MgNi1.5 As0.5 MgCu2,cF24,227 Fd-3m 0.6886,0.6886,0.6886,90,90,90 Friauf-Laves phase gray 6.10 X 26952
As-Mg-Ni Mg6Ni16As7 Mg6Cu16Si7,cF116,225 Fm-3m 1.1479,1.1479,1.1479,90,90,90 - gray 7.07 X 31230
As-Mg-O Mg2[As2O7] Sc2[Si2O7],mS22,12 C12/m1 0.6567,0.8524,0.4739,90,103.8,90 - - 4.00 X 5193
As-Mg-O Mg4.5 [AsO4]3 Mg4.5 [AsO4]3,tI80,122 I-42d 0.6783,0.6783,1.8963,90,90,90 - - 4.01 X 7164
As-Mg-O Mg8.5 As3O16 Co8As3O16 ,hR84,166 R-3m 0.60278,0.60278,2.76,90,90,120 - - 3.95 X 7576
As-Mg-Pd Mg0.25Pd2 As0.75 Fe2P,hP9,189 P-62m 0.672,0.672,0.335,90,90,120 Fe2P family - 10.46 A 5603
As-Mg-Pt MgPt5As TlPd5As,tP7,123 P4/mmm 0.3912,0.3912,0.689,90,90,90 - - 16.93 A 5603
As-Mg-Rh MgRh6As4 LiCo 6P 4,hP11,187 P-6m2 0.7271,0.7271,0.3612,90,90,120 - gray light 9.45 X 36645
Handbook of Inorganic Substances – Edition 2015 : Data 257

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Mg-Rh Mg4 Rh7As6 U4Re7Si6,cI34,229 Im-3m 0.8066,0.8066,0.8066,90,90,90 - gray 8.02 X 39428


As-Mg-Si MgSiAs2 CuFeS2,tI16,122 I-42d 0.588,0.588,1.053,90,90,90 adamantane structure - 3.69 A 16073
As-Mg-Sr SrMg2As2 Ce2SO2,hP5,164 P-3m1 0.441,0.441,0.741,90,90,120 - brown red 3.81 A 11115
As-Mn-Mo Mo0.03Mn0.97 As rt FeAs,oP8,62 Pnma 0.57304,0.36311,0.63311,90,90,90 AlB2 family - 6.61 X 16801
As-Mn-Mo Mo0.05Mn0.95 As *,oS32,20 C222 1 0.723,1.266,0.535,90,90,90 - - - N 6576
As-Mn-N Mn3 AsN ZnMn3C,tP5,123 P4/mmm 0.4089,0.4089,0.4185,90,90,90 - - 6.02 X 5472
As-Mn-Na NaMnAs MnAlGe,tP6,129 P4/nmm 0.4206,0.4206,0.7077,90,90,90 - gray 4.05 X 14690
As-Mn-Ni MnNiAs hex ZrNiAl,hP9,189 P-62m 0.6195,0.6195,0.3726,90,90,120 Fe2P family - 7.59 A 15560
As-Mn-Ni MnNiAs orth TiNiSi,oP12,62 Pnma 0.624,0.3794,0.7063,90,90,90 AlB2 family - 7.49 A 6164
As-Mn-Ni MnNi1.7 As0.3 MgCu2,cF24,227 Fd-3m 0.67513,0.67513,0.67513,90,90,90 Friauf-Laves phase - 7.65 X 36532
As-Mn-Ni Mn0.5 Ni0.5 As ht NiAs,hP4,194 P63/mmc 0.3647,0.3647,0.5535,90,90,120 AlB2 family - 6.86 X 19207
As-Mn-Ni Mn0.95 Ni0.05 As lt FeAs,oP8,62 Pnma 0.56592,0.36375,0.6334,90,90,90 AlB2 family - 6.63 X 11160
As-Mn-Ni Mn1.4 Ni0.6 As Cu2Sb,tP6,129 P4/nmm 0.377,0.377,0.6155,90,90,90 - - 7.10 A 31661
As-Mn-Ni Mn6 Ni16As7 Mg6 Cu16Si7,cF116,225 Fm-3m 1.14,1.14,1.14,90,90,90 - - 8.04 X 17397
As-Mn-O MnAs2O6 PbSb2O6,hP9,162 P-31m 0.47956,0.47956,0.46923,90,90,120 - - 5.34 X 30667
As-Mn-O Mn[AsO4] Mn[AsO4],mP24,14 P121/c1 0.47914,0.89303,0.79602,90,123.099,90 - - 4.51 X 27291
As-Mn-O Mn2 [As2O7] Sc2[Si2O7],mS22,12 C12/m1 0.67454,0.87561,0.48004,90,102.723,90 - pink light 4.46 X 53853
As-Mn-O Mn3 [AsO4]2 *,hP208,* - 1.296,1.296,1.599,90,90,120 - - 5.06 N 38019
As-Mn-P MnAs0.9 P0.1 ht2 NiAs,hP4,194 P63/mmc 0.3666,0.3666,0.5722,90,90,120 AlB2 family - 6.26 X 19300
As-Mn-P MnAs0.92P 0.08 rt FeAs,oP8,62 Pnma 0.56218,0.3563,0.62567,90,90,90 AlB2 family - 6.70 X 17173
As-Mn-P MnAs0.95P 0.05 rt NiAs,hP4,194 P63/mmc 0.363,0.363,0.5695,90,90,120 AlB2 family - 6.52 X 28011
As-Mn-P Mn2 As0.3P 0.7 Fe2P,hP9,189 P-62m 0.6172,0.6172,0.3487,90,90,120 Fe2P family - 6.67 A 8450
As-Mn-P Mn2 As0.8P 0.2 Cu2Sb,tP6,129 P4/nmm 0.3786,0.3786,0.6261,90,90,90 - - 6.51 A 8450
As-Mn-Pd MnPdAs ZrNiAl,hP9,189 P-62m 0.6621,0.6621,0.3759,90,90,120 Fe2P family - 8.25 A 24777
As-Mn-Pd MnPd2As m BiF3 ,cF16,225 Fm-3m 0.6187,0.6187,0.6187,90,90,90 b.c.c. family - 9.61 X 23068
As-Mn-Rb RbMnAs PbClF,tP6,129 P4/nmm 0.4426,0.4426,0.8108,90,90,90 - gray 4.50 X 36632
As-Mn-Rh MnRhAs ZrNiAl,hP9,189 P-62m 0.6481,0.6481,0.3715,90,90,120 Fe2P family - 8.58 X 17400
As-Mn-Ru MnRuAs ZrNiAl,hP9,189 P-62m 0.6518,0.6518,0.3619,90,90,120 Fe2P family - 8.64 A 24777
As-Mn-Sb MnSb0.3 As0.7 NiAs,hP4,194 P63/mmc 0.38,0.38,0.5782,90,90,120 AlB2 family - 6.61 X 24776
As-Mn-Sb Mn2 Sb0.7 As0.3 Cu2Sb,tP6,129 P4/nmm 0.402,0.402,0.644,90,90,90 - - 6.94 X 1678
As-Mn-Se MnAs2Se4 *,t*14,* - 0.872,0.872,0.59,90,90,90 - - 3.85 N 11847
As-Mn-Se Mn3 As2Se6 *,t*66,* - 1.363,1.363,0.853,90,90,90 - - 4.96 N 11847
As-Mn-Sr SrMn2As2 Ce2SO2,hP5,164 P-3m1 0.4306,0.4306,0.7315,90,90,120 - black gray 4.91 X 12026
As-Mn-Sr Sr14 MnAs11 Ca14 AlSb11,tI208,142 I41/acd 1.6576,1.6576,2.2167,90,90,90 - - 4.59 A 28583
As-Mn-Te MnAs2Te4 *,t**,* - 0.884,0.884,0.6,90,90,90 - - - N 11390
As-Mn-Te Mn3 As2Te6 *,hR*,* - 1.389,1.389,0.832,90,90,120 - - - N 11390
As-Mn-Ti TiMnAs ZrNiAl,hP9,189 P-62m 0.64044,0.64044,0.3579,90,90,120 Fe2P family - 6.97 A 7673
As-Mn-V VMnAs MnAlGe,tP6,129 P4/nmm 0.3722,0.3722,0.6483,90,90,90 - - 6.69 A 6909
As-Mn-V V0.10 Mn0.90 As rt FeAs,oP8,62 Pnma 0.571,0.3601,0.6318,90,90,90 AlB2 family - 6.62 X 9514
As-Mn-V V0.20 Mn0.80 As ht NiAs,hP4,194 P63/mmc 0.3681,0.3681,0.5862,90,90,120 AlB2 family - 6.23 X 9514
As-Mn-Yb YbMn2As2 Ce2SO2,hP5,164 P-3m1 0.4226,0.4226,0.6964,90,90,120 - black 6.67 X 12612
As-Mn-Zn ZnMn2As2 Ce2SO2,hP5,164 P-3m1 0.4099,0.4099,0.6572,90,90,120 - - 5.65 X 25434
As-Mn-Zn Zn0.1 Mn1.9 As Cu2Sb,tP6,129 P4/nmm 0.3779,0.3779,0.6275,90,90,90 - - 6.89 A 31661
As-Mn-Zn Zn0.7 Mn0.3 As2 ZnAs2,mP24,14 P121/c1 0.928,0.768,0.803,90,102.3,90 - - 5.04 A 35999
As-Mn-Zn Zn2.76 Mn0.24 As2 Cd3As2,tI160,110 I41cd 1.18001,1.18001,2.36538,90,90,90 - - 5.54 X 22708
As-Mo-Ni Mo0.8 Ni1.2 As Fe2P,hP9,189 P-62m 0.6052,0.6052,0.3744,90,90,120 Fe2P family - 9.32 A 10865
As-Mo-Ni Mo2 Ni0.83 As3 Mo2 NiAs3,mS24,12 C12/m1 1.3029,0.3327,0.8742,90,105.32,90 - black 8.46 X 9310
As-Mo-O Mo[AsO3][AsO4] Mo[AsO3][AsO4],mP40,14 P121/c1 0.7788,0.455,1.66492,90,107.354,90 - yellow 4.22 X 27048
As-Mo-P MoAs0.43P 1.57 MoP 2,oS12,36 Cmc21 0.3164,1.1313,0.5053,90,90,90 - - 6.49 A 16363
As-Mo-P MoAs1.62P 0.38 OsGe 2,mS12,12 C12/m1 0.8975,0.3276,0.7675,90,119.54,90 - - 7.75 A 16363
As-Mo-Ti Ti0.45 Mo0.55 As2 OsGe 2,mS12,12 C12/m1 0.9158,0.33172,0.76666,90,119.496,90 - - 7.35 X 48392
As-Mo-Ti Ti0.5 Mo0.5 As FeAs,oP8,62 Pnma 0.6023,0.3414,0.6431,90,90,90 AlB2 family - 7.38 A 2746
As-Mo-Ti Ti0.8 Mo0.2 As NiAs,hP4,194 P63/mmc 0.359,0.359,0.62,90,90,120 AlB2 family - 6.36 X 2746
As-Mo-Ti Ti2MoAs2 V3 As2,tP20,83 P4/m 0.9706,0.9706,0.3451,90,90,90 - - 6.98 X 47105
As-Mo-Ti Ti3MoAs3 V4 As3,mS28,12 C12/m1 1.4107,0.35148,0.9522,90,100.66,90 - - 6.65 X 47105
As-Mo-Ti Ti3.68 Mo1.32 As3 Y5Bi3,oP32,62 Pnma 0.6659,0.7853,0.9704,90,90,90 - - 6.91 X 40193
As-Mo-V V0.5 Mo0.5As FeAs,oP8,62 Pnma 0.589,0.337,0.636,90,90,90 AlB2 family - 7.81 A 6576
As-N-U U2AsN2 Ce2SO2,hP5,164 P-3m1 0.3833,0.3833,0.6737,90,90,120 - - 11.22 X 4419
As-N-V V3 AsN Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.313,1.018,0.759,90,90,90 - - 6.64 A 4188
As-Na-Ni Na2.3 Ni11.7As7 Zr2Fe12P 7,hP21,174 P-6 0.9425,0.9425,0.3748,90,90,120 - gray silver 7.28 X 25620
As-Na-O NaAsO2 NaAsO2,oP32,61 Pbca 0.50901,1.43098,0.67762,90,90,90 - colorless 3.50 X 42603
As-Na-O NaAsO3 NaAsO3,aP30,2 P-1 0.732,0.744,0.807,104.,91.5,90. - - 3.41 X 749
As-Na-O Na2As4O11 rt Na2As4O11,mS68,15 C12/c1 0.9049,0.8287,1.1508,90,102.74,90 - - 4.12 X 21012
As-Na-O Na3[AsO4] ht1 Li3[AsO4],oP36,62 Pnma 1.197,0.705,0.557,90,90,90 - - 2.94 A 5829
As-Na-O Na3[AsO4] ht2 Na3[PO4],cF396,225 Fm-3m 0.7669,0.7669,0.7669,90,90,90 - - 3.06 A 5793
As-Na-O Na3[AsO4] rt *,oP16,31 Pmn21 0.7051,0.6038,0.5531,90,90,90 - - - N 5829
As-Na-O Na4[As2O7] Na4[As2O7],mS52,15 C12/c1 0.5969,1.0126,1.2272,90,92.87,90 - - 3.17 X 7341
As-Na-O Na5[AsO4]O Na5[AsO4]O,oP44,57 Pbcm 0.5964,1.6433,0.6421,90,90,90 - red light 2.85 X 39419
As-Na-O Na7As11O31 Na7As11O31,hP52,164 P-3m1 1.1199,1.1199,0.5412,90,90,120 - colorless 4.18 X 47014
As-Na-S NaAsS2 NaAsS2,mP16,14 P121/c1 0.5867,1.1305,0.5586,90,92.95,90 - orange 2.91 X 11093
As-Na-S Na3AsS3 Na3AsS3,cP28,198 P213 0.8573,0.8573,0.8573,90,90,90 - amber 2.53 X 11035
As-Na-S Na3AsS4 *,tP*,137 P42/nmc 0.704,0.704,0.714,90,90,90 - - - N 11382
As-Na-Sb NaSb0.49 As0.51 LiAs,mP16,14 P121/c1 0.6404,0.6046,1.1853,90,117.05,90 - gray 3.93 X 41065
As-Na-Se NaAsSe 2 mon NaAsSe 2,mP32,7 P1c1 1.1682,0.59021,1.18231,90,90.446,90 - red 4.17 X 54451
As-Na-Se NaAsSe 2 orth NaAsSe 2,oP64,61 Pbca 0.583,2.427,1.182,90,90,90 - red 4.06 X 12822
As-Na-Se Na0.5 As0.5 Se hp NaCl,cF8,225 Fm-3m 0.5872,0.5872,0.5872,90,90,90 rocksalt family gray 4.20 X 12822
As-Na-Se Na3AsSe 3 Na3AsS3,cP28,198 P213 0.8952,0.8952,0.8952,90,90,90 - yellow 3.53 X 35206
As-Na-Si Na5SiAs3 Na5GeP3,mP36,14 P121/c1 0.8177,0.7529,1.5815,90,121.632,90 - red 2.95 X 25662
258 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Na-Sn NaSn2 As2 NaSn2 As2 ,hR15,166 R-3m 0.4006,0.4006,2.7581,90,90,120 - - 5.33 X 31096
As-Na-Sn Na2SnAs2 Na2SnAs2 ,tI160,142 I41/acd 1.4166,1.4166,2.1191,90,90,90 - - 3.93 X 28356
As-Na-Sn Na5SnAs3 KNa4SnSb3,mP36,14 P121/c1 0.8527,0.7642,1.61125,90,121.652,90 - - 3.41 X 25623
As-Na-Sr NaSrAs Fe2P,hP9,189 P-62m 0.7829,0.7829,0.4585,90,90,120 Fe2P family black 3.80 X 33869
As-Na-Sr Na2Sr3As4 Na2Sr3P4,oP36,62 Pnma 0.7514,1.5642,0.823,90,90,90 - gray 4.18 X 31730
As-Na-Te Na2AsTe2 Na2AsTe2 ,oP40,19 P212121 0.8714,0.9819,1.3988,90,90,90 - black 4.17 X 25659
As-Na-Ti Na8TiAs4 Na8SnSb4,cF104,227 Fd-3m 1.3767,1.3767,1.3767,90,90,90 - black blue 2.71 X 28365
As-Na-Zn NaZnAs cub MgAgAs,cF12,216 F-43m 0.5912,0.5912,0.5912,90,90,90 - gray 5.25 X 394
As-Na-Zn NaZnAs tet PbClF,tP6,129 P4/nmm 0.4176,0.4176,0.7088,90,90,90 - blue gray 4.39 A 10297
As-Na-Zn NaZn4 As3 RbCd4As3 ,hR24,166 R-3m 0.41694,0.41694,3.286,90,90,120 - golden 5.13 X 56388
As-Nb-Ni NbNiAs TiNiSi,oP12,62 Pnma 0.6242,0.3721,0.719,90,90,90 AlB2 family - 9.01 A 3421
As-Nb-Ni NbNiAs2 NbNiP 2,oP16,62 Pnma 0.5624,0.351,1.2496,90,90,90 - - 8.12 X 15979
As-Nb-O Nb[AsO4]O Mo[PO4]O,tP14,85 P4/n 0.657,0.657,0.408,90,90,90 - - 4.67 A 12367
As-Nb-O Nb9AsO25 Nb9PO25,tI74,87 I4/m 1.56684,1.56684,0.3829,90,90,90 - colorless 4.63 X 34086
As-Nb-Pd Nb5Pd4As4 Cu4Nb5Si4 ,tI26,87 I4/m 1.04457,1.04457,0.37868,90,90,90 - black 9.56 X 41894
As-Nb-Pd Nb9PdAs7 Nb9PdAs7 ,hP51,174 P-6 1.66955,1.66955,0.35582,90,90,120 - - 8.51 X 38703
As-Nb-Rb Rb6NbAs5 K6NbAs5,mP114,14 P121/c1 2.7629,0.9925,1.4111,90,101.63,90 - gray dark 3.44 A 40041
As-Nb-Rb Rb7NbAs4 K7NbAs4,oP24,31 Pmn21 1.0592,0.9528,0.8604,90,90,90 - red dark 3.79 X 32422
As-Nb-Si NbSiAs PbClF,tP6,129 P4/nmm 0.34914,0.34914,0.79005,90,90,90 - - 6.76 X 58137
As-Nb-Sr Sr13NbAs11 Sr14GaAs11,tI216,142 I41/acd 1.6498,1.6498,2.2141,90,90,90 - gray 4.53 X 32467
As-Nb-Ta TaNb2 As TaNb2 As,tP48,86 P42 /n 1.0308,1.0308,0.5148,90,90,90 - - 10.73 X 12092
As-Nb-Te Nb3AsTe3 Nb3AsTe3 ,hP14,176 P63 /m 1.04058,1.04058,0.35684,90,90,120 - - 7.31 X 30238
As-Nd-Ni NdNiAs hex1 LiBaSi,hP3,187 P-6m2 0.4115,0.4115,0.3955,90,90,120 AlB2 family - 7.96 X 35867
As-Nd-Ni NdNiAs hex2 YPtAs,hP12,194 P63 /mmc 0.4117,0.4117,1.5815,90,90,120 AlB2 family - 7.95 A 39663
As-Nd-Ni NdNi2As2 ht CaBe2Ge2 ,tP10,129 P4/nmm 0.41947,0.41947,0.9377,90,90,90 - - 8.28 X 21303
As-Nd-Ni NdNi2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.4039,0.4039,0.988,90,90,90 - - 8.48 A 21623
As-Nd-Ni Nd10Ni21As15 Sm10Ni20.8 P15,hP98,176 P63 /m 2.1135,2.1135,0.3995,90,90,120 - - 8.16 A 35867
As-Nd-Ni Nd2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9386,0.9386,0.3871,90,90,120 - black 8.53 A 14272
As-Nd-Ni Nd3Ni7As5 Ce3Ni7As5 ,oP30,59 Pmmn 0.41002,1.2133,0.9616,90,90,90 - gray 8.46 A 41899
As-Nd-Ni Nd6Ni13.4 As9 *,oI*,71 Immm 0.4111,0.9667,1.2256,90,90,90 - - - N 35867
As-Nd-Ni Nd7Ni19As13 Zr6Ni20P 13 ,hP39,174 P-6 1.3193,1.3193,0.3949,90,90,120 - - 8.65 A 18213
As-Nd-O Nd[AsO4] mon Ce[PO4],mP24,14 P121/c1 0.66852,0.70885,0.82763,90,126.402,90 - - 5.96 X 45650
As-Nd-O Nd[AsO4] tet Ca[WO4],tI24,88 I41/a 0.5102,0.5102,1.159,90,90,90 - - 6.23 A 21232
As-Nd-O Nd2As4O9 Nd2As4O9 ,aP30,2 P-1 0.68632,0.76306,0.9548,96.83,103.78,104.4 - violet light 5.26 X 45840
As-Nd-Os NdOs4As12 LaFe4P 12,cI34,204 Im-3 0.85291,0.85291,0.85291,90,90,90 - - 9.66 A 13452
As-Nd-Pd NdPdAs lt NdPtSb,hP6,186 P63 mc 0.4338,0.4338,0.7652,90,90,120 AlB2 family - 8.67 X 26089
As-Nd-Pd NdPdAs rt BeZrSi,hP6,194 P63 /mmc 0.4345,0.4345,0.7675,90,90,120 AlB2 family - 8.62 X 26089
As-Nd-Pd NdPd2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4219,0.4219,1.0278,90,90,90 - - 9.20 A 18318
As-Nd-Pd NdPd3As2 GdPd3As2 ,mS36,12 C12/m1 1.6601,0.4091,0.9954,90,108.,90 - - 9.50 A 30566
As-Nd-Rh NdRh2As2 CaBe2Ge2 ,tP10,129 P4/nmm 0.424,0.424,0.9859,90,90,90 - - 9.37 A 20220
As-Nd-S NdAsS CeAsS,mP12,14 P121/c1 0.38901,1.722,0.555,90,134.184,90 - - 6.26 A 10745
As-Nd-Se NdAsSe CeAsS,mP12,14 P121/c1 0.40358,1.7645,0.57078,90,134.996,90 - golden pale 6.89 X 14806
As-Nd-Zn Zn0.67 NdAs2 CuHfSi2,tP8,129 P4/nmm 0.3989,0.3989,1.0163,90,90,90 - - 6.94 A 56883
As-Nd-Zn Zn2Nd0.67 As2 Ce2SO2,hP5,164 P-3m1 0.4162,0.4162,0.6941,90,90,120 - black 6.02 A 57506
As-Nd-Zn Zn3NdAs3 Zn3PrAs3,hP22,194 P63 /mmc 0.41655,0.41655,2.04267,90,90,120 - gray 6.11 X 56276
As-Ni-O NiAs2O4 ZnSb2O4,tP28,135 P42 /mbc 0.822,0.822,0.562,90,90,90 adamantane structure - 4.77 A 235
As-Ni-O NiAs2O6 PbSb2O6,hP9,162 P-31m 0.47585,0.47585,0.44349,90,90,120 - - 5.82 X 30667
As-Ni-O Ni2[As2O7 ] ht Sc2[Si2O7],mS22,12 C12/m1 0.65391,0.85007,0.47437,90,103.19,90 - - 4.91 X 23731
As-Ni-O Ni2[As2O7 ] rt Ni2[As2O7 ],aP33,1 P1 0.5297,0.75737,1.01615,72.871,75.755,85.154 - orange 5.00 X 53853
As-Ni-O Ni3[AsO4]2 orth Ni3[VO4]2 ,oS52,64 Cmce 0.5943,1.1263,0.8164,90,90,90 - green 5.52 X 24515
As-Ni-O Ni3[AsO4]2 xan Co3[AsO4 ]2,mP52,14 P121/c1 0.5764,0.9559,1.0194,90,92.95,90 xanthiosite green 5.38 X 24515
As-Ni-O Ni8.5 As3O16 Co8As3O16 ,hR84,166 R-3m 0.59511,0.59511,2.75675,90,90,120 aerugite green dark 5.77 X 22157
As-Ni-Pd NiPdAs ht HfRhSn,hP18,190 P-62c 0.63165,0.63165,0.74278,90,90,120 majakite - 9.32 X 37884
As-Ni-Pd Ni0.94Pd0.06 As rt NiAs,hP4,194 P63 /mmc 0.3631,0.3631,0.5097,90,90,120 AlB2 family - 7.79 X 17699
As-Ni-Pr PrNiAs hex1 LiBaSi,hP3,187 P-6m2 0.4113,0.4113,0.3981,90,90,120 AlB2 family - 7.82 X 35867
As-Ni-Pr PrNiAs hex2 YPtAs,hP12,194 P63 /mmc 0.4127,0.4127,1.5953,90,90,120 AlB2 family - 7.75 A 39663
As-Ni-Pr PrNi2As2 ht CaBe2Ge2 ,tP10,129 P4/nmm 0.4186,0.4186,0.9427,90,90,90 - - 8.21 A 21623
As-Ni-Pr PrNi2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.4063,0.4063,0.9881,90,90,90 - - 8.31 A 21623
As-Ni-Pr Pr10Ni21As15 Sm10Ni20.8 P15,hP98,176 P63 /m 2.1133,2.1133,0.4,90,90,120 - - 8.08 A 35867
As-Ni-Pr Pr2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9403,0.9403,0.3889,90,90,120 - black 8.42 A 14272
As-Ni-Pr Pr3Ni7As5 Ce3Ni7As5 ,oP30,59 Pmmn 0.41217,1.2301,0.963,90,90,90 - gray 8.22 A 41899
As-Ni-Pr Pr7Ni19As13 Zr6Ni20P 13 ,hP39,174 P-6 1.3207,1.3207,0.396,90,90,120 - - 8.54 A 18213
As-Ni-Rb Rb2NiAs2 K2PdAs2,oS20,63 Cmcm 0.6906,1.4143,0.5976,90,90,90 - yellow 4.32 A 17714
As-Ni-Re Re5Ni2As12 Re5Ni2As12 ,oP38,58 Pnnm 1.2432,1.5511,0.3251,90,90,90 - - 10.32 X 16328
As-Ni-Rh RhNiAs PbClF,tP6,129 P4/nmm 0.35498,0.35498,0.61573,90,90,90 zaccariniite - 10.12 X 57804
As-Ni-Rh Rh1.5 Ni0.5 As Co2P,oP12,62 Pnma 0.5984,0.3792,0.724,90,90,90 - - 10.46 A 19180
As-Ni-S NiAsS NiSbS,cP12,198 P213 0.56888,0.56888,0.56888,90,90,90 gersdorffite-P213 black 5.98 X 39226
As-Ni-Sb NiSb0.5 As0.5 NiAs,hP4,194 P63 /mmc 0.38,0.38,0.52,90,90,120 breithauptite/nickeline - 8.02 X 14
As-Ni-Sc ScNi4As2 ZrFe4Si2,tP14,136 P42 /mnm 0.7077,0.7077,0.3738,90,90,90 - black 7.62 A 23540
As-Ni-Se NiAsSe NiSbS,cP12,198 P213 0.58469,0.58469,0.58469,90,90,90 jolliffeite black 7.06 X 39226
As-Ni-Si Ni2SiAs Ni2SiP,oP32,61 Pbca 0.5023,1.448,0.6274,90,90,90 AlB2 family gray 6.42 X 23987
As-Ni-Sm SmNiAs hex1 LiBaSi,hP3,187 P-6m2 0.40904,0.40904,0.38957,90,90,120 AlB2 family - 8.36 X 47791
As-Ni-Sm SmNiAs hex2 YPtAs,hP12,194 P63 /mmc 0.4092,0.4092,1.5588,90,90,120 AlB2 family - 8.35 A 39663
As-Ni-Sm SmNi2As2 ht CaBe2Ge2 ,tP10,129 P4/nmm 0.417,0.417,0.9349,90,90,90 - - 8.53 A 21623
As-Ni-Sm SmNi2As2 rt CeAl2Ga2,tI10,139 I4/mmm 0.3998,0.3998,0.9794,90,90,90 - - 8.86 A 21623
As-Ni-Sm Sm10Ni21As15.5 Sm10Ni20.8 P15,hP98,176 P63 /m 2.1079,2.1079,0.39575,90,90,120 - - 8.50 A 47791
As-Ni-Sm Sm2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.93682,0.93682,0.38518,90,90,120 - black 8.68 A 47791
As-Ni-Sm Sm3Ni7As5 Ce3Ni7As5 ,oP30,59 Pmmn 0.4102,1.2137,0.962,90,90,90 - gray 8.58 A 41899
Handbook of Inorganic Substances – Edition 2015 : Data 259

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Ni-Sm Sm6 Ni15As10 Tb6Ni15As10,hP78,176 P63/m 1.70632,1.70632,0.39526,90,90,120 - - 8.44 X 47791


As-Ni-Sm Sm6 Ni20As13 Zr6Ni20P 13,hP39,174 P-6 1.3147,1.3147,0.39113,90,90,120 - - 8.65 A 47791
As-Ni-Sn Ni1.25 Sn0.5 As0.5 Co1.75 Ge,hP6,194 P63/mmc 0.388,0.388,0.516,90,90,120 AlB2 family - 8.40 X 2836
As-Ni-Sr SrNi2As2 CeAl2Ga2,tI10,139 I4/mmm 0.41374,0.41374,1.0188,90,90,90 - gray steel 6.76 X 51292
As-Ni-Sr SrNi5As3 LaCo 5P3,oS36,63 Cmcm 0.3759,1.2239,1.189,90,90,90 - gray silver 7.36 X 25516
As-Ni-Ta TaNiAs TiNiSi,oP12,62 Pnma 0.6206,0.3708,0.7151,90,90,90 AlB2 family - 12.70 A 3421
As-Ni-Tb TbNiAs LiBaSi,hP3,187 P-6m2 0.4063,0.4063,0.3831,90,90,120 AlB2 family - 8.87 X 35867
As-Ni-Tb TbNi4As2 ZrFe 4Si2,tP14,136 P42/mnm 0.7277,0.7277,0.3761,90,90,90 - black 9.06 A 22394
As-Ni-Tb Tb10 Ni21As15 Sm10 Ni20.8P15,hP98,176 P63/m 2.114,2.114,0.3898,90,90,120 - - 8.69 A 35867
As-Ni-Tb Tb2NiAs2 ht Ho2NiAs2,hP10,194 P63/mmc 0.4111,0.4111,1.4024,90,90,120 - - 8.52 A 21646
As-Ni-Tb Tb2NiAs2 rt Tm2 NiAs2,hP10,186 P63mc 0.4115,0.4115,1.4055,90,90,120 - - 8.48 A 39663
As-Ni-Tb Tb2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9356,0.9356,0.3821,90,90,120 - black 8.87 A 14272
As-Ni-Tb Tb6Ni15As10 Tb6Ni15As10,hP78,176 P63/m 1.7005,1.7005,0.38877,90,90,120 - black 8.81 X 46615
As-Ni-Tb Tb6Ni15As10.5 (La0.5 Ce0.5 )6Rh15P 10.5 ,hP70,176 P63/m 1.7014,1.7014,0.3897,90,90,120 - black 8.91 A 39519
As-Ni-Tb Tb7Ni19As13 Zr6Ni20P 13,hP39,174 P-6 1.3124,1.3124,0.3893,90,90,120 - - 9.16 A 18213
As-Ni-Th Th2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9388,0.9388,0.3912,90,90,120 - - 9.42 A 54112
As-Ni-Ti TiNiAs TiNiSi,oP12,62 Pnma 0.6221,0.3714,0.7121,90,90,90 AlB2 family - 7.33 A 3421
As-Ni-Tm TmNiAs hex1 LiBaSi,hP3,187 P-6m2 0.4032,0.4032,0.3752,90,90,120 AlB2 family - 9.51 X 35867
As-Ni-Tm TmNiAs hex2 YPtAs,hP12,194 P63/mmc 0.4026,0.4026,1.4946,90,90,120 AlB2 family - 9.58 A 39663
As-Ni-Tm TmNi4As2 ZrFe 4Si2,tP14,136 P42/mnm 0.7192,0.7192,0.3753,90,90,90 - black 9.47 A 22394
As-Ni-Tm Tm13 Ni25As19 Tm13 Ni25As19,hP57,174 P-6 1.6219,1.6219,0.38778,90,90,120 - black 9.56 X 39483
As-Ni-Tm Tm2 NiAs2 rt hex1 Tm2 NiAs2,hP10,186 P63mc 0.4074,0.4074,1.3591,90,90,120 - black 9.29 X 39663
As-Ni-Tm Tm2 NiAs2 rt hex2 Ho2NiAs2,hP10,194 P63/mmc 0.4074,0.4074,1.3591,90,90,120 - black 9.29 X 39663
As-Ni-Tm Tm2 Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9339,0.9339,0.3786,90,90,120 - black 9.10 A 14272
As-Ni-Tm Tm7 Ni19As13 Zr6Ni20P 13,hP39,174 P-6 1.3073,1.3073,0.3823,90,90,120 - - 9.60 A 18213
As-Ni-U UNiAs YPtAs,hP12,194 P63/mmc 0.4048,0.4048,1.5325,90,90,120 AlB2 family - 11.35 A 39663
As-Ni-U UNiAs2 CuHfSi2,tP8,129 P4/nmm 0.3953,0.3953,0.915,90,90,90 - - 10.37 A 19128
As-Ni-U UNi1.6 As2 CaBe2Ge2,tP10,129 P4/nmm 0.3994,0.3994,0.9281,90,90,90 - - 10.81 X 23520
As-Ni-U U2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9378,0.9378,0.3838,90,90,120 - - 9.69 X 38781
As-Ni-U U3NiAs4 Au3 Y3Sb4,cI40,220 I-43d 0.8672,0.8672,0.8672,90,90,90 - - 10.92 X 23499
As-Ni-U U3Ni10As6.5 Ho3Ni10P 6.5,hP46,176 P63/m 1.3044,1.3044,0.3888,90,90,120 - - 10.37 X 26123
As-Ni-V VNiAs TiNiSi,oP12,62 Pnma 0.6042,0.3646,0.7071,90,90,90 AlB2 family - 7.87 A 7673
As-Ni-Y YNiAs LiBaSi,hP3,187 P-6m2 0.40457,0.40457,0.38186,90,90,120 AlB2 family - 6.83 X 44611
As-Ni-Y YNi4As2 ZrFe 4Si2,tP14,136 P42/mnm 0.72545,0.72545,0.37633,90,90,90 - black 7.94 A 44611
As-Ni-Y Y10Ni21As15 Sm10 Ni20.8P15,hP98,176 P63/m 2.09,2.09,0.3918,90,90,120 - - 7.27 A 35867
As-Ni-Y Y2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.93582,0.93582,0.38149,90,90,120 - black 8.07 A 44611
As-Ni-Y Y6Ni15As10 Tb6Ni15As10,hP78,176 P63/m 1.7001,1.7001,0.38858,90,90,120 - - 7.39 A 46615
As-Ni-Y Y7Ni19As13 Zr6Ni20P 13,hP39,174 P-6 1.3102,1.3102,0.3859,90,90,120 - - 7.85 A 18213
As-Ni-Yb YbNiAs YPtAs,hP12,194 P63/mmc 0.4019,0.4019,1.4885,90,90,120 AlB2 family - 9.78 A 39663
As-Ni-Yb YbNi4 As2 ZrFe 4Si2,tP14,136 P42/mnm 0.7216,0.7216,0.3756,90,90,90 - black 9.47 A 22394
As-Ni-Yb Yb13 Ni25As19 Tm13 Ni25As19,hP57,174 P-6 1.6236,1.6236,0.3876,90,90,120 - black 9.65 A 39483
As-Ni-Yb Yb2NiAs2 rt Tm2 NiAs2,hP10,186 P63mc 0.4073,0.4073,1.3506,90,90,120 - - 9.49 A 39663
As-Ni-Yb Yb2Ni12As7 Zr2Fe12P 7,hP21,174 P-6 0.9356,0.9356,0.3803,90,90,120 - black 9.07 A 14272
As-Ni-Zr ZrNiAs HoNiGa,oP12,62 Pnma 0.6466,0.3856,0.7318,90,90,90 AlB2 family - 8.19 A 35202
As-Ni-Zr ZrNi0.75 As2 CuHfSi2,tP8,129 P4/nmm 0.3766,0.3766,0.8909,90,90,90 - - 7.49 X 21295
As-Ni-Zr ZrNi4As2 ZrFe 4Si2,tP14,136 P42/mnm 0.7076,0.7076,0.3746,90,90,90 - black 8.43 A 22394
As-Ni-Zr Zr2NiAs2 Ho2NiAs2,hP10,194 P63/mmc 0.3915,0.3915,1.283,90,90,120 - - 7.62 X 21646
As-Ni-Zr Zr2Ni3As3 Zr2Ni3P3,oP32,62 Pnma 1.2691,0.3726,1.0144,90,90,90 - - 8.08 A 18035
As-Np-S NpAsS PbClF,tP6,129 P4/nmm 0.3881,0.3881,0.8355,90,90,90 - - 9.08 X 18063
As-Np-Se NpAsSe PbClF,tP6,129 P4/nmm 0.3972,0.3972,0.8571,90,90,90 - - 9.60 X 18063
As-Np-Te NpAsTe PbClF,tP6,129 P4/nmm 0.414,0.414,0.8909,90,90,90 - - 9.56 X 18063
As-O-P AsPO5 ht *,tP28,94 P42212 0.8318,0.8318,0.4558,90,90,90 - - - N 26798
As-O-P AsPO5 rt AsPO5,oP28,19 P212121 0.4536,0.8171,0.8417,90,90,90 - - 3.96 X 26798
As-O-P As[PO4] As[PO4],oP24,62 Pnma 0.84315,0.50229,0.72039,90,90,90 - colorless 3.70 X 15751
As-O-Pb PbAs2O4 PbAs2O4,mP28,14 P121/c1 0.7037,1.1801,0.6137,90,112.99,90 - - 5.96 X 20978
As-O-Pb PbAs2O6 PbSb2O6,hP9,162 P-31m 0.48698,0.48698,0.54837,90,90,120 - - 6.68 X 30473
As-O-Pb Pb2As2O5 Pb2As2O5,mP36,14 P121/c1 0.8551,0.565,1.3584,90,108.78,90 paulmooreite - 6.89 X 13101
As-O-Pb Pb3[AsO4]2 ht1 Pb3[PO4]2-a,mS52,15 C12/c1 1.4005,0.5828,0.9839,90,103.05,90 - colorless 7.64 A 13906
As-O-Pb Pb3[AsO4]2 ht2 Ba3[PO4]2,hR39,166 R-3m 0.5749,0.5749,2.0556,90,90,120 - colorless 7.62 A 13906
As-O-Pb Pb3[AsO4]2 rt Pb3[AsO4]2,mP26,14 P121/c1 0.7536,0.6029,0.9509,90,115.15,90 - colorless 7.64 X 11993
As-O-Pb Pb8[AsO4]2O5 Pb8[PO4]2O5,mS92,12 C12/m1 1.0797,1.0429,1.4614,90,98.081,90 - yellow 8.22 X 43345
As-O-Pd PdAs2O6 rt PbSb2O6,hP9,162 P-31m 0.48196,0.48196,0.46646,90,90,120 - violet 6.23 X 47570
As-O-Pu Pu[AsO4] Ce[PO4],mP24,14 P121/c1 0.666,0.709,0.82272,90,125.834,90 - - 8.08 A 2690
As-O-Rb RbAsO2 KAsO2,oP16,57 Pbcm 0.7297,0.7752,0.5411,90,90,90 - colorless 4.18 X 42509
As-O-Rb RbAsO3 *,mP*,* - 1.167,1.2487,1.4614,90,103.,90 - - - N 11855
As-O-Rb Rb3[AsO4] Li3[AsO4],oP36,62 Pnma 1.2092,0.8648,0.6334,90,90,90 - colorless 3.96 A 11855
As-O-Rb Rb4[As2O7] *,mP52,* - 1.1233,0.596,1.4707,90,105.7,90 - - 4.23 N 12710
As-O-Rh Rh0.5 As0.5 O2 TiO2 ,tP6,136 P42/mnm 0.446,0.446,0.2973,90,90,90 - black 6.79 X 14258
As-O-S As2[SO4]O2 As2[SO4]O2,oP18,18 P21212 0.4628,1.1497,0.4776,90,90,90 - - 3.63 X 15008
As-O-S As2[SO4]2O mon1 As2[SO4]2O,mP52,7 P1c1 0.665,0.6671,1.6612,90,94.34,90 - - 3.24 X 14890
As-O-S As2[SO4]2O mon2 As2[SO4]2O,mP52,14 P121/c1 0.665,0.6671,1.6612,90,94.34,90 - - 3.24 X 21080
As-O-S As2[SO4]3 As2[SO4]3,mP68,14 P121/c1 0.9389,0.5255,1.9355,90,91.88,90 - - 3.05 X 14999
As-O-Sb SbAsO3 SbAsO3,mP20,14 P121/c1 0.458,1.316,0.6799,90,127.149,90 stibioclaudetite colorless 4.98 X 16774
As-O-Sb SbAsO5 AsPO5,oP28,19 P212121 0.49035,0.87524,0.91607,90,90,90 - - 4.67 X 26798
As-O-Sb Sb[AsO4] Sb[AsO4],mP12,11 P121/m1 0.4794,0.6925,0.5307,90,93.55,90 - colorless 4.92 X 12983
As-O-Sc Sc[AsO4] Zr[SiO4],tI24,141 I41/amd 0.67102,0.67102,0.61132,90,90,90 - - 4.44 X 45650
As-O-Sm Sm[AsO4] tet1 Zr[SiO4],tI24,141 I41/amd 0.71857,0.71857,0.63906,90,90,90 - yellow pale 5.82 X 45685
As-O-Sm Sm[AsO4] tet2 Ca[WO4],tI24,88 I41/a 0.50658,0.50658,1.14613,90,90,90 - yellow pale 6.53 X 47627
260 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-O-Sm Sm2As4O9 Nd2As4O9 ,aP30,2 P-1 0.68112,0.75759,0.95397,96.623,103.751,104.4 - yellow pale 5.43 X 47681
As-O-Sr SrAs2O6 hex2 SrAs2O6,hP18,193 P63 /mcm 0.4853,0.4853,1.0867,90,90,120 - colorless 5.00 X 53355
As-O-Sr SrAs2O6 trig1 PbSb2O6,hP9,162 P-31m 0.4858,0.4858,0.5426,90,90,120 - colorless 4.99 X 53355
As-O-Sr Sr2[As2O7 ] Ca2[P 2O7],tP88,76 P41 0.71177,0.71177,2.56373,90,90,90 - white 4.47 X 53355
As-O-Sr Sr3[AsO4]2 Ba3[PO4]2 ,hR39,166 R-3m 0.55847,0.55847,2.0009,90,90,120 - colorless 4.98 X 53355
As-O-Sr Sr4As2O K2NiF4,tI14,139 I4/mmm 0.4831,0.4831,1.6364,90,90,90 high-Tc family brown red 4.49 X 25524
As-O-Sr Sr4As2O9 *,o**,* - 0.747,1.011,1.283,90,90,90 - - - N 2849
As-O-Ta Ta[AsO4]O rt Nb[PO4]O,oP28,62 Pnma 1.157,0.531,0.666,90,90,90 - - 5.45 A 14544
As-O-Ta Ta9AsO25 ht Nb9PO25,tI72,87 I4/m 1.558,1.558,0.382,90,90,90 - - 7.53 A 14544
As-O-Tb Tb[AsO4] lt Tb[AsO4],oF48,70 Fddd 0.631,1.012,0.9945,90,90,90 - - 6.23 X 10580
As-O-Tb Tb[AsO4] rt Zr[SiO4],tI24,141 I41/amd 0.7105,0.7105,0.6336,90,90,90 - - 6.19 X 10580
As-O-Te AsTe0.5 O2 AsTe0.5 O2 ,hP4,156 P3m1 0.4157,0.4157,0.7127,90,90,120 - red dark 2.66 X 28261
As-O-Th ThAs2O7 ht *,oP80,57 Pbcm 1.195,1.324,0.738,90,90,90 - white - N 9025
As-O-Th ThAs4O12 rt *,oP68,60 Pbcn 1.496,1.557,0.941,90,90,90 - - - N 3002
As-O-Ti Ti[As2O7] mon1 Si[P 2O7]-b,mP40,14 P121/c1 0.50992,1.2879,0.95725,90,120.865,90 - - 3.81 X 27270
As-O-Ti Ti[As2O7] mon2 Ti[As2O7],mS40,15 C12/c1 0.68697,0.79239,0.94369,90,104.072,90 - - 4.13 X 27270
As-O-Tl Tl3[AsO4] Tl3[PO4],hP16,173 P63 0.8517,0.8517,0.5233,90,90,120 - colorless 7.60 X 35251
As-O-Tm Tm[AsO4 ] rt Zr[SiO4],tI24,141 I41/amd 0.7,0.7,0.6256,90,90,90 - - 6.67 A 2034
As-O-U UAsO5 *,mP28,14 P121/c1 0.8833,0.6858,0.7151,90,96.88,90 - - 6.07 N 19024
As-O-V V[AsO4]O tet Mo[PO4]O,tP14,85 P4/n 0.633,0.633,0.418,90,90,90 - yellow 4.08 A 11826
As-O-V V2[AsO4]O2 (V0.5 Fe0.5)2[VO4]O(O...,oP36,19 P212121 0.4791,0.8795,0.9486,90,90,90 - black 4.53 X 58941
As-O-V V4 As2O13 V4 As2O13,aP19,1 P1 0.49441,0.499,0.88156,89.88,79.43,80.72 - black 4.42 X 18791
As-O-V [VO][AsO4] mon [VO][AsO4],mP28,14 P121/c1 0.63338,0.82826,0.89609,90,134.787,90 - orange 4.10 X 55682
As-O-V [VO][AsO4] orth [VO][SO4 ],oP28,62 Pnma 0.7922,0.6316,0.7194,90,90,90 - - 3.80 A 37594
As-O-V [VO]3[AsO3]2 ht [VO]3[AsO3]2,tP28,100 P4bm 0.8946,0.8946,0.4609,90,90,90 - green 4.02 X 58941
As-O-V [VO]3[AsO3]2 rt [VO]3[AsO3]2,mS30,12 C12/m1 0.8748,0.6397,0.6405,90,104.5,90 - black 4.27 X 58941
As-O-W W2[AsO4]2O3 W2[AsO4]2O3,oP60,62 Pnma 1.60109,0.64341,0.8043,90,90,90 - colorless 5.56 X 5724
As-O-Y Y[AsO4] Zr[SiO4],tI24,141 I41/amd 0.707,0.707,0.6214,90,90,90 chernovite - 4.87 X 57141
As-O-Yb Yb[AsO4] Zr[SiO4],tI24,141 I41/amd 0.69712,0.69712,0.62431,90,90,90 - colorless 6.83 X 44286
As-O-Yb Yb4 As2O K2NiF4,tI14,139 I4/mmm 0.4562,0.4562,1.544,90,90,90 high-Tc family - 8.87 X 35275
As-O-Zn Zn2[As2O7] lt Zn2[P 2O7],mS132,15 C12/c1 2.00796,0.8436,0.9618,90,100.766,90 - colorless 4.89 X 53853
As-O-Zn Zn2[As2O7] rt Mn2[P 2O7 ],mS24,12 C12/m1 0.67248,0.84605,0.47791,90,105.319,90 - colorless 4.97 X 53853
As-O-Zn Zn3[AsO3 ]2 mon Zn3[AsO3]2,mP44,14 P121/c1 0.82438,0.51781,1.58222,90,97.445,90 - colorless 4.38 X 53664
As-O-Zn Zn3[AsO3 ]2 orth Zn3[AsO3]2,oP44,55 Pbam 0.6092,1.4407,0.7811,90,90,90 reinerite blue faint 4.28 X 10511
As-O-Zn Zn3[AsO4 ]2 mon1 Cu3[AsO4 ]2,mP52,14 P121/c1 0.6306,0.8652,1.1321,90,92.25,90 - colorless 5.10 X 32667
As-O-Zn Zn3[AsO4 ]2 mon2 Mg3[PO4]2,mP26,14 P121/c1 0.5281,0.8494,0.88599,90,119.934,90 - colorless 4.57 X 32667
As-O-Zn Zn4[AsO4 ]2O ht Zn4[AsO4]2O,mP120,14 P121/c1 0.9743,0.8163,2.01759,90,117.314,90 - colorless 5.17 X 32656
As-O-Zn Zn4[AsO4 ]2O rt Zn4[AsO4]2O,mP60,14 P121/c1 0.9807,0.818,1.04018,90,120.985,90 - colorless 5.16 X 32656
As-Os-Pr PrOs4As12 LaFe4P 12,cI34,204 Im-3 0.85319,0.85319,0.85319,90,90,90 - - 9.63 X 47326
As-Os-S OsAsS FeAsS,mP12,14 P121/c1 0.594,0.592,0.601,90,111.9,90 osarsite - 10.07 A 2317
As-Os-Se OsAsSe FeAsS,mP12,14 P121/c1 0.61,0.609,0.619,90,112.6,90 pyrite-marcasite family - 10.77 A 2317
As-Os-Te OsAsTe FeAsS,mP12,14 P121/c1 0.637,0.631,0.642,90,113.1,90 pyrite-marcasite family - 10.99 A 2317
As-Os-Th ThOs4As12 LaFe4P 12,cI34,204 Im-3 0.85183,0.85183,0.85183,90,90,90 - black 10.17 A 13363
As-Os-Zr ZrOsAs ZrNiAl,hP9,189 P-62m 0.6602,0.6602,0.3794,90,90,120 Fe2P family - 12.40 A 16394
As-P-Pt PtAsP FeS2,cP12,205 Pa-3 0.584,0.584,0.584,90,90,90 pyrite-marcasite family - 10.04 A 3417
As-P-Rh Rh2As0.87P 0.13 CaF2,cF12,225 Fm-3m 0.5653,0.5653,0.5653,90,90,90 fluorite family - 10.11 X 19180
As-P-S As2P 2S3 As4S3-b,oP28,62 Pnma 1.0976,0.993,0.6582,90,90,90 - yellow 2.85 X 19861
As-P-S As2P 2S7 As2P 2S7,mP44,14 P121/c1 1.1746,0.8239,1.1401,90,94.43,90 - yellow 2.63 X 17705
As-P-S As3PS3 *,hR21,160 R3m 0.9875,0.9875,0.6331,90,90,120 - - 3.28 N 28100
As-P-Si SiAs0.2 P1.8 FeS2,cP12,205 Pa-3 0.5735,0.5735,0.5735,90,90,90 pyrite-marcasite family - 3.48 A 4156
As-P-Ti TiAs0.5P 0.5 TiP,hP8,194 P63 /mmc 0.3565,0.3565,1.186,90,90,120 - - 5.13 X 7663
As-P-U UAs0.2 P1.8 PbClF,tP6,129 P4/nmm 0.3802,0.3802,0.7798,90,90,90 - - 9.10 A 34742
As-P-U UAs0.45P 0.55 NaCl,cF8,225 Fm-3m 0.5674,0.5674,0.5674,90,90,90 rocksalt family - 10.50 X 3750
As-P-V VAs0.9 P0.1 FeAs,oP8,62 Pnma 0.5808,0.3341,0.6266,90,90,90 AlB2 family - 6.64 A 19375
As-P-W W5As2.5P 1.5 Ti5 Te4,tI18,87 I4/m 0.94729,0.94729,0.32414,90,90,90 Chevrel phase - 13.17 X 33453
As-P-Yb Yb4 As2.7 P0.3 Th3P 4,cI28,220 I-43d 0.8784,0.8784,0.8784,90,90,90 - - 8.86 A 21414
As-Pb-Pd PdPb0.2 As0.8 m NiAs,hP4,194 P63 /mmc 0.3803,0.3803,0.5651,90,90,120 AlB2 family - 9.75 X 16099
As-Pb-Pd Pd3Pb0.5 As0.5 m BiF3,cF16,225 Fm-3m 0.621,0.621,0.621,90,90,90 b.c.c. family - 12.77 X 23068
As-Pb-Pd Pd3Pb2As Pd3Pb2As,oS24,36 Cmc21 1.1857,0.6861,0.5808,90,90,90 - - 11.37 X 27470
As-Pb-S PbAs2S4 PbAs2S4,oP28,62 Pnma 0.789,0.419,1.962,90,90,90 sartorite - 4.97 X 1362
As-Pb-S Pb14As6S23 ht Pb14As6S23 ,mP90,11 P121/m1 0.8462,3.1899,0.8918,90,117.79,90 jordanite - 6.37 X 8653
As-Pb-S Pb18.5 As25 S56 Pb18.5 As25 S56,mP206,4 P1211 0.7914,7.049,0.8371,90,90.13,90 rathite - 5.34 X 5622
As-Pb-S Pb2As2S5 rt Pb2As2S5,mP72,4 P1211 0.79,2.574,0.837,90,90.35,90 dufrénoysite - 5.66 X 4941
As-Pb-S Pb5As9S18 Pb5As9S18 ,aP64,2 P-1 0.79,0.833,2.278,90.,97.4,90. baumhauerite - 5.11 X 1356
As-Pb-S Pb7As4S13 *,mP*,11 P121/m1 3.513,1.152,3.69,90,92.6,90 lengenbachite - - N 1175
As-Pb-S Pb9As4S15 rt Pb9As4S15-b,hR84,160 R3m 1.7758,1.7758,0.7807,90,90,120 gratonite - 6.18 X 4931
As-Pd-Pr PrPdAs ht BeZrSi,hP6,194 P63 /mmc 0.4355,0.4355,0.7732,90,90,120 AlB2 family - 8.43 X 26089
As-Pd-Pr PrPdAs rt CaIn2,hP6,194 P63 /mmc 0.4355,0.4355,0.7709,90,90,120 AlB2 family - 8.45 X 14266
As-Pd-Pr PrPd2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4234,0.4234,1.0268,90,90,90 - - 9.09 A 18318
As-Pd-Pr PrPd3As2 GdPd3As2 ,mS36,12 C12/m1 1.6651,0.41,0.9966,90,108.01,90 - - 9.39 A 30566
As-Pd-Rb Rb2PdAs2 K2PdAs2,oS20,63 Cmcm 0.6803,1.4486,0.6202,90,90,90 - yellow 4.64 A 17714
As-Pd-S PdAsS NiSbS,cP12,198 P213 0.59507,0.59507,0.59507,90,90,90 pyrite-marcasite family black 6.73 X 39226
As-Pd-Sb PdSb1.2 As0.8 FeS2,cP12,205 Pa-3 0.624,0.624,0.624,90,90,90 pyrite-marcasite family - 8.54 A 6345
As-Pd-Sb Pd3Sb0.45 As0.55 *,oP*,* - 0.337,0.613,1.103,90,90,90 isomertieite - - N 8587
As-Pd-Sb Pd5SbAs Pd5SbAs,cF112,227 Fd-3m 1.228,1.228,1.228,90,90,90 - - 10.45 X 11750
As-Pd-Sb Pd5Sb1.94 As0.06 Pd5Sb2,hP42,185 P63 cm 0.7595,0.7595,1.388,90,90,120 - - 11.10 A 9688
As-Pd-Se PdAsSe NiSbS,cP12,198 P213 0.60948,0.60948,0.60948,90,90,90 kalungaite black 7.64 X 39226
As-Pd-Si Pd2Si0.3As0.7 Fe2P,hP9,189 P-62m 0.657,0.657,0.342,90,90,120 Fe2P family - 10.66 A 5603
Handbook of Inorganic Substances – Edition 2015 : Data 261

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Pd-Sm SmPdAs ht BeZrSi,hP6,194 P63/mmc 0.4328,0.4328,0.7539,90,90,120 AlB2 family - 9.01 X 26089


As-Pd-Sm SmPdAs rt NdPtSb,hP6,186 P63mc 0.4328,0.4328,0.7539,90,90,120 AlB2 family - 9.01 X 26089
As-Pd-Sm SmPd2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4176,0.4176,1.0222,90,90,90 - - 9.56 A 18318
As-Pd-Sm SmPd3As2 GdPd3As2,mS36,12 C12/m1 1.6578,0.4061,0.9945,90,107.97,90 - - 9.69 A 30566
As-Pd-Sn Pd2Sn0.6 As0.4 ht Fe2P,hP9,189 P-62m 0.7,0.7,0.329,90,90,120 Fe2P family - 11.20 A 5603
As-Pd-Sn Pd3Sn0.5 As0.5 m BiF3 ,cF16,225 Fm-3m 0.6151,0.6151,0.6151,90,90,90 b.c.c. family - 11.87 X 23068
As-Pd-Sr SrPdAs BeZrSi,hP6,194 P63/mmc 0.4264,0.4264,0.8915,90,90,120 AlB2 family gray 6.36 X 32708
As-Pd-Sr SrPd2As2 CeAl2Ga2,tI10,139 I4/mmm 0.438,0.438,1.0169,90,90,90 - gray steel 7.67 X 18318
As-Pd-Tb TbPdAs TiNiSi,oP12,62 Pnma 0.7029,0.414,0.7868,90,90,90 AlB2 family - 9.87 A 26089
As-Pd-Te Pd5As0.5 Te1.5 Pd5Sb2,hP42,185 P63cm 0.7555,0.7555,1.3884,90,90,120 - - 11.05 A 6342
As-Pd-Te Pd6AsTe *,cF*,* - 1.225,1.225,1.225,90,90,90 - - - N 6342
As-Pd-Te Pd8As0.7 Te2.3 Pd8Sb3,hR132,161 R3c 0.7705,0.7705,4.2255,90,90,120 - - 10.98 A 6342
As-Pd-Ti TiPdAs ZrNiAl,hP9,189 P-62m 0.6553,0.6553,0.3719,90,90,120 Fe2P family - 8.26 A 8106
As-Pd-Tl TlPd5As TlPd5As,tP7,123 P4/mmm 0.4,0.4,0.704,90,90,90 - - 11.96 X 5603
As-Pd-Tl Tl0.16 Pd0.67 As0.84 m NiAs,hP4,194 P63/mmc 0.3737,0.3737,0.5648,90,90,120 AlB2 family - 8.12 X 16167
As-Pd-Tl Tl0.45 Pd2As0.55 Fe2P,hP9,189 P-62m 0.67,0.67,0.341,90,90,120 Fe2P family - 13.00 A 5603
As-Pd-Tl Tl0.5 Pd3As0.5 m BiF3 ,cF16,225 Fm-3m 0.6182,0.6182,0.6182,90,90,90 b.c.c. family - 12.90 X 23068
As-Pd-Tm TmPdAs TiNiSi,oP12,62 Pnma 0.6928,0.4063,0.7843,90,90,90 AlB2 family - 10.54 A 26089
As-Pd-U UPdAs2 CuHfSi2,tP8,129 P4/nmm 0.3987,0.3987,0.9493,90,90,90 - - 10.88 X 23611
As-Pd-V VPdAs Cr2P,oI36,44 Imm2 0.7155,1.1205,0.6708,90,90,90 - - 8.61 A 15560
As-Pd-Yb YbPdAs ZrNiAl,hP9,189 P-62m 0.6997,0.6997,0.3913,90,90,120 Fe2P family - 10.64 X 26089
As-Pd-Zn Zn0.4 Pd2As0.6 Fe2P,hP9,189 P-62m 0.671,0.671,0.339,90,90,120 Fe2P family - 10.70 A 5603
As-Pd-Zr ZrPdAs hex ZrNiAl,hP9,189 P-62m 0.6667,0.6667,0.3893,90,90,120 Fe2P family - 9.06 A 38136
As-Pd-Zr ZrPdAs orth NbCoB,oP30,59 Pmmn 0.3887,1.9288,0.669,90,90,90 - gray 9.02 X 38136
As-Pr-Rh PrRh2As2 CaBe2Ge2,tP10,129 P4/nmm 0.4266,0.4266,0.9856,90,90,90 - - 9.19 A 20220
As-Pr-Ru PrRu4As12 LaFe 4P 12,cI34,204 Im-3 0.8491,0.8491,0.8491,90,90,90 - - 7.84 X 49145
As-Pr-S PrAsS CeAsS,mP12,14 P121/c1 0.39182,1.737,0.559,90,134.018,90 - - 6.02 A 10745
As-Pr-S Pr4As2S9 Pr4As2S9,oP60,60 Pbcn 2.9106,0.69974,0.70451,90,90,90 - yellow 4.64 X 53456
As-Pr-Se PrAsSe CeAsS,mP12,14 P121/c1 0.4057,1.7719,0.57352,90,134.893,90 - - 6.70 A 14806
As-Pr-Si PrSiAs 3 CeSiP3,oP40,33 Pna21 0.5949,2.6149,0.5877,90,90,90 - - 5.72 A 21366
As-Pr-Te PrAsTe TiNiSi,oP12,62 Pnma 0.7728,0.412,1.0137,90,90,90 AlB2 family black 7.07 X 37205
As-Pr-Zn Zn0.67PrAs2 CuHfSi2,tP8,129 P4/nmm 0.4006,0.4006,1.0197,90,90,90 - black 6.79 X 36122
As-Pr-Zn Zn2PrAs3 Zn2CeAs3,tP14,129 P4/nmm 0.40534,0.40534,1.6059,90,90,90 - - 6.25 X 59687
As-Pr-Zn Zn2Pr0.67 As2 Ce2SO2,hP5,164 P-3m1 0.4166,0.4166,0.6985,90,90,120 - black 5.93 A 57506
As-Pr-Zn Zn2Pr3As6 Zn2Pr3As6,oP22,59 Pmmn 0.39989,1.2042,1.0197,90,90,90 - black 6.78 X 36122
As-Pr-Zn Zn3PrAs3 Zn3PrAs3,hP22,194 P63/mmc 0.41709,0.41709,2.04429,90,90,120 - gray 6.06 X 56276
As-Pt-Rb Rb2PtAs2 K2PdAs2,oS20,63 Cmcm 0.6729,1.4427,0.6292,90,90,90 - black 5.61 X 17714
As-Pt-S PtAsS FeS2 ,cP12,205 Pa-3 0.5929,0.5929,0.5929,90,90,90 pyrite-marcasite family - 9.63 A 1975
As-Pt-S PtAs1.7S0.3 FeS2 ,cP12,205 Pa-3 0.5943,0.5943,0.5943,90,90,90 pyrite-marcasite family - 10.51 A 6345
As-Pt-Sb PtSb0.2As1.8 FeS2 ,cP12,205 Pa-3 0.601,0.601,0.601,90,90,90 pyrite-marcasite family - 10.84 A 3417
As-Pt-Sb PtSb1.7As0.3 FeS2 ,cP12,205 Pa-3 0.638,0.638,0.638,90,90,90 pyrite-marcasite family - 10.86 A 3417
As-Pt-Sm SmPtAs YPtAs,hP12,194 P63/mmc 0.4285,0.4285,1.5485,90,90,120 AlB2 family gray 11.34 A 19746
As-Pt-Sr SrPtAs BeZrSi,hP6,194 P63/mmc 0.4246,0.4246,0.8967,90,90,120 AlB2 family brown 8.48 X 19673
As-Pt-Sr SrPt0.70 As0.90 LiBaSi,hP3,187 P-6m2 0.4262,0.4262,0.4428,90,90,120 AlB2 family gray dark 6.95 X 19673
As-Pt-Sr SrPt2As2 hp LaPt2Ge2,mP20,14 P121/c1 0.9752,0.4398,0.8727,90,90.34,90 - - 11.14 X 49597
As-Pt-Sr SrPt2As2 rt SrPt2As2,oP14,59 Pmmn 0.4475,0.4498,0.9828,90,90,90 - gray steel 10.54 X 49597
As-Pt-Sr SrPt4As6 BaPt4As6,mS44,15 C12/c1 0.8582,0.8321,1.1945,90,91.,90 - gray 10.26 X 20919
As-Pt-Tl TlPt5As TlPd5As,tP7,123 P4/mmm 0.4009,0.4009,0.7161,90,90,90 - - 18.10 A 5603
As-Pt-Tm TmPtAs YPtAs,hP12,194 P63/mmc 0.4235,0.4235,1.4898,90,90,120 AlB2 family gray 12.60 A 19746
As-Pt-Y YPtAs YPtAs,hP12,194 P63/mmc 0.425,0.425,1.5165,90,90,120 AlB2 family gray 10.05 X 19746
As-Pt-Yb YbPtAs YPtAs,hP12,194 P63/mmc 0.4234,0.4234,1.4851,90,90,120 AlB2 family gray bright 12.76 X 19746
As-Pt-Zn ZnPt5As TlPd5As,tP7,123 P4/mmm 0.388,0.388,0.7,90,90,90 - - 17.58 A 5603
As-Rb-Rh RbRh2As2 CeAl2Ga2,tI10,139 I4/mmm 0.3994,0.3994,1.3937,90,90,90 - - 6.59 A 17714
As-Rb-Ru RbRu2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4024,0.4024,1.3981,90,90,90 - - 6.42 A 17714
As-Rb-Se RbAsSe 2 RbAsSe 2,mS64,15 C12/c1 2.3311,0.9915,0.9337,90,102.33,90 - red 4.01 X 21939
As-Rb-Se Rb3AsSe 16 Rb3AsSe 16,cF160,203 Fd-3 1.666,1.666,1.666,90,90,90 - black 4.58 X 33964
As-Rb-Se Rb3AsSe 4 [NH4]3AsS4,oP32,62 Pnma 0.9747,1.1433,0.9954,90,90,90 - red 3.88 X 32666
As-Rb-Si Rb2SiAs2 K2ZnO2,oI20,72 Ibam 0.7266,1.3771,0.6389,90,90,90 - red 3.62 X 19792
As-Rb-Si Rb5SiAs3 Cs5SiP 3,oP36,62 Pnma 1.4169,0.5671,1.5479,90,90,90 - black 3.63 X 25666
As-Rb-Sn Rb2SnAs2 K2ZnO2,oI20,72 Ibam 0.7454,1.3974,0.6942,90,90,90 - - 4.04 X 24899
As-Rb-Zn RbZn4 As3 KCu4S3,tP8,123 P4/mmm 0.41714,0.41714,1.0355,90,90,90 - black 5.27 X 56388
As-Rb-Zn Rb2Zn5As4 K2Zn5As4,oS44,63 Cmcm 1.16649,0.70953,1.17585,90,90,90 - - 5.44 X 58404
As-Rb-Zn Rb4Zn9As14 K4(Zn0.39 As0.61 )23,cP70,223 Pm-3n 1.07413,1.07413,1.07413,90,90,90 clathrate brown 5.30 X 57941
As-Re-S Re4As6S3 Re4As5(As0.25 S0.75 )4,cF52,216 F-43m 0.98608,0.98608,0.98608,90,90,90 - black 8.94 X 41908
As-Rh-S RhAsS FeS2 ,cP12,205 Pa-3 0.5758,0.5758,0.5758,90,90,90 hollingworthite - 7.30 A 6345
As-Rh-Se RhAs0.4 Se1.6 FeS2 ,cP12,205 Pa-3 0.5959,0.5959,0.5959,90,90,90 pyrite-marcasite family - 8.14 A 6345
As-Rh-Sm Sm4 Rh13As9 Ca4Rh13As9,oP54,59 Pmmn 0.3913,1.1242,1.944,90,90,90 - - 10.15 X 39495
As-Rh-Sr SrRh2As2 ht1 SrRh2As2,oF20,69 Fmmm 0.576,0.6067,1.1264,90,90,90 - gray silver 7.48 X 49746
As-Rh-Sr SrRh2As2 ht2 CeAl2Ga2,tI10,139 I4/mmm 0.4112,0.4112,1.1431,90,90,90 - gray silver 7.62 X 49746
As-Rh-Sr SrRh2As2 rt mon SrRh2As2,mP20,14 P121/c1 0.4212,1.1056,0.843,90,95.06,90 - - 7.53 X 59208
As-Rh-Sr SrRh2As2 rt orth BaNi2Si2,oS20,63 Cmcm 0.6178,0.5676,1.1052,90,90,90 - gray silver 7.60 A 49746
As-Rh-Sr SrRh6As4 LiCo 6P 4,hP11,187 P-6m2 0.7214,0.7214,0.3823,90,90,120 - gray light 9.68 X 36645
As-Rh-Sr Sr3Rh15As9.5 Sm3 Rh15Si9.5 ,hP58,176 P63/m 1.6135,1.6135,0.3916,90,90,120 - gray 9.47 X 40964
As-Rh-Te RhAsTe FeS2 ,cP12,205 Pa-3 0.6165,0.6165,0.6165,90,90,90 pyrite-marcasite family - 8.66 A 1975
As-Rh-Ti TiRhAs TiNiSi,oP12,62 Pnma 0.6334,0.38165,0.7388,90,90,90 AlB2 family - 8.40 A 8106
As-Rh-U URh1.55 As1.9 tet1 URh1.6 As1.9 ,tI156,108 I4cm 1.1554,1.1554,1.9359,90,90,90 - - 11.10 X 21356
As-Rh-U URh1.57 As1.9 tet2 CaBe2Ge2,tP10,129 P4/nmm 0.4082,0.4082,0.9675,90,90,90 - - 11.16 X 21356
As-Rh-V VRhAs TiNiSi,oP12,62 Pnma 0.6138,0.387,0.7259,90,90,90 AlB2 family - 8.81 A 8106
262 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Rh-Y Y2Rh12As7 Zr2Rh12P 7 ,hP22,176 P63 /m 0.9883,0.9883,0.3869,90,90,120 - grayish 9.83 A 16937


As-Rh-Yb YbRh6As4 LiCo 6P 4,hP11,187 P-6m2 0.7206,0.7206,0.3754,90,90,120 - gray light 10.72 X 36645
As-Rh-Yb Yb4Rh7 As6 U4Re7Si6,cI34,229 Im-3m 0.8254,0.8254,0.8254,90,90,90 - gray 11.00 X 39428
As-Ru-S RuAsS FeAsS,mP12,14 P121/c1 0.595,0.592,0.602,90,113.1,90 ruarsite - 7.09 A 2317
As-Ru-Se RuAsSe FeAsS,mP12,14 P121/c1 0.608,0.606,0.614,90,112.7,90 pyrite-marcasite family - 8.11 A 2317
As-Ru-Sr SrRu2As2 CeAl2Ga2,tI10,139 I4/mmm 0.4168,0.4168,1.1179,90,90,90 - - 7.52 A 20401
As-Ru-Te RuAsTe FeAsS,mP12,14 P121/c1 0.636,0.63,0.64,90,113.6,90 pyrite-marcasite family - 8.58 A 2317
As-Ru-Ti TiRuAs TiFeSi,oI36,46 Ima2 0.7287,1.1227,0.6515,90,90,90 - - 8.37 A 15932
As-Ru-U U4Ru7As6 U4Re7Si6,cI34,229 Im-3m 0.83048,0.83048,0.83048,90,90,90 - gray 12.23 X 37345
As-Ru-Zr ZrRuAs ZrNiAl,hP9,189 P-62m 0.6586,0.6586,0.3891,90,90,120 Fe2P family - 9.11 X 16394
As-S-Sb Sb0.35 As4.65 S7 (Sb0.11 As0.89)3As2S7,oP96,33 Pna21 2.5262,1.4563,0.6492,90,90,90 wakabayashilite golden 3.42 X 44325
As-S-Sb Sb1.02 As0.98 S3 (Sb0.5 As0.5 )2S3,mP40,14 P121/c1 1.013,0.9028,1.1949,90,116.15,90 getchellite red dark 3.98 X 42694
As-S-Sb Sb2.07 As0.93 S2 Sb2AsS2,mS20,12 C12/m1 1.075,0.3959,1.249,90,115.25,90 pääkkönenite - 5.33 X 29837
As-S-Se AsSe0.15 S0.85 AsS-a,mP32,14 P121/c1 0.66182,1.35837,0.98284,90,113.734,90 - - 3.75 X 51831
As-S-Se As2Se2.29 S0.71 As2S3,mP20,14 P121/c1 0.4268,0.9804,1.26518,90,109.395,90 laphamite - 4.70 X 50045
As-S-Sm SmAsS LaSbTe,oP12,62 Pnma 1.71134,0.38544,0.39063,90,90,90 - black 6.64 X 41660
As-S-Sm SmAs0.05 S0.95 NaCl,cF8,225 Fm-3m 0.59,0.59,0.59,90,90,90 rocksalt family red 5.97 X 14228
As-S-Sm SmAs0.5 S0.5 NaCl,cF8,225 Fm-3m 0.577,0.577,0.577,90,90,90 rocksalt family - 7.05 X 14228
As-S-Sr Sr0.25 As0.5 S ZnS,cF8,216 F-43m 0.5404,0.5404,0.5404,90,90,90 adamantane structure brown 3.85 X 2035
As-S-Tb TbAsS CeAsS,mP12,14 P121/c1 0.38003,1.724,0.547,90,133.017,90 - - 6.74 A 28710
As-S-Th ThAs1.23 S0.77 PbClF,tP6,129 P4/nmm 0.40225,0.40225,0.8483,90,90,90 - - 8.44 X 38822
As-S-Tl TlAsS2 TlAsS2,mP32,14 P121/c1 0.612,1.133,1.232,90,104.4,90 lorandite red deep 5.51 X 28829
As-S-Tl TlAs5S8 TlAs5S8,mP56,14 P121/c1 1.5647,0.8038,1.075,90,91.27,90 bernardite black 4.11 X 22653
As-S-Tl Tl1.4 As3.75 S6.33 Tl1.4 As3.75 S6.33 ,mP60,14 P121/c1 0.5739,2.4425,0.88355,90,109.8,90 imhofite - 4.39 X 10278
As-S-Tl Tl3AsS3 orth Tl3AsS3,oP56,61 Pbca 0.5695,1.2205,2.1634,90,90,90 - - 6.93 X 28829
As-S-Tl Tl3AsS3 rhom Tl3AsSe3,hR21,160 R3m 0.95708,0.95708,0.69888,90,90,120 ellisite gray dark 7.05 X 13824
As-S-Tl Tl3AsS4 [NH4]3AsS4,oP32,62 Pnma 0.8894,1.0855,0.9079,90,90,90 fangite red deep 6.19 X 27075
As-S-Tm TmAsS CeAsS,mP12,14 P121/c1 0.37462,1.661,0.53322,90,134.549,90 - - 7.75 A 10745
As-S-U UAsS PbClF,tP6,129 P4/nmm 0.386,0.386,0.8128,90,90,90 - - 9.46 X 34742
As-S-U UAs0.43 S0.57 NaCl,cF8,225 Fm-3m 0.562,0.562,0.562,90,90,90 rocksalt family - 10.80 X 3750
As-S-Y YAsS CeAsS,mP12,14 P121/c1 0.37991,1.685,0.542,90,133.984,90 - - 5.21 A 10745
As-S-Y YAs0.5 S0.5 NaCl,cF8,225 Fm-3m 0.5664,0.5664,0.5664,90,90,90 rocksalt family - 5.21 X 5145
As-S-Yb YbAsS CeAsS,mP12,14 P121/c1 0.37517,1.71,0.54,90,132.999,90 - - 7.34 A 28710
As-S-Yb YbAs2S4 *,o**,* - 0.395,1.115,1.387,90,90,90 - - - N 20079
As-S-Yb YbAs4S7 *,c**,* - 1.025,1.025,1.025,90,90,90 - red - N 21769
As-S-Yb Yb3 As4S9 *,o*96,* - 0.403,1.697,2.423,90,90,90 - black 6.66 N 21769
As-S-Zr ZrAs1.42 S0.58 UAs2,tP6,129 P4/nmm 0.362,0.362,0.804,90,90,90 - gray silver 6.82 X 6735
As-Sb-Sr Sr5Sb1.4 As1.6 Yb5Sb3,oP32,62 Pnma 1.292,0.9802,0.8563,90,90,90 - black 4.46 X 31191
As-Sb-U USbAs UAs2,tP6,129 P4/nmm 0.4152,0.4152,0.8463,90,90,90 - - 9.90 X 10787
As-Sb-Yb Yb4Sb0.36 As2.64 Th3P 4,cI28,220 I-43d 0.8851,0.8851,0.8851,90,90,90 - - 8.95 A 30414
As-Sb-Zr Zr5Sb3As CuHf5Sn3,hP18,193 P63 /mcm 0.85007,0.85007,0.5849,90,90,120 AlB2 family - 8.13 A 23372
As-Se-Sm SmAsSe CeAsS,mP12,14 P121/c1 0.394,1.7598,0.5615,90,134.543,90 - - 7.28 A 14806
As-Se-Sm SmAs0.5 Se 0.5 NaCl,cF8,225 Fm-3m 0.591,0.591,0.591,90,90,90 rocksalt family - 7.32 X 14514
As-Se-Tb TbAsSe CeAsS,mP12,14 P121/c1 0.3899,1.7405,0.55428,90,134.683,90 - - 7.77 A 14806
As-Se-Th ThAsSe PbClF,tP6,129 P4/nmm 0.4084,0.4084,0.8578,90,90,90 - - 8.96 X 38822
As-Se-Tl TlAsSe2 TlAsSe2,mP64,14 P121/c1 0.6243,2.3633,1.23558,90,106.663,90 - gray 6.65 X 42490
As-Se-Tl Tl3AsSe3 Tl3AsSe3,hR21,160 R3m 0.987,0.987,0.7094,90,90,120 - - 7.70 X 8453
As-Se-Tl Tl3AsSe4 [NH4]3AsS4,oP32,62 Pnma 0.911,1.116,0.964,90,90,90 - - 6.80 A 17994
As-Se-Tm TmAsSe CeAsS,mP12,14 P121/c1 0.3849,1.7178,0.54681,90,134.741,90 - - 8.35 A 14806
As-Se-U UAsSe rt PbClF,tP6,129 P4/nmm 0.3987,0.3987,0.8381,90,90,90 - - 9.77 X 34742
As-Se-U UAs0.6 Se0.4 hp CsCl,cP2,221 Pm-3m 0.3294,0.3294,0.3294,90,90,90 b.c.c. family - 14.62 X 25213
As-Se-U UAs0.6 Se0.4 NaCl,cF8,225 Fm-3m 0.577,0.577,0.577,90,90,90 rocksalt family - 10.88 X 25213
As-Se-U UAs1.5 Se0.5 UAs2,tP6,129 P4/nmm 0.3972,0.3972,0.8284,90,90,90 - - 9.91 X 7725
As-Se-Y YAsSe CeAsS,mP12,14 P121/c1 0.3887,1.7346,0.55223,90,134.689,90 - - 6.09 A 14806
As-Se-Y YAs0.25 Se0.75 NaCl,cF8,225 Fm-3m 0.5733,0.5733,0.5733,90,90,90 rocksalt family - 5.88 X 5573
As-Se-Yb YbAs2Se4 *,o**,* - 0.398,1.134,1.304,90,90,90 - - - N 17430
As-Se-Yb YbAs4Se7 *,o**,* - 0.406,0.685,2.352,90,90,90 - - - N 17430
As-Se-Zr ZrAs0.76 Se 1.24 NbPS,oI12,71 Immm 0.3695,0.5243,1.2605,90,90,90 - - 6.69 A 47615
As-Se-Zr ZrAs1.15 Se 0.575 UAs2,tP6,129 P4/nmm 0.374,0.374,0.81,90,90,90 - golden 6.53 X 6735
As-Se-Zr ZrAs1.595 Se0.393 PbClF,tP6,129 P4/nmm 0.3783,0.3783,0.8136,90,90,90 - - 6.90 X 54907
As-Si-Sr Sr3Si2As4 Sr3Si2As4,mS36,15 C12/c1 0.9205,1.6832,0.7376,90,122.46,90 - gray 4.26 X 15619
As-Si-Sr Sr4SiAs4 Ba4SiAs4,cP72,218 P-43n 1.2711,1.2711,1.2711,90,90,90 - - 4.39 A 14689
As-Si-Ta TaSiAs PbClF,tP6,129 P4/nmm 0.3499,0.3499,0.7857,90,90,90 - - 9.80 X 7473
As-Si-Zn ZnSiAs2 rt CuFeS2,tI16,122 I-42d 0.56086,0.56086,1.0878,90,90,90 adamantane structure red 4.72 X 21721
As-Si-Zn Zn0.5 Si0.5 As m ZnS,cF8,216 F-43m 0.5545,0.5545,0.5545,90,90,90 adamantane structure - 4.74 X 6701
As-Si-Zr ZrSi0.39 As1.61 PbCl2,oP12,62 Pnma 0.66828,0.36377,0.91131,90,90,90 - - 6.68 X 54516
As-Si-Zr ZrSi0.57 As1.43 UAs2,tP6,129 P4/nmm 0.36539,0.36539,0.82399,90,90,90 - - 6.47 X 54516
As-Sm-Te SmAsTe TiNiSi,oP12,62 Pnma 0.7618,0.40821,0.9991,90,90,90 AlB2 family black 7.55 X 37205
As-Sm-Zn Zn0.67 SmAs2 CuHfSi2,tP8,129 P4/nmm 0.3952,0.3952,1.00993,90,90,90 - - 7.24 X 56883
As-Sm-Zn Zn2Sm0.67 As2 Ce2SO2,hP5,164 P-3m1 0.4154,0.4154,0.6924,90,90,120 - black 6.12 A 57506
As-Sm-Zn Zn3SmAs3 Zn3PrAs3,hP22,194 P63 /mmc 0.41501,0.41501,2.0357,90,90,120 - gray 6.25 X 56276
As-Sn-Sr SrSn2As2 NaSn2 As2 ,hR15,166 R-3m 0.4204,0.4204,2.6726,90,90,120 - - 5.78 X 31096
As-Sn-Sr Sr5Sn2As6 Ca5Sn2As6 ,oP26,55 Pbam 1.2482,1.4137,0.4244,90,90,90 - black 4.99 X 58334
As-Sn-Zn ZnSnAs2 rt CuFeS2,tI16,122 I-42d 0.58466,0.58466,1.17037,90,90,90 adamantane structure - 5.54 X 21721
As-Sn-Zn Zn0.5 Sn0.5 As ht ZnS,cF8,216 F-43m 0.5851,0.5851,0.5851,90,90,90 adamantane structure - 5.54 X 6701
As-Sr-Ti Sr4TiAs4 Ba4SiAs4,cP72,218 P-43n 1.2883,1.2883,1.2883,90,90,90 - gray silver 4.34 X 32424
As-Sr-Zn SrZn0.5 As BeZrSi,hP6,194 P63 /mmc 0.44185,0.44185,0.8042,90,90,120 AlB2 family - 4.77 X 57420
As-Sr-Zn SrZn2As2 Ce2SO2,hP5,164 P-3m1 0.4223,0.4223,0.7268,90,90,120 - black gray 5.45 X 13897
Handbook of Inorganic Substances – Edition 2015 : Data 263

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

As-Sr-Zn Sr2Zn2As3 Ba2Cd2As3,mS28,12 C12/m1 1.6212,0.42754,1.1955,90,126.271,90 - gray 5.28 X 58279


As-Te-Th ThAsTe PbClF,tP6,129 P4/nmm 0.426,0.426,0.8812,90,90,90 - - 9.03 A 4101
As-Te-Ti TiAsTe NbPS,oI12,71 Immm 0.3573,0.5249,1.2794,90,90,90 - black 6.93 X 41529
As-Te-U UAsTe tet1 La2Sb,tI12,139 I4/mmm 0.4148,0.4148,1.7256,90,90,90 - - 9.86 X 8498
As-Te-U UAsTe tet2 PbClF,tP6,129 P4/nmm 0.4167,0.4167,0.8764,90,90,90 - - 9.61 A 4101
As-Te-Zn Zn1.35 As0.7 Te0.3 ht2 CaF2 ,cF12,225 Fm-3m 0.5943,0.5943,0.5943,90,90,90 fluorite family gray 5.66 X 5976
As-Te-Zn Zn2.975 As1.95Te0.05 rt Cd3As2,tI160,110 I41cd 1.1814,1.1814,2.3628,90,90,90 - - 5.59 A 7424
As-Te-Zr ZrAs1.43 Te0.46 PbClF,tP6,129 P4/nmm 0.382,0.382,0.817,90,90,90 - golden 7.16 X 7579
As-Te-Zr ZrAs1.59 Te0.41 PbClF,tP6,129 P4/nmm 0.3837,0.3837,0.8197,90,90,90 - - 7.23 A 47615
As-Te-Zr Zr0.97 As0.70 Te1.28 NbPS,oI12,71 Immm 0.378,0.564,1.337,90,90,90 - - 7.09 X 6736
As-Te-Zr Zr2.29 AsTe2 Zr2.29 AsTe2,hR18,166 R-3m 0.39329,0.39329,2.9564,90,90,120 - - 6.78 X 34350
As-Th-U Th2.7 U0.3 As4 Th3P 4,cI28,220 I-43d 0.8815,0.8815,0.8815,90,90,90 - - 9.67 A 12769
As-Ti-V Ti0.43 V0.57 As rt FeAs,oP8,62 Pnma 0.6018,0.3496,0.6296,90,90,90 AlB2 family - 6.25 X 18753
As-Ti-V Ti0.52 V0.48 As ht NiAs,hP4,194 P63/mmc 0.3552,0.3552,0.6145,90,90,120 AlB2 family - 6.15 X 18753
As-Ti-W Ti2W3As4 Ti5 Te4,tI18,87 I4/m 0.9572,0.9572,0.3306,90,90,90 Chevrel phase - 10.38 X 2301
As-Ti-Zr Zr0.58 Ti1.42 As La2Sb,tI12,139 I4/mmm 0.37325,0.37325,1.4495,90,90,90 - - 6.44 X 38553
As-U-Y Y0.5 U0.5 As NaCl,cF8,225 Fm-3m 0.5789,0.5789,0.5789,90,90,90 rocksalt family - 8.16 X 18428
As-Yb-Zn Zn2YbAs2 Ce2SO2,hP5,164 P-3m1 0.4157,0.4157,0.6954,90,90,120 - gray 7.24 X 35918
Au-Ba-Bi BaAuBi BeZrSi,hP6,194 P63/mmc 0.4886,0.4886,0.9241,90,90,120 AlB2 family - 9.44 X 23592
Au-Ba-F BaAu2F12 BaAu2F12,cP60,215 P-43m 0.9901,0.9901,0.9901,90,90,90 - - 5.20 X 23989
Au-Ba-F BaAu2F8 BaAu2F8,tI44,82 I-4 0.9788,0.9788,0.76,90,90,90 - yellow 6.23 X 20862
Au-Ba-Ga BaAu0.3 Ga3.7 CeAl2Ga2,tI10,139 I4/mmm 0.455,0.455,1.086,90,90,90 - gray silver 6.71 X 26923
Au-Ba-Ge BaAu0.9 Ge1.1 AlB2 ,hP3,191 P6/mmm 0.4656,0.4656,0.4979,90,90,120 AlB2 family - 7.01 X 56797
Au-Ba-Ge BaAu1.6 Ge2.4 BaNiSn3,tI10,107 I4mm 0.4615,0.4615,1.0492,90,90,90 - - 9.31 X 56797
Au-Ba-Ge BaAu2Ge2 Ce(Ni0.59 Sb0.41 )4,oI10,71 Immm 0.4577,0.4656,1.0558,90,90,90 - - 9.99 X 56797
Au-Ba-Ge BaAu3Ge BaAu3Ge,tP10,129 P4/nmm 0.6459,0.6459,0.5487,90,90,90 - - 11.62 X 56797
Au-Ba-Ge BaAu3.16 Ge0.84 CeAl2Ga2,tI10,139 I4/mmm 0.465,0.465,1.056,90,90,90 - - 11.94 X 7079
Au-Ba-Ge BaAu5Ge2 BaAu5Ge2,oP32,62 Pnma 0.8981,0.7106,1.0363,90,90,90 - - 12.73 X 56797
Au-Ba-Ge Ba0.002 Au0.001 Ge0.997 C,cF8,227 Fd-3m 0.5658,0.5658,0.5658,90,90,90 - - 5.34 X 56797
Au-Ba-Ge Ba2Au10.6 Ge3.4 Ba2Au9(Au0.53 Ge0.47 )3Ge2,oP64,62 Pnma 0.8895,0.7175,2.0658,90,90,90 clathrate - 13.15 X 56797
Au-Ba-Ge Ba4Au3Ge20 Na4Si23,cP54,223 Pm-3n 1.07969,1.07969,1.07969,90,90,90 clathrate gray 6.84 X 55297
Au-Ba-Ge Ba6Au0.7 Ge24.3 K6Sn25,cP124,213 P4132 1.45598,1.45598,1.45598,90,90,90 clathrate - 5.87 A 56797
Au-Ba-In BaAuIn3 BaAl4,tI10,139 I4/mmm 0.48107,0.48107,1.198,90,90,90 - gray silver 8.13 X 42998
Au-Ba-In BaAu0.36 In1.64 KHg2,oI12,74 Imma 0.5104,0.8461,0.858,90,90,90 AlB2 family - 7.11 X 46425
Au-Ba-In BaAu2In2 ThRu2P 2,oP20,62 Pnma 0.8755,0.4712,1.2368,90,90,90 - - 9.91 X 48433
Au-Ba-N Ba3Au2N *,oS*,65 Cmmm 0.4998,1.71,0.4497,90,90,90 - - - N 40912
Au-Ba-O BaAu2O4 rt UPd2S4,tI28,88 I41/a 0.64297,0.64297,1.0251,90,90,90 - - 9.33 X 30656
Au-Ba-O Ba9Au2O12 Ba9Au2O12,oP92,62 Pnma 0.7133,1.7165,1.4093,90,90,90 - red 7.01 X 26110
Au-Ba-P BaAuP BeZrSi,hP6,194 P63/mmc 0.44068,0.44068,0.8998,90,90,120 AlB2 family black 8.02 X 53423
Au-Ba-Pt BaAu0.5 Pt0.5 TlI,oS8,63 Cmcm 0.43915,1.19149,0.4792,90,90,90 CrB(TlI)-FeB - 8.83 X 53491
Au-Ba-Sb BaAuSb BeZrSi,hP6,194 P63/mmc 0.47461,0.47461,0.93075,90,90,120 AlB2 family gray 8.34 X 39796
Au-Ba-Sb BaAu2Sb2 rt SrPd2Bi2,mP10,11 P121/m1 0.4899,0.4783,1.1102,90,91.16,90 - gray 9.89 X 47590
Au-Ba-Si BaAu0.9 Si1.1 AlB2 ,hP3,191 P6/mmm 0.4353,0.4353,0.4853,90,90,120 AlB2 family - 7.20 X 57566
Au-Ba-Si BaAu2.6 Si1.4 *,tP*,* - 1.053,1.053,0.845,90,90,90 - - - N 57566
Au-Ba-Si BaAu3Si BaAu3Ge,tP10,129 P4/nmm 0.6488,0.6488,0.5305,90,90,90 - - 11.25 X 57566
Au-Ba-Si BaAu5Si2 BaAu5Ge2,oP32,62 Pnma 0.8935,0.6939,1.0365,90,90,90 - - 12.18 X 57566
Au-Ba-Si Ba2Au4Si3 *,oI*,* - 0.65097,0.82267,2.38516,90,90,90 - - - N 57566
Au-Ba-Si Ba4Au3Si20 Na4Si23,cP54,223 Pm-3n 1.0422,1.0422,1.0422,90,90,90 clathrate gray 4.99 X 24843
Au-Ba-Si Ba4Au3.05 Si19.95 Cs4(In0.27 Ge0.73)15Ge8,cP54,223 Pm-3n 1.04177,1.04177,1.04177,90,90,90 - - 5.02 A 57213
Au-Ba-Sn BaAuSn KHg2,oI12,74 Imma 0.4935,0.8172,0.8445,90,90,90 AlB2 family - 8.83 A 40784
Au-Ba-Te Ba7Au2 Te14 Ba7Au2 Te14,hP48,193 P63/mcm 1.42593,1.42593,0.92726,90,90,120 - - 6.39 X 48388
Au-Ba-Tl BaAuTl3 BaAl4,tI10,139 I4/mmm 0.48604,0.48604,1.218,90,90,90 - gray silver 10.94 X 42998
Au-Ba-Tl BaAu0.40 Tl1.60 KHg2,oI12,74 Imma 0.514,0.8317,0.8809,90,90,90 AlB2 family - 9.58 X 46425
Au-Ba-Tl Ba2AuTl7 Ba2AuTl7,oP40,62 Pnma 2.1919,0.5193,1.0447,90,90,90 - - 10.63 X 42962
Au-Ba-Zn BaAu2Zn11 NaZn13,cF112,226 Fm-3c 1.24485,1.24485,1.24485,90,90,90 - - 8.61 X 58271
Au-Ba-Zn BaAu6Zn7 SrNi4(Ni0.46 Si0.54 )5Si4,tP56,125 P4/nbm 0.88945,0.88945,1.26457,90,90,90 - - 11.80 X 58271
Au-Bi-Br AuBiBr6 AuBiCl6,aP32,2 P-1 0.7357,1.0557,1.445,104.88,94.25,110.18 - red dark 5.87 X 33788
Au-Bi-Br AuBi9Br9 AuBi8 AsCl9,mP76,14 P121/c1 1.05902,1.5286,1.46355,90,93.69,90 - black 7.86 X 51524
Au-Bi-Ca CaAuBi MgAgAs,cF12,216 F-43m 0.6851,0.6851,0.6851,90,90,90 - - 9.21 X 20687
Au-Bi-Ca CaAu4.85 Bi0.15 MgCu4Sn,cF24,216 F-43m 0.77646,0.77646,0.77646,90,90,90 Friauf-Laves phase - 14.57 X 54458
Au-Bi-Ce Au3Ce 3Bi4 Au3 Y3Sb4,cI40,220 I-43d 1.0209,1.0209,1.0209,90,90,90 - - 11.53 A 38029
Au-Bi-Cl AuBiCl6 AuBiCl6,aP32,2 P-1 0.6983,1.0093,1.381,104.98,94.73,110.06 - orange 4.74 X 33788
Au-Bi-Dy Au2Dy5Bi Mo5 SiB2,tI32,140 I4/mcm 0.7952,0.7952,1.3396,90,90,90 - - 11.10 X 48631
Au-Bi-Er Au2Er5Bi Mo5 SiB2,tI32,140 I4/mcm 0.79007,0.79007,1.32,90,90,90 - - 11.60 X 48631
Au-Bi-Eu AuEuBi LiGaGe,hP6,186 P63mc 0.4799,0.4799,0.8295,90,90,120 AlB2 family - 11.20 A 23592
Au-Bi-F Au5Bi2F21 Au5La2F21,tP112,92 P41212 0.82289,0.82289,2.5571,90,90,90 - yellow 6.91 X 40841
Au-Bi-Gd Au2Gd5Bi Mo5 SiB2,tI32,140 I4/mcm 0.80522,0.80522,1.3424,90,90,90 - - 10.60 X 48631
Au-Bi-Ho Au2Ho 5Bi Mo5 SiB2,tI32,140 I4/mcm 0.79583,0.79583,1.32046,90,90,90 - - 11.34 X 48631
Au-Bi-K K2AuBi Na2CuAs,oS16,63 Cmcm 1.0632,0.7918,0.6597,90,90,90 - - 5.79 X 55514
Au-Bi-La Au3La3Bi4 Au3 Y3Sb4,cI40,220 I-43d 1.0276,1.0276,1.0276,90,90,90 - - 11.29 A 38029
Au-Bi-Li Li2AuBi Li2AgSb,cF16,216 F-43m 0.665,0.665,0.665,90,90,90 b.c.c. family gray 9.48 X 4311
Au-Bi-Na Na2AuBi Na2CuAs,oS16,63 Cmcm 0.9447,0.77,0.5849,90,90,90 - - 7.06 X 55514
Au-Bi-Nd Au3Nd3Bi4 Au3 Y3Sb4,cI40,220 I-43d 1.0135,1.0135,1.0135,90,90,90 - - 11.86 A 38029
Au-Bi-O AuBi2O5 AuBi2O5,tP32,130 P4/ncc 0.86703,0.86703,0.60301,90,90,90 - - 10.18 X 32021
Au-Bi-O Au2Bi4O9 Au2Bi4O9,oP120,61 Pbca 0.5889,3.4647,0.8847,90,90,90 - - 10.11 X 32021
Au-Bi-Pb AuPb3Bi PtPb3Bi,tP20,136 P42/mnm 1.1485,1.1485,0.4264,90,90,90 - - 12.14 X 37402
Au-Bi-Pr Au3Pr3Bi4 Au3 Y3Sb4,cI40,220 I-43d 1.0163,1.0163,1.0163,90,90,90 - - 11.70 A 38029
Au-Bi-Sr SrAuBi BeZrSi,hP6,194 P63/mmc 0.4795,0.4795,0.8677,90,90,120 AlB2 family - 9.49 X 23592
264 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Bi-Tb Au2 Tb5Bi Mo5SiB2,tI32,140 I4/mcm 0.79856,0.79856,1.342,90,90,90 - - 10.85 X 48631


Au-Bi-Yb AuYbBi ht LiGaGe,hP6,186 P63 mc 0.4734,0.4734,0.7814,90,90,120 AlB2 family - 12.68 A 23592
Au-Bi-Yb AuYbBi rt MgAgAs,cF12,216 F-43m 0.6846,0.6846,0.6846,90,90,90 - - 11.99 X 23592
Au-Br-Cs CsAuBr3 CsAuCl3,tI20,139 I4/mmm 0.77869,0.77869,1.13808,90,90,90 - golden 5.48 X 58652
Au-Br-Cs CsAu0.67 [Br3]0.13 Br2.87 CsAu0.67 [Br3]0.13Br2.87 ,cP8,221 Pm-3m 0.5475,0.5475,0.5475,90,90,90 - - 5.32 X 15767
Au-Br-Cs Cs3Au2[Br3]Br8 Cs3Au2[Br3]Br8,mP64,14 P121/c1 0.7706,1.6063,1.8454,90,93.65,90 - red 4.87 X 14791
Au-Br-F [BrF2]AuF4 [BrF2]AuF4,mP16,4 P1211 0.5356,0.5766,0.8649,90,101.39,90 - golden 4.96 X 38978
Au-Br-K KAuBr4 KAuI4,mP24,14 P121/c1 0.90306,0.66484,1.28,90,96.88,90 - red dark 4.84 X 35431
Au-Br-K K3Au3Br8 rt Rb3Au3Cl8 ,mS56,15 C12/c1 1.2202,0.7717,1.916,90,97.96,90 - - 5.01 A 12821
Au-Br-Rb RbAuBr3 rt RbAuBr3,mS20,12 C12/m1 1.26894,0.7243,0.852,90,119.949,90 - green 5.11 X 12821
Au-Br-Rb RbAuBr4 RbAuBr4,mP12,14 P121/c1 0.7436,0.6214,1.0299,90,121.33,90 - - 4.92 X 6362
Au-Br-Rb Rb3Au3Br8 rt Rb3Au3Cl8 ,mS56,15 C12/c1 1.2539,0.7853,1.899,90,98.36,90 - - 5.34 A 12821
Au-Br-Se AuSeBr AuSeBr,oP24,62 Pnma 0.677,1.222,0.738,90,90,90 - gray dark 7.74 X 7574
Au-Br-Te AuTeBr8 AuTeBr8,aP20,2 P-1 0.7936,0.8992,0.9959,86.48,73.34,82.86 - black 4.74 X 20914
Au-C-Cs CsAuC2 KAgC2,tP4,123 P4/mmm 0.461,0.461,0.519,90,90,90 - yellow pale 5.33 X 38240
Au-C-K KAuC2 KAgC2,tP4,123 P4/mmm 0.4184,0.4184,0.516,90,90,90 - yellow pale 4.78 X 38240
Au-C-Li LiAuC2 LiAgC2,hP4,187 P-6m2 0.3787,0.3787,0.5194,90,90,120 - yellow pale 5.87 X 38240
Au-C-N Au[CN] hex1 Au[CN],hP3,183 P6mm 0.3396,0.3396,0.5092,90,90,120 - - 7.28 X 34351
Au-C-N Au[CN] hex2 Au[CN],hP3,191 P6/mmm 0.33915,0.33915,0.50726,90,90,120 - yellow 7.33 X 41549
Au-C-Na NaAuC2 KAgC2,tP4,123 P4/mmm 0.373,0.373,0.52,90,90,90 - yellow pale 5.60 X 38240
Au-C-Rb RbAuC2 KAgC2,tP4,123 P4/mmm 0.422,0.422,0.519,90,90,90 - yellow pale 5.51 X 38240
Au-C-Y Au0.2 Y1.8 C2.6 Pu2C3,cI40,220 I-43d 0.82503,0.82503,0.82503,90,90,90 - - 5.46 A 4710
Au-Ca-Cd CaAuCd TiNiSi,oP12,62 Pnma 0.73499,0.43366,0.8737,90,90,90 AlB2 family gray silver 8.34 X 53597
Au-Ca-Cd CaAu0.13 Cd0.87 CsCl,cP2,221 Pm-3m 0.38229,0.38229,0.38229,90,90,90 b.c.c. family - 4.86 X 54920
Au-Ca-Cd CaAu0.89 Cd0.11 TlI,oS8,63 Cmcm 0.3977,1.1227,0.4615,90,90,90 CrB(TlI)-FeB - 7.34 X 54920
Au-Ca-Cd Ca11Au4Cd18 Ca11Au2(Au0.5 Cd0.5 )4Cd16,tI132,141 I41/amd 1.02939,1.02939,3.051,90,90,90 - gray silver 6.68 X 53597
Au-Ca-Cd Ca5Au10Cd2 Ca4Au10In3,oS68,64 Cmce 1.3906,1.0157,1.0256,90,90,90 - gray silver 10.98 X 53597
Au-Ca-Cd Ca5Au2Cd Mo5SiB2,tI32,140 I4/mcm 0.8003,0.8003,1.4618,90,90,90 - - 5.01 A 57498
Au-Ca-F CaAu2F12 CaAu2F12,tP15,81 P-4 0.50191,0.50191,0.8428,90,90,90 - - 5.18 X 23989
Au-Ca-Ga CaAu0.5 Ga3.5 BaAl4,tI10,139 I4/mmm 0.42187,0.42187,1.1232,90,90,90 - - 6.36 X 28831
Au-Ca-Ga CaAu3Ga NaAu3Si,cP40,205 Pa-3 0.90882,0.90882,0.90882,90,90,90 - - 12.40 X 50422
Au-Ca-Ga Ca3Au6.61 Ga4.39 Ca3Au6(Au0.3 Ga0.7 )2Ga3,hP28,194 P63 /mmc 0.9266,0.9266,0.7331,90,90,120 - - 10.53 X 39479
Au-Ca-Ge CaAuGe ht Sr(Ag0.5 Ge0.5)2,mS30,12 C12/m1 1.0609,0.4483,1.3497,90,98.06,90 - - 8.09 X 34414
Au-Ca-Ge CaAuGe rt AuYbGe,oP36,62 Pnma 2.1526,0.4494,0.7726,90,90,90 - - 8.26 X 34414
Au-Ca-Ge CaAu0.7 Ge 1.3 AlB2,hP3,191 P6/mmm 0.429,0.429,0.4225,90,90,120 AlB2 family - 6.72 X 34414
Au-Ca-Ge CaAu1.24 Ge0.76 AuEuGe,oI12,44 Imm2 0.4523,0.7154,0.7802,90,90,90 - - 8.93 X 34414
Au-Ca-Ge CaAu2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.44407,0.44407,1.0266,90,90,90 - - 9.50 X 52293
Au-Ca-Ge Ca13Au50Ge 22 Ca13Au50Ge22,cI170,204 Im-3 1.46704,1.46704,1.46704,90,90,90 - - 12.59 X 54337
Au-Ca-Ge Ca3Au7.16 Ge 3.84 Ca3Au7(Au0.08 Ge0.92 )2Ge2,oI28,44 Imm2 0.43987,1.306,0.96032,90,90,90 - - 10.89 X 52293
Au-Ca-Ge Ca3Au7.50 Ge 3.50 Ca3Au7(Au0.25 Ge0.75 )2Ge2,oP28,58 Pnnm 0.95598,1.31311,0.44214,90,90,90 - - 11.08 X 52293
Au-Ca-Hg Ca4Au4.5 Hg4.5 Au6(Au0.5 In0.5 )6In,cP76,215 P-43m 1.114,1.114,1.114,90,90,90 γ-brass - 9.37 A 13877
Au-Ca-In CaAuIn TiNiSi,oP12,62 Pnma 0.7382,0.4594,0.8394,90,90,90 AlB2 family gray silver 8.21 X 35156
Au-Ca-In CaAuIn2 MgCuAl2,oS16,63 Cmcm 0.45635,1.0748,0.75969,90,90,90 - gray light 8.32 X 36671
Au-Ca-In Ca2Au3 In4 Ca2Au3 In4 ,oP36,62 Pnma 1.4636,0.44323,1.2723,90,90,90 - - 9.10 X 36680
Au-Ca-In Ca3Au3 In Ca3Au3 In,oP28,62 Pnma 1.6647,0.4569,0.8947,90,90,90 - - 8.06 X 51559
Au-Ca-In Ca4Au10In3 Ca4Au10In3,oS68,64 Cmce 1.3729,1.005,1.016,90,90,90 - - 11.72 X 48481
Au-Ca-Mg CaMg2Au MgCuAl2,oS16,63 Cmcm 0.43127,1.0753,0.8262,90,90,90 - - 4.95 A 59742
Au-Ca-Mg Ca4MgAu Gd4RhIn,cF96,216 F-43m 1.4663,1.4663,1.4663,90,90,90 - - 3.22 A 59572
Au-Ca-N Ca2AuN Ca2AuN,oS16,63 Cmcm 0.35814,1.80642,0.49191,90,90,90 - gray dark 6.08 X 34016
Au-Ca-N Ca3AuN CaTiO3,cP5,221 Pm-3m 0.48215,0.48215,0.48215,90,90,90 perovskite family blue violet 4.91 X 27106
Au-Ca-O CaAu2O4 UPd2S4,tI28,88 I41/a 0.59868,0.59868,1.0043,90,90,90 - colorless 9.19 X 32696
Au-Ca-P CaAuP BeZrSi,hP6,194 P63 /mmc 0.4245,0.4245,0.787,90,90,120 AlB2 family gray 7.25 X 20687
Au-Ca-Pb Ca2Au2Pb Mo2FeB2,tP10,127 P4/mbm 0.8038,0.8038,0.38254,90,90,90 - gray 9.15 X 39612
Au-Ca-Pt CaAu0.5 Pt0.5 TlI,oS8,63 Cmcm 0.39858,1.092,0.45249,90,90,90 CrB(TlI)-FeB black 7.96 X 55366
Au-Ca-Sb CaAuSb LiGaGe,hP6,186 P63 mc 0.4606,0.4606,0.7789,90,90,120 AlB2 family - 8.33 X 20687
Au-Ca-Si CaAu0.64 Si1.36 AlB2,hP3,191 P6/mmm 0.4151,0.4151,0.428,90,90,120 AlB2 family - 5.31 X 36681
Au-Ca-Si CaAu1.2 Si0.8 AuEuGe,oI12,44 Imm2 0.4454,0.7139,0.7667,90,90,90 - - 8.14 X 36681
Au-Ca-Si CaAu2Si2 CeAl2Ga2,tI10,139 I4/mmm 0.432,0.432,1.002,90,90,90 - - 8.71 X 10313
Au-Ca-Sn CaAuSn CaAuSn,oP60,62 Pnma 3.6903,0.4705,0.8136,90,90,90 - gray silver 8.36 X 35156
Au-Ca-Sn Ca14Au46.15 Sn4.53 Ag51Gd14,hP68,175 P6/m 1.27946,1.27946,0.93643,90,90,120 - - 12.74 X 56301
Au-Ca-Sn Ca3Au14.39 Sn4.35 Au12.90 Pr3 Sn5.31 ,cI208,204 Im-3 1.5131,1.5131,1.5131,90,90,90 - gray silver 13.31 X 54271
Au-Cd-Ce AuCdCe ZrNiAl,hP9,189 P-62m 0.78291,0.78291,0.41001,90,90,120 Fe2P family gray light 10.29 X 39433
Au-Cd-Ce Au2CdCe2 Mo2FeB2,tP10,127 P4/mbm 0.80493,0.80493,0.39336,90,90,90 - gray light 10.25 A 38336
Au-Cd-Dy AuCdDy ZrNiAl,hP9,189 P-62m 0.7686,0.7686,0.3901,90,90,120 Fe2P family gray light 11.78 A 39433
Au-Cd-Er AuCdEr ZrNiAl,hP9,189 P-62m 0.7666,0.7666,0.3862,90,90,120 Fe2P family gray light 12.08 A 39433
Au-Cd-Eu AuCdEu TiNiSi,oP12,62 Pnma 0.7552,0.45059,0.8786,90,90,90 AlB2 family gray light 10.25 X 39433
Au-Cd-Eu Au2CdEu5 Mo5SiB2,tI32,140 I4/mcm 0.8327,0.8327,1.5128,90,90,90 - - 8.02 A 57498
Au-Cd-F Au2CdF12 Au2CdF12,mS60,15 C12/c1 1.1167,0.87666,1.008,90,118.026,90 - - 5.60 X 47523
Au-Cd-F Au2CdF8 Au2CdF8,tP22,124 P4/mcc 0.5741,0.5741,1.0333,90,90,90 - yellow 6.42 X 33775
Au-Cd-Gd AuCdGd ZrNiAl,hP9,189 P-62m 0.7701,0.7701,0.396,90,90,120 Fe2P family gray light 11.43 X 43297
Au-Cd-Ho AuCdHo ZrNiAl,hP9,189 P-62m 0.76696,0.76696,0.38847,90,90,120 Fe2P family gray light 11.94 A 39433
Au-Cd-In Au0.775 Cd0.175 In0.050 Nd,hP4,194 P63 /mmc 0.29075,0.29075,0.95414,90,90,120 close-packed structure - 16.93 X 7440
Au-Cd-In Au3Cd0.08 In0.92 rt Cu3Ti,oP8,59 Pmmn 0.475,0.584,0.5095,90,90,90 close-packed structure - 16.58 A 1166
Au-Cd-La AuCdLa ZrNiAl,hP9,189 P-62m 0.7862,0.7862,0.4159,90,90,120 Fe2P family gray light 10.03 X 39433
Au-Cd-La Au2CdLa2 Mo2FeB2,tP10,127 P4/mbm 0.8092,0.8092,0.40027,90,90,90 - gray light 9.94 A 39433
Au-Cd-Mg Mg0.6 AuCd0.4 CsCl,cP2,221 Pm-3m 0.329,0.329,0.329,90,90,90 b.c.c. family - 11.96 X 14656
Au-Cd-Na Na6Au7Cd16 Mg6Cu16Si7,cF116,225 Fm-3m 1.3589,1.3589,1.3589,90,90,90 - - 8.78 X 56373
Au-Cd-Nd AuCdNd ZrNiAl,hP9,189 P-62m 0.7773,0.7773,0.4042,90,90,120 Fe2P family gray light 10.68 A 39433
Handbook of Inorganic Substances – Edition 2015 : Data 265

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Cd-Nd Au2CdNd2 Mo2 FeB2,tP10,127 P4/mbm 0.7972,0.7972,0.3885,90,90,90 - gray light 10.69 A 39433
Au-Cd-Pr AuCdPr ZrNiAl,hP9,189 P-62m 0.7799,0.7799,0.40762,90,90,120 Fe2P family gray light 10.45 A 39433
Au-Cd-Pr Au2CdPr2 Mo2 FeB2,tP10,127 P4/mbm 0.80067,0.80067,0.391,90,90,90 - gray light 10.44 A 39433
Au-Cd-Sb AuCdSb MgAgAs,cF12,216 F-43m 0.62532,0.62532,0.62532,90,90,90 - - 11.71 X 7791
Au-Cd-Sm AuCdSm ZrNiAl,hP9,189 P-62m 0.7737,0.7737,0.3996,90,90,120 Fe2P family gray light 11.06 A 39433
Au-Cd-Sm Au2CdSm2 Mo2 FeB2,tP10,127 P4/mbm 0.7914,0.7914,0.3827,90,90,90 - gray light 11.18 A 39433
Au-Cd-Sn AuCdSn CaF2 ,cF12,225 Fm-3m 0.65033,0.65033,0.65033,90,90,90 fluorite family - 10.34 X 10264
Au-Cd-Sr SrAu0.78 Cd0.22 Ca(Cu0.80 Zn0.20),oP32,62 Pnma 3.2433,0.47417,0.6262,90,90,90 CrB(TlI)-FeB - 7.34 X 54920
Au-Cd-Sr SrAu0.93 Cd0.07 (Y0.3 Gd0.7)Ni,mP12,11 P121/m1 0.6213,0.4724,1.2161,90,96.97,90 CrB(TlI)-FeB - 7.84 X 54920
Au-Cd-Sr SrAu1.55 Cd0.45 TiNiSi,oP12,62 Pnma 0.7584,0.4746,0.8292,90,90,90 AlB2 family gray silver 9.87 X 53597
Au-Cd-Tb AuCdTb ZrNiAl,hP9,189 P-62m 0.7695,0.7695,0.3924,90,90,120 Fe2P family gray light 11.59 A 39433
Au-Cd-Tm AuCdTm ZrNiAl,hP9,189 P-62m 0.7663,0.7663,0.3824,90,90,120 Fe2P family gray light 12.25 A 39433
Au-Cd-Y AuCdY ZrNiAl,hP9,189 P-62m 0.7722,0.7722,0.3911,90,90,120 Fe2P family gray light 9.82 A 39433
Au-Cd-Yb AuCdYb TiNiSi,oP12,62 Pnma 0.73164,0.43294,0.8758,90,90,90 AlB2 family gray light 11.55 X 39433
Au-Cd-Yb Au2CdYb5 Mo5 SiB2,tI32,140 I4/mcm 0.7972,0.7972,1.4388,90,90,90 - - 9.96 X 57498
Au-Cd-Zn AuZn0.5 Cd0.5 CsCl,cP2,221 Pm-3m 0.323,0.323,0.323,90,90,90 b.c.c. family - 14.09 X 16357
Au-Cd-Zn Au3Zn0.84 Cd0.16 SrPb3,tP4,123 P4/mmm 0.4019,0.4019,0.4095,90,90,90 close-packed structure - 16.67 X 723
Au-Ce-Cu Cu5AuCe rt Cu5AuCe,oP28,62 Pnma 0.82455,0.50866,1.03659,90,90,90 - - 10.00 X 27144
Au-Ce-Ga AuCeGa KHg2,oI12,74 Imma 0.4595,0.742,0.7881,90,90,90 AlB2 family - 10.06 A 38823
Au-Ce-Ga Au0.6 CeGa3.4 CeAl2Ga2,tI10,139 I4/mmm 0.4354,0.4354,1.0582,90,90,90 - - 8.20 X 31840
Au-Ce-Ga Au1.5 CeGa2.5 CaBe2Ge2,tP10,129 P4/nmm 0.4349,0.4349,1.0636,90,90,90 - - 10.07 A 31840
Au-Ce-Ge AuCeGe hp TiNiSi,oP12,62 Pnma 0.7159,0.43842,0.7674,90,90,90 AlB2 family - 11.30 X 45758
Au-Ce-Ge AuCeGe ht MgAgAs,cF12,216 F-43m 0.6801,0.6801,0.6801,90,90,90 - - 8.65 X 49619
Au-Ce-Ge AuCeGe rt NdPtSb,hP6,186 P63mc 0.44555,0.44555,0.78994,90,90,120 AlB2 family gray 10.02 X 45758
Au-Ce-Ge AuCe2Ge6 CuCe2Ge6,oS18,38 Amm2 0.42587,0.41263,2.1852,90,90,90 - - 7.89 A 30286
Au-Ce-Ge Au0.28 CeGe1.72 ThSi2,tI12,141 I41/amd 0.42415,0.42415,1.464,90,90,90 - - 8.07 X 55047
Au-Ce-Ge Au0.43 Ce5Ge3.57 Sm5 Ge4,oP36,62 Pnma 0.7868,1.5258,0.8052,90,90,90 - gray silver 7.18 X 44309
Au-Ce-Ge Au0.75 CeGe1.25 AlB2 ,hP3,191 P6/mmm 0.4335,0.4335,0.4226,90,90,120 AlB2 family gray silver 9.14 X 33258
Au-Ce-Ge Au2CeGe 2 CeAl2Ga2,tI10,139 I4/mmm 0.4367,0.4367,1.0407,90,90,90 - - 11.37 X 26618
Au-Ce-In AuCeIn ZrNiAl,hP9,189 P-62m 0.7688,0.7688,0.4262,90,90,120 Fe2P family - 10.32 X 48098
Au-Ce-In Au2CeIn rt Cu2MnAl,cF16,225 Fm-3m 0.709,0.709,0.709,90,90,90 b.c.c. family - 12.09 X 19115
Au-Ce-In Au2CeIn4 lt NdRh2Sn4,oP28,62 Pnma 1.8514,0.46624,0.7389,90,90,90 - - 10.34 X 48456
Au-Ce-In Au2Ce 2In Mo2 FeB2,tP10,127 P4/mbm 0.80474,0.80474,0.39407,90,90,90 - gray silver 10.27 X 32282
Au-Ce-In Au3Ce 2In5 Au3Ce2In5,oP80,31 Pmn21 0.46527,5.3483,0.7405,90,90,90 - gray light 10.42 X 36319
Au-Ce-Mg MgAuCe ZrNiAl,hP9,189 P-62m 0.7741,0.7741,0.4216,90,90,120 Fe2P family gray light 8.23 A 38196
Au-Ce-Mg Mg2.5 Au0.5 Ce rt BiF3 ,cF16,225 Fm-3m 0.744,0.744,0.744,90,90,90 b.c.c. family - 4.83 X 21342
Au-Ce-P AuCe2P 3 U2NiC3,oP24,62 Pnma 0.77414,0.42111,1.6123,90,90,90 - - 7.21 X 39464
Au-Ce-Pb AuCePb CaIn2,hP6,194 P63/mmc 0.4802,0.4802,0.7739,90,90,120 AlB2 family - 11.70 X 21319
Au-Ce-Pb Au2Ce 2Pb U2Pt2Sn,tP20,136 P42/mnm 0.81012,0.81012,0.7905,90,90,90 - gray light 11.28 A 58526
Au-Ce-Sb Au0.882 CeSb2 CuHfSi2,tP8,129 P4/nmm 0.44187,0.44187,1.02167,90,90,90 - - 9.28 X 52500
Au-Ce-Sb Au1.468 CeSb0.532 Hg2U,hP3,191 P6/mmm 0.47256,0.47256,0.36711,90,90,120 AlB2 family - 11.56 X 48581
Au-Ce-Sb Au2Ce 3Sb3 Cu2U3Sb3,hP16,194 P63/mmc 0.45966,0.45966,2.4005,90,90,120 - - 8.92 X 52500
Au-Ce-Sb Au3Ce 3Sb4 Au3 Y3Sb4,cI40,220 I-43d 1.00029,1.00029,1.00029,90,90,90 - - 9.94 X 49370
Au-Ce-Si AuCe2Si3 m *,t**,* - 0.42224,0.42224,1.4375,90,90,90 - gray silver - N 33116
Au-Ce-Si AuCe2Si3 rt *,hP*,* - 0.8284,0.8284,0.8701,90,90,120 - gray silver - N 33116
Au-Ce-Si Au2CeSi2 CeAl2Ga2,tI10,139 I4/mmm 0.43072,0.43072,1.0196,90,90,90 - - 10.36 X 50971
Au-Ce-Si Au4CeSi2 orth CeRe 4Si2,oS14,65 Cmmm 0.4316,1.3741,0.435,90,90,90 - - 12.67 X 50971
Au-Ce-Si Au4CeSi2 tet Au4CeSi2,tP28,115 P-4m2 0.43304,0.43304,2.7409,90,90,90 - - 12.72 X 46695
Au-Ce-Sn AuCeSn NdPtSb,hP6,186 P63mc 0.4727,0.4727,0.7716,90,90,120 AlB2 family gray dark 10.14 X 39656
Au-Ce-Sn AuCe5Sn3 CuHf5Sn3,hP18,193 P63/mcm 0.9645,0.9645,0.6754,90,90,120 AlB2 family - 7.65 A 38813
Au-Ce-Sn Au1.5 CeSn0.5 *,h**,* - 0.8313,0.8313,0.9528,90,90,120 - - - N 38813
Au-Ce-Sn Au2CeSn *,hP16,* - 0.9517,0.9517,0.9591,90,90,120 - - - N 38813
Au-Ce-Sn Au2CeSn2 *,oP*,* - 0.4575,1.0176,1.359,90,90,90 - - - N 38813
Au-Ce-Sn Au28.4 Ce6Sn5.4 Au28.4 Ce6Sn5.4 ,cI168,197 I23 1.5118,1.5118,1.5118,90,90,90 - - 13.60 X 38813
Au-Ce-Sn Au3Ce 2Sn4 *,tP*,* - 0.9142,0.9142,1.0359,90,90,90 - - - N 38813
Au-Ce-Zn AuZnCe TiNiSi,oP12,62 Pnma 0.7192,0.4627,0.7965,90,90,90 AlB2 family - 10.09 X 51647
Au-Cl-Cs CsAuCl3 cub BaBiO3,cF40,225 Fm-3m 1.046,1.046,1.046,90,90,90 perovskite family - 5.06 X 129
Au-Cl-Cs CsAuCl3 hp CaTiO3,cP5,221 Pm-3m 0.47694,0.47694,0.47694,90,90,90 perovskite family golden 6.68 X 34909
Au-Cl-Cs CsAuCl3 m ZnMn3C,tP5,123 P4/mmm 0.48196,0.48196,0.48293,90,90,90 - - 6.46 X 48934
Au-Cl-Cs CsAuCl3 rt CsAuCl3,tI20,139 I4/mmm 0.75004,0.75004,1.08836,90,90,90 - golden 4.73 X 48934
Au-Cl-Cs CsAuCl4 RbAuCl4,mS24,15 C12/c1 1.2923,0.61715,0.96512,90,105.049,90 - orange 4.21 X 57526
Au-Cl-K KAuCl4 mon1 KAuCl4,mP24,7 P1c1 0.8671,0.6386,1.2243,90,95.37,90 - golden 3.72 X 7125
Au-Cl-K KAuCl4 mon2 KAuI4,mP24,14 P121/c1 0.8619,0.635,1.2169,90,95.72,90 - yellow 3.79 X 26226
Au-Cl-Na NaAuCl4 NaAuCl4,mP96,14 P121/c1 1.1277,1.1234,2.08328,90,107.013,90 - - 3.81 X 20938
Au-Cl-O AuClO AuClO,hR54,148 R-3 1.36242,1.36242,0.63759,90,90,120 - - 7.24 X 12147
Au-Cl-O [ClO2]Au[ClO4]4 [ClO2]Au[ClO4]4,mS96,15 C12/c1 1.50474,0.52944,1.74645,90,94.201,90 - orange 3.17 X 40052
Au-Cl-P AuPCl4 AuPCl4,mP24,14 P121/c1 0.7237,1.452,0.6091,90,95.99,90 - yellow pale 3.86 X 26226
Au-Cl-P AuPCl8 PICl8,oI80,74 Imma 1.2433,1.5734,1.1646,90,90,90 - yellow 2.98 X 19858
Au-Cl-Rb RbAuCl4 RbAuCl4,mS24,15 C12/c1 1.25115,0.5902,0.976,90,102.422,90 - - 4.00 X 5606
Au-Cl-Rb Rb3Au3Cl8 rt Rb3Au3Cl8,mS56,15 C12/c1 1.202,0.7522,1.829,90,97.62,90 - - 4.58 X 12821
Au-Cl-S AuSCl5 AuSCl5,mP28,14 P121/c1 0.8067,0.827,1.28826,90,115.876,90 - - 3.49 X 25327
Au-Cl-S AuSCl7 AuSeCl7,mP36,14 P121/c1 0.8637,1.024,1.1618,90,107.88,90 - yellow 3.24 X 20984
Au-Cl-Se AuSeCl7 AuSeCl7,mP36,14 P121/c1 0.8484,1.0184,1.2135,90,108.37,90 - orange 3.50 X 19904
Au-Cl-Te AuTeCl7 AuTeCl7,aP18,2 P-1 0.7564,0.772,0.8964,78.26,88.84,89.35 - orange 3.71 X 19782
Au-Cl-Te AuTe 2Cl AuTe 2Cl,oS16,63 Cmcm 0.40199,1.18666,0.87728,90,90,90 - white silver7.74 X 8354
Au-Cl-Tl AuTlCl4 RbAuCl4,mS24,15 C12/c1 1.2298,0.5825,0.9681,90,102.09,90 - - 5.32 X 19845
Au-Co-Fe Au0.012 Fe0.129 Co0.859 Cu,cF4,225 Fm-3m 0.3565,0.3565,0.3565,90,90,90 close-packed structure - 8.82 X 5487
Au-Co-Sn AuCo 1.666 Sn4 Ni3Sn4,mS14,12 C12/m1 1.2603,0.4213,0.5229,90,104.62,90 - - 9.52 X 31771
266 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Co-Sn Au0.58 Co0.92 Sn Co1.75 Ge,hP6,194 P63 /mmc 0.416,0.416,0.54,90,90,120 AlB2 family - 11.78 X 31771
Au-Co-Sn Au0.76 Co0.24 Sn NiAs,hP4,194 P63 /mmc 0.42,0.42,0.542,90,90,120 AlB2 family - 11.33 X 31771
Au-Cr-Mn Au2Cr0.1 Mn0.9 MoSi2,tI6,139 I4/mmm 0.3356,0.3356,0.8732,90,90,90 b.c.c. family - 15.15 A 35833
Au-Cr-Nb Au0.9 Nb3.04 Cr0.06 Cr3Si,cP8,223 Pm-3n 0.52139,0.52139,0.52139,90,90,90 Frank-Kasper phase - 10.84 X 19439
Au-Cr-S AuCrS2 lt CuMnO2,mS8,12 C12/m1 0.59879,0.34976,0.74197,90,105.444,90 - - 6.94 X 57193
Au-Cr-S AuCrS2 rt AuCrS2,hR12,160 R3m 0.34823,0.34823,2.1463,90,90,120 - black 6.92 X 36325
Au-Cr-Sn Au0.58 CrSn4.42 (Au0.58 Sn0.42 )CrSn4,tP12,124 P4/mcc 0.6874,0.6874,0.5657,90,90,90 - - 8.58 X 37391
Au-Cr-Sn Au0.80 Cr0.07 Sn0.13 ht Mg,hP2,194 P63 /mmc 0.29093,0.29093,0.47791,90,90,120 close-packed structure - 16.75 X 37391
Au-Cr-Te AuCrTe4 ZrTiTe4,mP6,10 P12/m1 0.54774,0.40169,0.73692,90,89.396,90 - black 7.78 X 43444
Au-Cs-F CsAuF4 CsAuF4,oI24,71 Immm 0.5486,0.6589,1.2655,90,90,90 - yellow 5.89 X 43982
Au-Cs-F CsAuF6 KAsF6,hR24,148 R-3 0.76944,0.76944,0.81316,90,90,120 - - 5.30 A 22808
Au-Cs-F CsAu2F7 CsAu2F7,mS40,15 C12/c1 1.1365,1.082,0.7374,90,123.4,90 - brown 5.79 X 43982
Au-Cs-Ga CsAu3Ga2 RbAu3Ga2 ,oP24,62 Pnma 1.3511,0.5614,0.7146,90,90,90 - gray silver 10.58 X 58372
Au-Cs-Ga Cs0.54 Au2Ga2 Rb0.56 Au2Ga2,tI20,140 I4/mcm 0.90773,0.90773,0.48154,90,90,90 - gray silver 10.13 X 58372
Au-Cs-Ge Cs3AuGe4 K3AuSn4,oP16,59 Pmmn 0.7179,1.2993,0.6112,90,90,90 - black 5.16 X 44039
Au-Cs-I CsAuI3 hp1 CsAuCl3,tI20,139 I4/mmm 0.82847,0.82847,1.20845,90,90,90 - bronze 5.69 X 58652
Au-Cs-I CsAuI3 hp2 ZnMn3C,tP5,123 P4/mmm 0.5483,0.5483,0.567,90,90,90 - - 6.92 X 53933
Au-Cs-In Cs0.66 Au2In2 K0.73 Au2In2,tP40,137 P42 /nmc 1.341,1.341,0.5367,90,90,90 - - 9.79 X 48447
Au-Cs-N CsAu[N3]4 KAu[N3]4,mS56,15 C12/c1 1.0119,1.0938,0.8584,90,87.28,90 - orange red 3.49 X 47595
Au-Cs-O CsAuO tet1 KAgO,tI24,139 I4/mmm 1.01646,1.01646,0.61773,90,90,90 - colorless 7.20 X 39635
Au-Cs-O CsAuO tet2 KAgO,tI24,82 I-4 1.016,1.016,0.617,90,90,90 - yellow 7.21 X 4298
Au-Cs-O CsAuO2 *,o**,* - 0.504,0.596,1.276,90,90,90 - - - N 5586
Au-Cs-O Cs3AuO BaNiO3,hP10,194 P63 /mmc 0.783,0.783,0.706,90,90,120 perovskite family brown red 5.42 X 31071
Au-Cs-O Cs3AuO2 rt Cs3AuO2,mP72,14 P121/c1 1.0196,1.9843,1.39734,90,132.753,90 - orange 6.03 X 39553
Au-Cs-O Cs7Au5O2 Rb7Au5O2 ,oI28,71 Immm 0.5994,0.9606,1.7208,90,90,90 - - 6.53 X 36807
Au-Cs-Pb Cs3AuPb4 K3AuSn4,oP16,59 Pmmn 0.7333,1.3821,0.6828,90,90,90 - gray silver 6.84 X 35218
Au-Cs-Rb Cs1.34 Rb1.66 Au7 Rb3Au7,oS20,65 Cmmm 0.5657,1.3265,0.7281,90,90,90 - gray silver 10.33 X 33750
Au-Cs-S CsAuS KAuS,oS12,63 Cmcm 0.698,0.8463,0.6678,90,90,90 - colorless 6.09 A 26121
Au-Cs-S CsAu3S2 CsAu3S2,hP6,164 P-3m1 0.6192,0.6192,0.508,90,90,120 - colorless 7.76 X 31788
Au-Cs-S Cs4Au6S5 Cs4Au6S5,hP15,157 P31m 1.0243,1.0243,0.529,90,90,120 - colorless 6.47 X 31791
Au-Cs-Se CsAuSe KAuS,oS12,63 Cmcm 0.7165,0.8625,0.6862,90,90,90 - yellow 6.40 A 26121
Au-Cs-Se CsAuSe3 CsAuSe3,mS20,15 C12/c1 0.6483,1.3789,0.7651,90,112.17,90 - purple 5.94 X 33215
Au-Cs-Se CsAu3Se2 CsAu3S2,hP6,164 P-3m1 0.6281,0.6281,0.5205,90,90,120 - yellowish 8.23 X 31788
Au-Cs-Se Cs2Au2Se 3 Cs2Au2Se3 ,mS28,15 C12/c1 0.9769,1.344,0.7178,90,90.69,90 - - 6.32 X 34289
Au-Cs-Sn Cs3AuSn4 K3AuSn4,oP16,59 Pmmn 0.7459,1.3707,0.6597,90,90,90 - gray silver 5.27 X 35218
Au-Cs-Sn Cs4Au7Sn2 Rb4Au7Sn2,hR39,166 R-3m 0.6844,0.6844,2.9233,90,90,120 - gray silver 9.02 X 35136
Au-Cs-Te CsAuTe RbAuTe,oP6,51 Pmma 0.6211,0.5327,0.7172,90,90,90 - red 6.40 X 26121
Au-Cu-Dy Cu4AuDy MgCu4Sn,cF24,216 F-43m 0.7095,0.7095,0.7095,90,90,90 Friauf-Laves phase - 11.41 A 19349
Au-Cu-Er Cu4AuEr MgCu4Sn,cF24,216 F-43m 0.7072,0.7072,0.7072,90,90,90 Friauf-Laves phase - 11.61 A 23934
Au-Cu-F CuAuF5 CuAuF5,aP7,2 P-1 0.3707,0.4979,0.5536,89.63,81.23,72.4 - yellow 6.14 X 19953
Au-Cu-Fe Cu0.483 Au0.507 Fe0.01 Cu,cF4,225 Fm-3m 0.38791,0.38791,0.38791,90,90,90 close-packed structure - 14.92 X 20569
Au-Cu-Ga Cu0.53 Au0.22 Ga0.25 ht Mg,hP2,194 P63 /mmc 0.26875,0.26875,0.43881,90,90,120 close-packed structure - 11.43 X 22849
Au-Cu-Ga Cu0.9 AuGa0.1 (Cu0.6 Zn0.4 )Au,oP8,55 Pbam 0.456,0.892,0.283,90,90,90 b.c.c. family - 15.07 X 8941
Au-Cu-Ga Cu2.2 Au6.5 Ga4.3 ht Cu9Al4,cP52,215 P-43m 0.9342,0.9342,0.9342,90,90,90 γ-brass - 14.01 A 22849
Au-Cu-Ga Cu2.28 AuGa0.72 TiNi3,hP16,194 P63 /mmc 0.5375,0.5375,0.8786,90,90,120 close-packed structure - 11.85 A 10615
Au-Cu-Ga Cu2.5 AuGa0.5 ZrAl3,tI16,139 I4/mmm 0.3784,0.3784,1.5147,90,90,90 close-packed structure - 11.97 A 10615
Au-Cu-Gd Cu4AuGd MgCu4Sn,cF24,216 F-43m 0.7138,0.7138,0.7138,90,90,90 Friauf-Laves phase - 11.11 A 19349
Au-Cu-Ho Cu4AuHo MgCu4Sn,cF24,216 F-43m 0.708,0.708,0.708,90,90,90 Friauf-Laves phase - 11.53 A 19349
Au-Cu-Ni CuAu0.90 Ni0.10 CuAu,tP2,123 P4/mmm 0.27697,0.27697,0.3682,90,90,90 close-packed structure - 14.50 X 16399
Au-Cu-Ni Cu0.33 Au0.33 Ni0.34 Cu,cF4,225 Fm-3m 0.375,0.375,0.375,90,90,90 close-packed structure - 13.34 X 271
Au-Cu-Pd Cu0.69 Au0.06Pd0.25 Cu,cF4,225 Fm-3m 0.3712,0.3712,0.3712,90,90,90 close-packed structure - 10.68 X 723
Au-Cu-Pd Cu0.88 AuPd0.12 CuAu,tP2,123 P4/mmm 0.27931,0.27931,0.3739,90,90,90 close-packed structure - 15.12 X 18575
Au-Cu-Pd Cu3Au0.16 Pd0.84 SrPb3,tP4,123 P4/mmm 0.3706,0.3706,0.3679,90,90,90 close-packed structure - 10.24 X 723
Au-Cu-Pd Cu3Au0.24 Pd0.76 Cu3Au,cP4,221 Pm-3m 0.3705,0.3705,0.3705,90,90,90 close-packed structure - 10.41 X 723
Au-Cu-Pt Cu0.474 Au0.509Pt0.017 ht Cu,cF4,225 Fm-3m 0.3914,0.3914,0.3914,90,90,90 close-packed structure - 14.81 X 56233
Au-Cu-Pt Cu0.892 Au2.592Pt0.516 rt Cu3Au,cP4,221 Pm-3m 0.397,0.397,0.397,90,90,90 close-packed structure - 17.73 X 56233
Au-Cu-Pt Cu0.948 Au1.018Pt0.034 rt CuAu,tP2,123 P4/mmm 0.28086,0.28086,0.3754,90,90,90 close-packed structure - 14.99 X 56233
Au-Cu-Se CuAuSe4 CuAuSe4,mP12,11 P121/m1 0.4318,0.7447,0.8099,90,93.33,90 - - 7.36 X 38705
Au-Cu-Sn CuAuSn2 CuAuSn2,hP6,164 P-3m1 0.42597,0.42597,0.52688,90,90,120 - gray 9.99 X 47574
Au-Cu-Sn Cu0.18 Au0.73 Sn0.09 ht Nd,hP4,194 P63 /mmc 0.2859,0.2859,0.9393,90,90,120 close-packed structure - 16.57 X 25728
Au-Cu-Sn Cu0.45 Au0.35 Sn0.20 rt Mn,cP20,213 P4132 0.6762,0.6762,0.6762,90,90,90 - - 13.03 X 25725
Au-Cu-Sn Cu0.47 Au0.40 Sn0.13 ht Mg,hP2,194 P63 /mmc 0.2773,0.2773,0.4539,90,90,120 close-packed structure - 13.63 X 25728
Au-Cu-Sn Cu0.56 Au0.56 Sn Co1.75 Ge,hP6,194 P63 /mmc 0.4288,0.4288,0.5313,90,90,120 AlB2 family - 10.39 X 25728
Au-Cu-Sn Cu0.95 Au1.05 Sn La2Sb,tI12,139 I4/mmm 0.4078,0.4078,1.2938,90,90,90 - - 11.91 X 25733
Au-Cu-Sn Cu2.8 Au0.2 Sn rt Cu3Ti,oP8,59 Pmmn 0.4353,0.555,0.4807,90,90,90 close-packed structure - 9.61 A 25728
Au-Cu-Sn Cu6.5 Au3.9 Sn2.6 Cu5Zn8,cI52,217 I-43m 0.93,0.93,0.93,90,90,90 γ-brass - 12.30 A 25728
Au-Cu-Tb Cu4AuTb MgCu4Sn,cF24,216 F-43m 0.713,0.713,0.713,90,90,90 Friauf-Laves phase - 11.18 A 19349
Au-Cu-U Cu2Au3U Be5Au,cF24,216 F-43m 0.7433,0.7433,0.7433,90,90,90 Friauf-Laves phase - 15.46 A 23660
Au-Cu-U Cu4AuU MgCu4Sn,cF24,216 F-43m 0.7427,0.7427,0.7427,90,90,90 Friauf-Laves phase - 11.17 A 20255
Au-Cu-U Cu9Au42U14 Ag51Gd14,hP68,175 P6/m 1.242,1.242,0.9028,90,90,120 - - 16.77 A 29215
Au-Cu-Yb Cu3.5 Au1.5 Yb Be5Au,cF24,216 F-43m 0.711,0.711,0.711,90,90,90 Friauf-Laves phase - 12.77 X 45022
Au-Cu-Yb Cu4AuYb MgCu4Sn,cF24,216 F-43m 0.7058,0.7058,0.7058,90,90,90 Friauf-Laves phase - 11.79 A 23669
Au-Cu-Zn CuAuZn2 rt Cu2MnAl,cF16,225 Fm-3m 0.61273,0.61273,0.61273,90,90,90 b.c.c. family - 11.30 X 3130
Au-Cu-Zn Cu0.17 Au0.60 Zn0.23 *,o*4,* - 0.3873,0.3954,0.4064,90,90,90 - - 15.37 N 924
Au-Cu-Zn Cu0.4 Au1.2 Zn0.4 *,o**,* - 0.3818,0.3983,0.4067,90,90,90 - - 7.73 N 723
Au-Cu-Zn Cu0.46 Au0.60 Zn0.94 CsCl,cP2,221 Pm-3m 0.3075,0.3075,0.3075,90,90,90 b.c.c. family - 11.93 X 6865
Au-Cu-Zn Cu0.6 AuZn0.4 rt (Cu0.6 Zn0.4 )Au,oP8,55 Pbam 0.4548,0.8998,0.2892,90,90,90 b.c.c. family - 14.66 X 794
Au-Cu-Zn Cu0.67 Au0.13 Zn0.2 Cu,cF4,225 Fm-3m 0.37341,0.37341,0.37341,90,90,90 close-packed structure - 10.37 X 2147
Handbook of Inorganic Substances – Edition 2015 : Data 267

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Cu-Zn Cu1.25 Au0.94 Zn1.81 mart Cu(Cu0.06 Au0.94)(Zn0 ...,oP8,25 Pmm2 0.448,0.565,0.46,90,90,90 - - 10.92 X 2983
Au-Cu-Zn Cu2AuZn SrPb3,tP4,123 P4/mmm 0.3794,0.3794,0.3812,90,90,90 close-packed structure - 11.79 X 723
Au-Cu-Zn Cu30 Au25Zn45 *,m**,* - 0.4559,0.5631,3.991,90,92.5,90 - - - N 10208
Au-Dy-F Au5Dy2F21 Au5Er2F21,aP56,2 P-1 0.79633,0.89965,1.19166,89.056,88.972,88.956 - yellow 6.65 A 26869
Au-Dy-Ga Au3.8 Dy3Ga7.2 La3Al11,oI28,71 Immm 0.42663,0.9743,1.26211,90,90,90 - - 11.00 A 28769
Au-Dy-Ge AuDy2Ge6 CuCe2Ge6,oS18,38 Amm2 0.41065,0.39918,2.1006,90,90,90 - - 9.24 A 30286
Au-Dy-In AuDyIn ZrNiAl,hP9,189 P-62m 0.7653,0.7653,0.3899,90,90,120 Fe2P family - 11.95 X 40159
Au-Dy-In Au2DyIn Cu2MnAl,cF16,225 Fm-3m 0.6885,0.6885,0.6885,90,90,90 b.c.c. family - 13.66 X 19115
Au-Dy-In Au2Dy2In Mo2 FeB2,tP10,127 P4/mbm 0.7841,0.7841,0.3739,90,90,90 - gray silver 12.05 X 29709
Au-Dy-Mg MgAuDy ZrNiAl,hP9,189 P-62m 0.7522,0.7522,0.40889,90,90,120 Fe2P family gray light 9.54 A 38196
Au-Dy-Ni AuDyNi4 MgCu4Sn,cF24,216 F-43m 0.7052,0.7052,0.7052,90,90,90 Friauf-Laves phase - 11.26 A 11015
Au-Dy-Pb AuDyPb MgAgAs,cF12,216 F-43m 0.6728,0.6728,0.6728,90,90,90 - - 12.36 X 21319
Au-Dy-Pb Au2Dy2Pb U2Pt2Sn,tP20,136 P42/mnm 0.79171,0.79171,0.74164,90,90,90 - - 13.23 A 58526
Au-Dy-Sb Au2Dy5Sb Mo5 SiB2,tI32,140 I4/mcm 0.79477,0.79477,1.31348,90,90,90 - - 10.63 X 48631
Au-Dy-Sb Au3Dy3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9811,0.9811,0.9811,90,90,90 - - 11.01 A 10372
Au-Dy-Si Au2DySi2 CeAl2Ga2,tI10,139 I4/mmm 0.4218,0.4218,1.015,90,90,90 - - 11.27 A 15783
Au-Dy-Sn AuDySn LiGaGe,hP6,186 P63mc 0.46448,0.46448,0.73782,90,90,120 AlB2 family - 11.52 X 33324
Au-Dy-Sn Au2Dy2Sn U2Pt2Sn,tP20,136 P42/mnm 0.7822,0.7822,0.7503,90,90,90 - gray light 12.12 A 29701
Au-Dy-Te AuDy6Te2 Sc6PdTe 2,oP36,62 Pnma 2.161,0.40667,1.1438,90,90,90 - - 9.43 A 58293
Au-Dy-Te Au2Dy5 Te2 Tm5 Sb2Si2,oS36,64 Cmce 1.5284,0.7898,0.78681,90,90,90 - - 10.22 A 56271
Au-Dy-Te Au2Dy7 Te2 Au2Er7Te2,mS44,12 C12/m1 1.8142,0.40134,1.7058,90,104.46,90 - - 9.87 A 58293
Au-Dy-Zn Au1.05 Zn0.95 Dy ZrNiAl,hP9,189 P-62m 0.73781,0.73781,0.3892,90,90,120 Fe2P family - 11.71 X 56239
Au-Er-F Au5Er2F21 Au5Er2F21,aP56,2 P-1 0.79398,0.89383,1.1852,89.187,88.884,88.751 - yellow 6.79 X 26869
Au-Er-Ga Au2.8 Er3Ga8.2 La3Al11,oI28,71 Immm 0.4208,0.9902,1.2373,90,90,90 - - 10.47 A 25426
Au-Er-Ge AuErGe LiGaGe,hP6,186 P63mc 0.43913,0.43913,0.71608,90,90,120 AlB2 family - 12.13 X 39048
Au-Er-In AuErIn ZrNiAl,hP9,189 P-62m 0.767,0.767,0.3857,90,90,120 Fe2P family - 12.14 X 54244
Au-Er-In Au2ErIn Cu2MnAl,cF16,225 Fm-3m 0.6864,0.6864,0.6864,90,90,90 b.c.c. family - 13.89 X 19115
Au-Er-In Au2Er2In Mo2 FeB2,tP10,127 P4/mbm 0.77886,0.77886,0.37086,90,90,90 - gray silver 12.45 A 31700
Au-Er-Mg MgAuEr ZrNiAl,hP9,189 P-62m 0.7474,0.7474,0.40676,90,90,120 Fe2P family gray light 9.84 A 38196
Au-Er-Ni AuErNi4 MgCu4Sn,cF24,216 F-43m 0.7011,0.7011,0.7011,90,90,90 Friauf-Laves phase - 11.55 A 11015
Au-Er-Pb AuErPb MgAgAs,cF12,216 F-43m 0.6694,0.6694,0.6694,90,90,90 - - 12.65 X 21319
Au-Er-Pb Au2Er2Pb U2Pt2Sn,tP20,136 P42/mnm 0.7875,0.7875,0.73554,90,90,90 - - 13.62 A 58526
Au-Er-Sb Au2Er5Sb Mo5 SiB2,tI32,140 I4/mcm 0.78985,0.78985,1.29795,90,90,90 - - 11.09 X 48631
Au-Er-Sb Au3Er3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9768,0.9768,0.9768,90,90,90 - - 11.26 A 10372
Au-Er-Si Au2ErSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4214,0.4214,1.017,90,90,90 - - 11.35 A 9139
Au-Er-Sn AuErSn cub MgAgAs,cF12,216 F-43m 0.6614,0.6614,0.6614,90,90,90 - - 11.09 X 39034
Au-Er-Sn AuErSn hex LiGaGe,hP6,186 P63mc 0.4693,0.4693,0.7426,90,90,120 AlB2 family - 11.32 X 49619
Au-Er-Sn Au2Er2Sn U2Pt2Sn,tP20,136 P42/mnm 0.7782,0.7782,0.7396,90,90,90 - gray light 12.56 X 29701
Au-Er-Te Au2Er7Te2 Au2Er7Te2,mS44,12 C12/m1 1.7831,0.39819,1.69089,90,104.361,90 - black 10.39 X 54113
Au-Er-Zn Au1.21 Zn0.79 Er ZrNiAl,hP9,189 P-62m 0.74063,0.74063,0.3802,90,90,120 Fe2P family - 12.61 X 56239
Au-Eu-Ga AuEuGa KHg2,oI12,74 Imma 0.4603,0.7568,0.7838,90,90,90 AlB2 family - 10.18 A 20153
Au-Eu-Ga Au2EuGa5 SrAu(Au0.5 Ga0.5 )2Ga4,tP8,123 P4/mmm 0.4375,0.4375,0.8343,90,90,90 - - 9.12 X 32570
Au-Eu-Ge AuEuGe AuEuGe,oI12,44 Imm2 0.4601,0.7371,0.7881,90,90,90 - - 10.48 X 30384
Au-Eu-Ge AuEu2Ge3 Ca2AgSi3,oF48,69 Fmmm 0.8577,0.9002,1.4855,90,90,90 - - 8.32 X 54402
Au-Eu-Ge Au0.54 EuGe1.46 AlB2 ,hP3,191 P6/mmm 0.43043,0.43043,0.44749,90,90,120 AlB2 family - 8.43 X 33891
Au-Eu-Ge Au2EuGe2 CeAl2Ga2,tI10,139 I4/mmm 0.4473,0.4473,1.034,90,90,90 - gray silver 11.09 X 57448
Au-Eu-In AuEuIn TiNiSi,oP12,62 Pnma 0.7552,0.4722,0.8423,90,90,90 AlB2 family - 10.26 X 31888
Au-Eu-In AuEuIn2 MgCuAl2,oS16,63 Cmcm 0.4681,1.1055,0.7535,90,90,90 - gray light 9.86 X 38345
Au-Eu-In Au17.7 Eu5In4.3 Au16 (Au0.42 In0.58 )4Eu5In2,mS54,12 C12/m1 0.9027,0.7228,1.7341,90,94.31,90 - - 13.95 X 59556
Au-Eu-In Au3EuIn3 SrAu3In3,oP14,59 Pmmn 0.4542,0.7681,0.9073,90,90,90 - - 11.41 X 49001
Au-Eu-In Au3Eu2 In4 Hf2Co4P 3,hP36,189 P-62m 1.4897,1.4897,0.4549,90,90,120 - - 10.29 X 36210
Au-Eu-Mg MgAuEu4 Gd4RhIn,cF96,216 F-43m 1.5156,1.5156,1.5156,90,90,90 - - 6.33 A 59572
Au-Eu-Mg Mg1.026 Au1.012 Eu0.962 TiNiSi,oP12,62 Pnma 0.7606,0.4488,0.8758,90,90,90 AlB2 family gray light 8.23 X 38196
Au-Eu-O AuEu3O6 AuGd3O6,aP10,2 P-1 0.37012,0.56134,0.70652,90.838,102.956,90.909 - yellow 8.70 X 39538
Au-Eu-O Au2Eu4O9 rt Au2La4O9,oP60,60 Pbcn 1.18241,0.59922,1.18013,90,90,90 - yellow 9.10 X 38190
Au-Eu-P AuEuP BeZrSi,hP6,194 P63/mmc 0.4313,0.4313,0.8258,90,90,120 AlB2 family blue gray 9.48 X 14785
Au-Eu-Sb AuEuSb BeZrSi,hP6,194 P63/mmc 0.4671,0.4671,0.8488,90,90,120 AlB2 family gray 9.75 X 57459
Au-Eu-Si Au0.5 EuSi1.5 AlB2 ,hP3,191 P6/mmm 0.415,0.415,0.4515,90,90,120 AlB2 family - 7.21 X 7618
Au-Eu-Si Au2EuSi2 CeAl2Ga2,tI10,139 I4/mmm 0.436,0.436,1.012,90,90,90 - - 10.39 A 20753
Au-Eu-Sn AuEuSn orth1 KHg2,oI12,74 Imma 0.4791,0.7667,0.8201,90,90,90 AlB2 family gray silver 10.31 X 32893
Au-Eu-Sn AuEuSn orth2 AuEuSn,oI60,44 Imm2 0.4791,3.8336,0.8201,90,90,90 - gray silver 10.31 X 32893
Au-Eu-Sn Au2Eu2Sn5 Au2Eu2Sn5,mP18,11 P121/m1 0.9286,0.4658,1.0429,90,92.28,90 - gray silver 9.51 X 36772
Au-Eu-Zn AuZnEu TiNiSi,oP12,62 Pnma 0.7474,0.4658,0.7891,90,90,90 AlB2 family - 10.02 X 52908
Au-F-Gd Au5Gd2F21 Au5La2F21,tP112,92 P41212 0.81726,0.81726,2.559,90,90,90 - yellow 6.60 X 24211
Au-F-Hg Au2HgF12 Au2HgF12,oP60,60 Pbcn 0.91767,0.97159,0.96204,90,90,90 - orange 6.37 X 56672
Au-F-Hg Au2HgF8 Au2CdF8,tP22,124 P4/mcc 0.5769,0.5769,1.044,90,90,90 - yellow 7.14 X 33775
Au-F-Ho Au5Ho 2F21 Au5Er2F21,aP56,2 P-1 0.79546,0.89681,1.18906,89.101,88.873,88.912 - yellow 6.71 X 26869
Au-F-K KAuF4 KBrF4-b,tI24,140 I4/mcm 0.599,0.599,1.138,90,90,90 - yellow 5.08 X 4738
Au-F-K KAuF6 BaSiF6,hR24,166 R-3m 0.7496,0.7496,0.7315,90,90,120 - yellow 4.90 X 47523
Au-F-La Au3LaF12 Au3LaF12,hR96,167 R-3c 1.0562,1.0562,1.6337,90,90,120 - yellow 6.05 X 32423
Au-F-La Au5La2F21 Au5La2F21,tP112,92 P41212 0.8368,0.8368,2.6022,90,90,90 - yellow 6.06 X 40841
Au-F-Li LiAuF4 mon1 LiAuF4,mP24,13 P12/c1 0.48532,0.63429,1.00443,90,92.759,90 - yellow 6.02 X 25529
Au-F-Li LiAuF4 mon2 LiAuF4,mS24,15 C12/c1 1.116,0.539,0.541,90,115.7,90 - - 6.34 X 5597
Au-F-Li LiAuF6 LiSbF6,hR24,148 R-3 0.50034,0.50034,1.3716,90,90,120 - - 5.33 X 37197
Au-F-Lu Au2LuF9 Au2 TmF9,oP144,60 Pbcn 1.09928,0.9007,2.1515,90,90,90 - yellow 6.92 X 28144
Au-F-Mg MgAu2F12 CaAu2F12,tP15,81 P-4 0.4938,0.4938,0.7714,90,90,90 - - 5.71 A 23989
Au-F-Mg MgAu2F8 Au2ZnF8,mP22,14 P121/c1 0.5489,0.5521,1.0792,90,109.4,90 - yellow 6.14 X 20862
Au-F-Na NaAuF4 KBrF4-b,tI24,140 I4/mcm 0.564,0.564,1.049,90,90,90 - yellow 5.89 X 5597
268 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-F-Nd Au5Nd2F21 Au5La2F21 ,tP112,92 P41212 0.827,0.827,2.5792,90,90,90 - yellow 6.30 X 24211


Au-F-Ni Au2NiF8 Au2ZnF8,mP22,14 P121/c1 0.5504,0.546,1.08311,90,109.511,90 - yellow 6.55 X 33808
Au-F-O [O2]AuF6 rhom [O2]AuF6,hR39,148 R-3 0.7742,0.7742,0.7089,90,90,120 - yellow 4.64 X 32379
Au-F-O [O2]AuF6 tricl [O2]RhF6,aP9,2 P-1 0.4933,0.4973,0.5006,78.68,90.63,77.91 - yellow 4.84 X 38361
Au-F-Pd Au2PdF8 Au2PdF8,mP22,14 P121/c1 0.51979,1.0957,0.76045,90,133.05,90 - green 6.85 X 33808
Au-F-Pr Au5Pr2F21 Au5La2F21 ,tP112,92 P41212 0.83011,0.83011,2.5885,90,90,90 - yellow 6.20 X 24211
Au-F-Rb RbAuF4 KBrF4-b,tI24,140 I4/mcm 0.6182,0.6182,1.191,90,90,90 - yellow 5.23 X 25529
Au-F-Rb RbAuF6 KAsF6,hR24,148 R-3 0.7638,0.7638,0.7608,90,90,120 - - 5.14 A 22808
Au-F-Sb Au3Sb2F18 Au3Sb2F18 ,mP46,14 P121/c1 0.9049,0.8424,1.00459,90,119.591,90 - brown 5.87 X 40972
Au-F-Sb Au3Sb3F22 Au3Sb3F22 ,mP112,7 P1c1 0.9991,1.0728,1.5222,90,95.304,90 - black 5.62 X 40972
Au-F-Sm Au3SmF12 Au3LaF12,hR96,167 R-3c 1.0345,1.0345,1.6141,90,90,120 - yellow 6.46 A 40841
Au-F-Sm Au5Sm2F21 Au5La2F21 ,tP112,92 P41212 0.82173,0.82173,2.5716,90,90,90 - yellow 6.44 X 24211
Au-F-Sn Au0.024 Sn0.976 F4 SnF4,tI10,139 I4/mmm 0.40482,0.40482,0.79638,90,90,90 - green 5.00 X 32413
Au-F-Sr SrAu2F12 BaAu2F12,cP60,215 P-43m 0.9535,0.9535,0.9535,90,90,90 - - 5.44 A 23989
Au-F-Tb Au5 Tb2F21 Au5Er2F21 ,aP56,2 P-1 0.79846,0.90202,1.19434,88.99,89.006,89.033 - yellow 6.57 X 26869
Au-F-Th AuTh2F11 AuTh2F11,tI56,140 I4/mcm 1.13062,1.13062,0.63134,90,90,90 - yellow 7.16 X 36659
Au-F-Tl AuTlF6 AuTlF6,tP64,92 P41212 0.57317,0.57317,2.7804,90,90,90 - yellow 7.49 X 40841
Au-F-Tm Au2 TmF9 Au2 TmF9,oP144,60 Pbcn 1.10292,0.90438,2.16446,90,90,90 - yellow 6.77 X 28144
Au-F-U AuU2F11 AuTh2F11,tI56,140 I4/mcm 1.13237,1.13237,0.63299,90,90,90 - yellow 7.22 X 43982
Au-F-Xe AuXeF9 AgXeF9,tI44,87 I4/m 0.5735,0.5735,2.0007,90,90,90 - yellow 5.04 A 22271
Au-F-Xe AuXe2F17 AuXe2F17,oP80,62 Pnma 0.9115,0.8542,1.5726,90,90,90 - green 4.25 X 8209
Au-F-Y Au5 Y2F21 Au5 Y2F21,mP56,13 P12/c1 0.8957,0.7974,1.47827,90,126.47,90 - yellow 6.11 X 40841
Au-F-Yb Au2 YbF9 Au2 TmF9,oP144,60 Pbcn 1.10098,0.90223,2.15736,90,90,90 - yellow 6.86 X 28144
Au-F-Zn Au2ZnF8 Au2ZnF8,mP22,14 P121/c1 0.5487,0.5518,1.0831,90,109.26,90 - yellow 6.56 X 20862
Au-Fe-Nb Au0.9 Nb3.04 Fe0.06 Cr3Si,cP8,223 Pm-3n 0.52144,0.52144,0.52144,90,90,90 Frank-Kasper phase - 10.85 X 19439
Au-Fe-Nd AuNd6Fe13 Pr6Fe13Ge,tI80,140 I4/mcm 0.80854,0.80854,2.25909,90,90,90 - - 8.04 X 28867
Au-Fe-Pd Au2.4 FePd0.6 Cu3Au,cP4,221 Pm-3m 0.397,0.397,0.397,90,90,90 close-packed structure - 15.72 X 12643
Au-Fe-Pr AuPr6Fe13 Pr6Fe13Ge,tI80,140 I4/mcm 0.80962,0.80962,2.2672,90,90,90 - - 7.90 X 34611
Au-Fe-Sn Au0.84 Fe0.02 Sn0.14 Mg,hP2,194 P63 /mmc 0.292,0.292,0.478,90,90,120 close-packed structure - 17.24 X 1733
Au-Ga-Gd Au3.6 Gd3Ga7.4 La3Al11,oI28,71 Immm 0.43052,0.974,1.2735,90,90,90 - - 10.55 A 28769
Au-Ga-Hf AuHfGa AuScSi,hP6,187 P-6m2 0.43238,0.43238,0.66359,90,90,120 AlB2 family - 13.76 X 48589
Au-Ga-Hf Au0.53 HfGa2.47 Cu3Au,cP4,221 Pm-3m 0.40728,0.40728,0.40728,90,90,90 close-packed structure - 11.19 X 48632
Au-Ga-Ho Au3.8 Ho3Ga7.2 La3Al11,oI28,71 Immm 0.42589,0.9736,1.2596,90,90,90 - - 11.10 A 28769
Au-Ga-In Au0.92 Ga0.04 In0.04 Cu,cF4,225 Fm-3m 0.40867,0.40867,0.40867,90,90,90 close-packed structure - 18.35 X 11635
Au-Ga-K KAu0.33 Ga2.67 RbGa3,tI24,119 I-4m2 0.609,0.609,1.545,90,90,90 - - 5.05 X 58266
Au-Ga-K KAu2.23 Ga3.77 KAu2(Au0.06 Ga0.94 )4,oI14,71 Immm 0.4407,0.7339,0.8664,90,90,90 - - 8.78 X 58266
Au-Ga-K KAu3.08 Ga1.92 BaZn5,oS24,63 Cmcm 1.1078,0.84864,0.55686,90,90,90 - - 9.89 X 58266
Au-Ga-K K0.275 AuGa K0.25 PdSi,tI24,140 I4/mcm 0.8861,0.8861,0.48339,90,90,90 - - 9.71 X 58266
Au-Ga-K K4Au8Ga K4Au8Ga,mS52,12 C12/m1 2.085,0.563,1.0912,90,97.45,90 - black 9.42 X 38168
Au-Ga-La AuLaGa KHg2,oI12,74 Imma 0.4626,0.7524,0.7882,90,90,90 AlB2 family - 9.82 A 38823
Au-Ga-La Au0.85 LaGa3.15 CeAl2Ga2,tI10,139 I4/mmm 0.4379,0.4379,1.0633,90,90,90 - - 8.57 A 20405
Au-Ga-La Au1.5 LaGa2.5 CaBe2Ge2 ,tP10,129 P4/nmm 0.4388,0.4388,1.0604,90,90,90 - - 9.90 A 31840
Au-Ga-Li Li2AuGa Li2AgSb,cF16,216 F-43m 0.6188,0.6188,0.6188,90,90,90 b.c.c. family yellow 7.87 X 4311
Au-Ga-Lu Au1.24 LuGa1.76 MgCuAl2,oS16,63 Cmcm 0.43663,1.01413,0.67031,90,90,90 - - 12.13 X 29270
Au-Ga-Lu Au3.5 Lu3Ga7.5 La3Al11,oI28,71 Immm 0.43709,0.9654,1.2619,90,90,90 - - 10.84 A 25426
Au-Ga-Mo AuMo8Ga40 V8Ga41,hR147,148 R-3 1.3991,1.3991,1.5083,90,90,120 - gray 7.31 A 17155
Au-Ga-Na Na0.28 AuGa K0.25 PdSi,tI24,140 I4/mcm 0.8718,0.8718,0.4857,90,90,90 - gray silver 9.83 X 58372
Au-Ga-Na Na13Au41.2 Ga30.3 Sc12.3 Ni40.7 Ge31,hP169,191 P6/mmm 1.955,1.955,0.8991,90,90,120 - gray silver 11.75 X 58372
Au-Ga-Na Na13Au9.05 Ga17.95 Li13(Cu0.53 Si0.47)27,cI160,204 Im-3 1.4512,1.4512,1.4512,90,90,90 - - 7.24 X 58394
Au-Ga-Na Na32Au20.3 Ga68.7 Na32(Au0.23 Ga0.77)89,oF968,69 Fmmm 1.6088,2.5584,4.686,90,90,90 - - 6.56 X 28290
Au-Ga-Nb Au0.2 Nb0.6 Ga0.2 stab Mn,cP20,213 P4132 0.7084,0.7084,0.7084,90,90,90 - - 10.19 A 2740
Au-Ga-Nd AuNdGa KHg2,oI12,74 Imma 0.4553,0.7315,0.7804,90,90,90 AlB2 family - 10.50 A 38823
Au-Ga-Nd Au1.2 NdGa2.8 CeAl2Ga2,tI10,139 I4/mmm 0.429,0.429,1.0732,90,90,90 - - 9.68 A 20405
Au-Ga-Nd Au1.5 NdGa2.5 CaBe2Ge2 ,tP10,129 P4/nmm 0.4303,0.4303,1.0705,90,90,90 - - 10.29 A 20405
Au-Ga-Pd Au0.95 Pd0.05 Ga2 CaF2,cF12,225 Fm-3m 0.60432,0.60432,0.60432,90,90,90 fluorite family - 9.99 X 7720
Au-Ga-Pr AuPrGa KHg2,oI12,74 Imma 0.4571,0.7361,0.7837,90,90,90 AlB2 family - 10.27 A 38823
Au-Ga-Pr Au1.2 PrGa2.8 CeAl2Ga2,tI10,139 I4/mmm 0.4313,0.4313,1.0699,90,90,90 - - 9.55 A 20405
Au-Ga-Pr Au1.5 PrGa2.5 CaBe2Ge2 ,tP10,129 P4/nmm 0.4324,0.4324,1.0682,90,90,90 - - 10.15 X 20405
Au-Ga-Rb RbAu0.26 Ga2.74 RbGa3,tI24,119 I-4m2 0.6205,0.6205,1.5478,90,90,90 - - 5.48 X 40190
Au-Ga-Rb RbAu3Ga2 RbAu3Ga2 ,oP24,62 Pnma 1.3384,0.5577,0.7017,90,90,90 - gray silver 10.35 X 58372
Au-Ga-Rb Rb0.56 Au2 Ga2 Rb0.56 Au2Ga2,tI20,140 I4/mcm 0.89496,0.89496,0.48293,90,90,90 - gray silver 9.98 X 58372
Au-Ga-Sm AuSmGa KHg2,oI12,74 Imma 0.4525,0.7229,0.7779,90,90,90 AlB2 family - 10.89 A 38823
Au-Ga-Sm Au1.15 SmGa2.85 CeAl2Ga2,tI10,139 I4/mmm 0.4238,0.4238,1.0845,90,90,90 - - 9.81 A 20405
Au-Ga-Sm Au1.6 SmGa2.4 CaBe2Ge2 ,tP10,129 P4/nmm 0.4255,0.4255,1.091,90,90,90 - - 10.64 A 20405
Au-Ga-Sr SrAuGa3 CeAl2Ga2,tI10,139 I4/mmm 0.436,0.436,1.101,90,90,90 - gray silver 7.83 X 26924
Au-Ga-Sr SrAu2Ga2 CaBe2Ge2 ,tP10,129 P4/nmm 0.4484,0.4484,1.0558,90,90,90 - gray silver 9.72 X 25677
Au-Ga-Sr SrAu2Ga5 SrAu(Au0.5 Ga0.5 )2Ga4,tP8,123 P4/mmm 0.4389,0.4389,0.8395,90,90,90 - - 8.52 X 32570
Au-Ga-Ta Au0.2Ta0.6 Ga0.2 (N) Mn,cP20,213 P4132 0.7034,0.7034,0.7034,90,90,90 - - 15.45 A 2740
Au-Ga-Tb Au2.8 Tb3Ga8.2 La3Al11,oI28,71 Immm 0.425,0.9809,1.2546,90,90,90 - - 10.16 A 25426
Au-Ga-Ti AuTiGa Co1.75Ge,hP6,194 P63 /mmc 0.43848,0.43848,0.58792,90,90,120 AlB2 family - 10.67 X 48589
Au-Ga-Ti Au0.32 TiGa2.68 Cu3Au,cP4,221 Pm-3m 0.398,0.398,0.398,90,90,90 close-packed structure - 7.84 X 48559
Au-Ga-Tm Au3.8 Tm3Ga7.2 La3Al11,oI28,71 Immm 0.42405,0.97239,1.25369,90,90,90 - - 11.29 A 28769
Au-Ga-U AuUGa TiNiSi,oP12,62 Pnma 0.7034,0.4491,0.7775,90,90,90 AlB2 family - 13.65 X 32344
Au-Ga-V Au0.2 V0.6 Ga0.2 (N) Mn,cP20,213 P4132 0.6726,0.6726,0.6726,90,90,90 - - 9.16 A 2740
Au-Ga-Y Au3.8 Y3Ga7.2 La3Al11,oI28,71 Immm 0.42745,0.9729,1.26505,90,90,90 - - 9.58 A 28769
Au-Ga-Yb Au0.27 YbGa1.73 ht KHg2,oI12,74 Imma 0.4483,0.72446,0.76739,90,90,90 AlB2 family - 9.24 A 52954
Au-Ga-Yb Au1.04 YbGa0.96 rt TiNiSi,oP12,62 Pnma 0.71167,0.45019,0.77083,90,90,90 AlB2 family - 11.96 X 52954
Au-Ga-Yb Au1.075 YbGa2.925 CeAl2Ga2,tI10,139 I4/mmm 0.41748,0.41748,1.1314,90,90,90 - - 9.92 X 27415
Handbook of Inorganic Substances – Edition 2015 : Data 269

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Ga-Yb Au3 YbGa7 ScRh3Si7,hR66,167 R-3c 0.8109,0.8109,2.1055,90,90,120 - - 10.40 X 32506


Au-Ga-Yb Au4.8 Yb3Ga6.2 La3Al11,oI28,71 Immm 0.43687,0.94683,1.29764,90,90,90 - - 11.74 X 28769
Au-Ga-Yb Au5.5 Yb3Ga5.5 Au5.5 Yb3Ga5.5 ,oP56,25 Pmm2 0.44746,1.3294,1.8067,90,90,90 - - 12.27 X 27459
Au-Ga-Zn Au3Zn0.67 Ga0.33 Au3(Zn0.67 Ga0.33 ),tI48,140 I4/mcm 0.5591,0.5591,2.521,90,90,90 close-packed structure - 16.63 X 1032
Au-Ga-Zn Au5Zn2Ga Au5(Zn0.67 Ga0.33 )3,oI32,72 Ibam 0.5473,1.0946,0.8084,90,90,90 close-packed structure - 16.26 X 1032
Au-Ga-Zr AuZrGa AuScSi,hP6,187 P-6m2 0.43442,0.43442,0.66942,90,90,120 AlB2 family - 10.86 X 48589
Au-Ga-Zr Au0.44 ZrGa1.56 KHg2,oI12,74 Imma 0.41624,0.66351,0.7737,90,90,90 AlB2 family - 8.91 X 49532
Au-Ga-Zr Au0.54 ZrGa2.46 Cu3Au,cP4,221 Pm-3m 0.40921,0.40921,0.40921,90,90,90 close-packed structure - 8.94 X 48559
Au-Gd-Ge AuGdGe NdPtSb,hP6,186 P63mc 0.44264,0.44264,0.74211,90,90,120 AlB2 family - 11.26 A 34881
Au-Gd-Ge AuGd2Ge6 CuCe2Ge6,oS18,38 Amm2 0.41325,0.40234,2.1187,90,90,90 - - 8.93 A 30286
Au-Gd-Ge Au59.23 Gd12.65 Ge16.32 Ca12.2 Au50(Au0.30 Ge0...,cI210,204 Im-3 1.47322,1.47322,1.47322,90,90,90 - - 15.41 X 59653
Au-Gd-I AuGd7I12 Sc7NCl12,hR60,148 R-3 1.564,1.564,1.0484,90,90,120 - - 6.33 A 23365
Au-Gd-In AuGdIn ZrNiAl,hP9,189 P-62m 0.7698,0.7698,0.3978,90,90,120 Fe2P family gray 11.45 X 34881
Au-Gd-In Au0.44 GdIn1.56 CaIn2,hP6,194 P63/mmc 0.4789,0.4789,0.7403,90,90,120 AlB2 family gray 9.56 X 34881
Au-Gd-In Au2GdIn Cu2MnAl,cF16,225 Fm-3m 0.694,0.694,0.694,90,90,90 b.c.c. family - 13.23 X 19115
Au-Gd-In Au2Gd2In Mo2 FeB2,tP10,127 P4/mbm 0.78688,0.78688,0.38113,90,90,90 - gray silver 11.59 A 31700
Au-Gd-Mg MgAuGd ZrNiAl,hP9,189 P-62m 0.7563,0.7563,0.41271,90,90,120 Fe2P family gray light 9.22 X 43866
Au-Gd-Ni AuGdNi4 MgCu4Sn,cF24,216 F-43m 0.7136,0.7136,0.7136,90,90,90 Friauf-Laves phase - 10.77 A 11015
Au-Gd-O AuGd3O6 AuGd3O6,aP10,2 P-1 0.3672,0.55977,0.70636,90.509,102.889,91.068 - yellow 8.97 X 39538
Au-Gd-O Au2Gd4O9 Au2La4O9,oP60,60 Pbcn 1.1922,0.61242,1.1917,90,90,90 - brown 8.91 X 32701
Au-Gd-Pb AuGdPb MgAgAs,cF12,216 F-43m 0.6775,0.6775,0.6775,90,90,90 - - 11.99 X 21319
Au-Gd-Pb Au2Gd2Pb U2Pt2Sn,tP20,136 P42/mnm 0.79702,0.79702,0.7529,90,90,90 - - 12.72 A 58526
Au-Gd-Sb Au2Gd5Sb Mo5 SiB2,tI32,140 I4/mcm 0.801,0.801,1.3388,90,90,90 - - 10.07 X 48676
Au-Gd-Sb Au3Gd3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9864,0.9864,0.9864,90,90,90 - - 10.73 A 10372
Au-Gd-Si Au14.8 Gd3Si3.4 Cu2.19 Zn16Sc3,cI192,204 Im-3 1.4747,1.4747,1.4747,90,90,90 - - 14.42 X 59653
Au-Gd-Si Au2GdSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4244,0.4244,1.0159,90,90,90 - - 11.02 X 12456
Au-Gd-Sn AuGdSn cub MgAgAs,cF12,216 F-43m 0.6782,0.6782,0.6782,90,90,90 - - 10.07 X 49619
Au-Gd-Sn AuGdSn hex NdPtSb,hP6,186 P63mc 0.46514,0.46514,0.7424,90,90,120 AlB2 family gray silver 11.29 X 47761
Au-Gd-Sn Au2Gd2Sn Mo2 FeB2,tP10,127 P4/mbm 0.7865,0.7865,0.3838,90,90,90 - gray light 11.57 A 29709
Au-Gd-Tb AuGdTb TiNiSi,oP12,62 Pnma 0.7093,0.49,0.89,90,90,90 AlB2 family - 11.02 A 18163
Au-Gd-Zn Au0.94 Zn1.06 Gd TiNiSi,oP12,62 Pnma 0.6999,0.4513,0.7774,90,90,90 AlB2 family - 11.14 X 56239
Au-Ge-Ho AuHoGe cub MgAgAs,cF12,216 F-43m 0.6534,0.6534,0.6534,90,90,90 - - 10.35 X 49619
Au-Ge-Ho AuHoGe hex LiGaGe,hP6,186 P63mc 0.43991,0.43991,0.72001,90,90,120 AlB2 family gray light 11.96 X 39048
Au-Ge-K K3AuGe4 K3AuSn4,oP16,59 Pmmn 0.6655,1.1911,0.6081,90,90,90 - black 4.17 X 44039
Au-Ge-K K4Au7Ge2 Rb4Au7Sn2,hR39,166 R-3m 0.6411,0.6411,2.7912,90,90,120 - black 8.43 X 31111
Au-Ge-La AuLaGe NdPtSb,hP6,186 P63mc 0.44587,0.44587,0.81631,90,90,120 AlB2 family gray light 9.65 X 33310
Au-Ge-Li Li2AuGe Li2AgSb,cF16,216 F-43m 0.617,0.617,0.617,90,90,90 b.c.c. family orange 8.02 X 4311
Au-Ge-Lu AuLuGe LiGaGe,hP6,186 P63mc 0.43775,0.43775,0.71138,90,90,120 AlB2 family gray light 12.51 X 31727
Au-Ge-Na NaAuGe AuEuGe,oI12,44 Imm2 0.4422,0.7238,0.7531,90,90,90 - black 8.06 X 32383
Au-Ge-Na NaAu3Ge NaAu3Si,cP40,205 Pa-3 0.9021,0.9021,0.9021,90,90,90 - - 12.42 X 13873
Au-Ge-Na Na1.5 Au0.75 Ge0.75 Na1.5 Au0.75 Ge0.75 ,oI16,71 Immm 0.4417,0.7227,0.7529,90,90,90 - - 6.54 X 11046
Au-Ge-Na Na26 Au40.93 Ge14.07 Na26 (Na0.67 Au0.33)6A...,cI162,204 Im-3 1.4581,1.4581,1.4581,90,90,90 Frank-Kasper phase gray 10.37 X 58394
Au-Ge-Nb Au0.4 Nb3Ge0.6 Cr3Si,cP8,223 Pm-3n 0.5177,0.5177,0.5177,90,90,90 Frank-Kasper phase - 9.60 X 16148
Au-Ge-Nd AuNdGe NdPtSb,hP6,186 P63mc 0.4439,0.4439,0.7718,90,90,120 AlB2 family - 10.43 A 38116
Au-Ge-Nd AuNd2Ge6 CuCe2Ge6,oS18,38 Amm2 0.42265,0.41272,2.1689,90,90,90 - - 8.08 A 30286
Au-Ge-Nd Au0.7 NdGe1.3 AlB2 ,hP3,191 P6/mmm 0.4369,0.4369,0.4278,90,90,120 AlB2 family - 8.84 X 38116
Au-Ge-Nd Au2NdGe2 CeAl2Ga2,tI10,139 I4/mmm 0.43404,0.43404,1.0423,90,90,90 - - 11.56 X 52727
Au-Ge-Pr AuPr2Ge6 CuCe2Ge6,oS18,38 Amm2 0.42412,0.41135,2.1772,90,90,90 - - 7.99 A 30286
Au-Ge-Rb Rb3AuGe4 K3AuSn4,oP16,59 Pmmn 0.6894,1.2421,0.6107,90,90,90 - black 4.72 X 44039
Au-Ge-Sc AuScGe LiGaGe,hP6,186 P63mc 0.43082,0.43082,0.68458,90,90,120 AlB2 family gray light 9.49 X 31727
Au-Ge-Sm AuSm2Ge6 CuCe2Ge6,oS18,38 Amm2 0.41945,0.40792,2.1507,90,90,90 - - 8.42 A 30286
Au-Ge-Sr SrAu2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.4519,0.4519,1.0356,90,90,90 - - 9.84 X 58458
Au-Ge-Sr SrAu3Ge BaAu3Ge,tP10,129 P4/nmm 0.6274,0.6274,0.54944,90,90,90 - - 11.53 X 58458
Au-Ge-Tb AuTb2Ge6 CuCe2Ge6,oS18,38 Amm2 0.41325,0.40234,2.1187,90,90,90 - - 8.96 A 30286
Au-Ge-Th Au2 ThGe2 CeAl2Ga2,tI10,139 I4/mmm 0.4378,0.4378,1.0092,90,90,90 - - 13.24 X 10747
Au-Ge-Tm AuTmGe LiGaGe,hP6,186 P63mc 0.43908,0.43908,0.71659,90,90,120 AlB2 family gray light 12.17 A 31727
Au-Ge-U AuUGe YPtAs,hP12,194 P63/mmc 0.43526,0.43526,1.5474,90,90,120 AlB2 family - 13.28 X 38936
Au-Ge-Y AuYGe NdPtSb,hP6,186 P63mc 0.44091,0.44091,0.73053,90,90,120 AlB2 family gray light 9.68 X 33310
Au-Ge-Yb AuYbGe rt AuYbGe,oP36,62 Pnma 2.1332,0.4485,0.7708,90,90,90 AlB2 family - 11.96 X 34414
Au-Ge-Yb AuYb2Ge3 rt Ca2AgSi3,oF48,69 Fmmm 0.85124,0.84995,1.473,90,90,90 - gray silver 9.48 X 58221
Au-Ge-Yb Au0.67 YbGe1.33 AlB2 ,hP3,191 P6/mmm 0.4323,0.4323,0.3936,90,90,120 AlB2 family - 10.47 X 34414
Au-Ge-Yb Au1.03 YbGe0.97 ht AuYbGe,oP36,62 Pnma 2.1311,0.4481,0.7704,90,90,90 - - 12.09 X 34414
Au-Ge-Yb Au1.24 YbGe0.76 AuEuGe,oI12,44 Imm2 0.451,0.7067,0.7786,90,90,90 - - 12.65 X 34414
Au-Ge-Yb Au50 Yb13Ge21.56 Ca13 Au50Ge22,cI170,204 Im-3 1.46334,1.46334,1.46334,90,90,90 - - 14.48 X 54337
Au-H-Nb AuNb3H4.2 Cr3Si,cP8,223 Pm-3n 0.5467,0.5467,0.5467,90,90,90 Frank-Kasper phase - 9.75 F 24893
Au-H-Nb Au1.02 Nb2.98 H2.9 AuNb3H2.9 ,cP30,223 Pm-3n 0.5409,0.5409,0.5409,90,90,90 - - 10.09 X 34396
Au-Hf-In Au2HfIn Cu2MnAl,cF16,225 Fm-3m 0.6514,0.6514,0.6514,90,90,90 b.c.c. family - 16.52 X 9083
Au-Hf-In Au2Hf2In U2Pt2Sn,tP20,136 P42/mnm 0.74545,0.74545,0.7054,90,90,90 - gray silver 14.67 A 31700
Au-Hg-Mg MgAu0.667 Hg0.333 CsCl,cP2,221 Pm-3m 0.33161,0.33161,0.33161,90,90,90 b.c.c. family - 10.13 X 17376
Au-Hg-Mg Mg2 Au0.5 Hg0.5 Co2Si-b,oP12,62 Pnma 0.6081,0.4528,0.8654,90,90,90 - - 6.90 A 17376
Au-Hg-Mg Mg3 Au0.667 Hg0.333 Na3As,hP8,194 P63/mmc 0.469,0.469,0.8489,90,90,120 - - 5.57 A 17376
Au-Hg-Mn Au0.25 Hg0.75Mn lt (Au0.25 Hg0.75 )Mn,oP4,51 Pmma 0.471,0.308,0.481,90,90,90 - - 12.12 X 19347
Au-Hg-Mn Au0.25 Hg0.75Mn rt CsCl,cP2,221 Pm-3m 0.328,0.328,0.328,90,90,90 b.c.c. family - 11.98 X 19347
Au-Hg-P Au2HgP 2 Au2HgP 2,oS36,63 Cmcm 0.32204,1.1301,1.1223,90,90,90 - - 10.68 X 40483
Au-Ho-In AuHoIn ZrNiAl,hP9,189 P-62m 0.7619,0.7619,0.3857,90,90,120 Fe2P family - 12.25 X 40159
Au-Ho-In Au2HoIn Cu2MnAl,cF16,225 Fm-3m 0.687,0.687,0.687,90,90,90 b.c.c. family - 13.80 X 19115
Au-Ho-In Au2Ho 2In Mo2 FeB2,tP10,127 P4/mbm 0.78134,0.78134,0.37195,90,90,90 - gray silver 12.27 A 31700
Au-Ho-Mg Mg0.974 Au1.026 Ho ZrNiAl,hP9,189 P-62m 0.7509,0.7509,0.4077,90,90,120 Fe2P family gray light 9.78 X 38196
270 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Ho-Ni AuHoNi4 MgCu4Sn,cF24,216 F-43m 0.7034,0.7034,0.7034,90,90,90 Friauf-Laves phase - 11.39 A 11015


Au-Ho-Pb AuHoPb MgAgAs,cF12,216 F-43m 0.6718,0.6718,0.6718,90,90,90 - - 12.47 X 21319
Au-Ho-Pb Au2Ho2Pb U2Pt2Sn,tP20,136 P42 /mnm 0.79007,0.79007,0.73932,90,90,90 - - 13.40 A 58526
Au-Ho-Sb Au2Ho5Sb Mo5SiB2,tI32,140 I4/mcm 0.79387,0.79387,1.30282,90,90,90 - - 10.84 X 48631
Au-Ho-Sb Au3Ho3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9788,0.9788,0.9788,90,90,90 - - 11.14 A 10372
Au-Ho-Si Au2HoSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4224,0.4224,1.012,90,90,90 - - 11.31 A 9139
Au-Ho-Sn AuHoSn cub MgAgAs,cF12,216 F-43m 0.6624,0.6624,0.6624,90,90,90 - - 10.98 X 9498
Au-Ho-Sn AuHoSn hex LiGaGe,hP6,186 P63 mc 0.4626,0.4626,0.73429,90,90,120 AlB2 family - 11.73 X 33324
Au-Ho-Sn Au2Ho2Sn U2Pt2Sn,tP20,136 P42 /mnm 0.7797,0.7797,0.7455,90,90,90 - gray light 12.35 A 29701
Au-Ho-Te AuHo6Te2 Sc6PdTe2,oP36,62 Pnma 2.142,0.4062,1.1391,90,90,90 - - 9.66 A 58293
Au-Ho-Te Au2Ho5Te 2 Tm5Sb2Si2 ,oS36,64 Cmce 1.5226,0.78726,0.78537,90,90,90 - - 10.40 A 56271
Au-Ho-Te Au2Ho7Te 2 Au2Er7Te2 ,mS44,12 C12/m1 1.7978,0.40073,1.6997,90,104.427,90 - - 10.10 X 58293
Au-Ho-Zn AuZnHo ZrNiAl,hP9,189 P-62m 0.7345,0.7345,0.3883,90,90,120 Fe2P family - 11.73 A 56239
Au-I-K KAuI3 rt KAuI3,mP20,14 P121/c1 0.7283,0.9259,1.33592,90,119.985,90 - - 5.25 X 12853
Au-I-K KAuI4 KAuI4,mP24,14 P121/c1 0.9686,0.7045,1.3932,90,100.95,90 - black 5.29 X 33785
Au-I-K K3Au3I8 rt Rb3Au3Cl8 ,mS56,15 C12/c1 1.2946,0.818,2.046,90,98.64,90 - - 5.34 A 12821
Au-I-La AuLa3I3 Ca3PI3,cI56,214 I4132 1.2661,1.2661,1.2661,90,90,90 - golden 6.51 X 43979
Au-I-Li LiAuI4 RbAuBr4,mP12,14 P121/c1 0.71,0.4339,1.5117,90,121.5,90 - black 5.95 X 33785
Au-I-P Au7P 10I rt Au7P 10I,hP18,162 P-31m 0.618,0.618,1.1122,90,90,120 - black 8.19 X 12210
Au-I-Rb RbAuI3 rt RbAuBr3,mS20,12 C12/m1 1.35942,0.7932,0.8725,90,119.739,90 - golden 5.39 X 44263
Au-I-Rb Rb3Au3I8 rt Rb3Au3Cl8 ,mS56,15 C12/c1 1.3238,0.9311,2.024,90,98.74,90 - - 5.02 A 12821
Au-I-Te AuTeI AuTeI,mP12,14 P121/c1 0.7313,0.76242,0.7255,90,106.263,90 - black 7.72 X 11708
Au-I-Te AuTe2I AuTe2I,oP8,51 Pmma 1.2579,0.4056,0.4741,90,90,90 - white silver7.95 X 8354
Au-I-Tl AuTl3I5 rt Tl3AuI5,hP56,190 P-62c 1.0569,1.0569,1.3431,90,90,120 - black 7.39 X 12900
Au-In-K KAu4 In2 KAu4 In2,tI28,140 I4/mcm 0.86675,0.86675,0.83684,90,90,90 - - 11.16 X 46544
Au-In-K KAu4 In6 LiCo 6P 4,hP11,187 P-6m2 0.8058,0.8058,0.44411,90,90,120 - - 10.08 X 48447
Au-In-K K0.73 Au2In2 K0.73 Au2In2,tP40,137 P42 /nmc 1.3111,1.3111,0.544,90,90,90 - - 9.26 X 48447
Au-In-K K1.76 Au6In4 K1.76 Au6In4,tI48,140 I4/mcm 0.8665,0.8665,1.419,90,90,90 - - 10.66 X 48447
Au-In-K K34Au8.81 In96.19 Na34Cu7Cd6Ga92,hR417,166 R-3m 1.84741,1.84741,3.996,90,90,120 - - 5.95 X 46509
Au-In-La AuLaIn ZrNiAl,hP9,189 P-62m 0.7727,0.7727,0.4315,90,90,120 Fe2P family - 10.06 X 11077
Au-In-La Au2LaIn4 rt NdRh2Sn4 ,oP28,62 Pnma 1.8506,0.46865,0.73414,90,90,90 - - 10.35 X 48456
Au-In-La Au2La2 In Mo2FeB2,tP10,127 P4/mbm 0.80963,0.80963,0.39998,90,90,90 - gray silver 9.96 A 31700
Au-In-La Au4La3 In7 Er3Pd7P4,mS28,12 C12/m1 1.72414,0.46042,1.0396,90,126.309,90 - gray silver 10.03 X 38165
Au-In-Li LiAu0.5 In0.5 cub2 NaTl,cF16,227 Fd-3m 0.6466,0.6466,0.6466,90,90,90 b.c.c. family - 8.00 X 4313
Au-In-Li Li0.87 Au2In1.13 Cu2MnAl,cF16,225 Fm-3m 0.64982,0.64982,0.64982,90,90,90 b.c.c. family - 12.82 X 56834
Au-In-Li Li17.55 Au1.35 In8.1 Li22Pb5,cF432,216 F-43m 1.9997,1.9997,1.9997,90,90,90 b.c.c. family - 4.38 X 56834
Au-In-Li Li2.24 Au0.88 In0.88 cub1 Li2AgSb,cF16,216 F-43m 0.64663,0.64663,0.64663,90,90,90 b.c.c. family yellow 7.12 X 56834
Au-In-Lu AuLuIn ZrNiAl,hP9,189 P-62m 0.7635,0.7635,0.382,90,90,120 Fe2P family - 12.57 A 9498
Au-In-Lu Au2LuIn Cu2MnAl,cF16,225 Fm-3m 0.6822,0.6822,0.6822,90,90,90 b.c.c. family - 14.30 X 19115
Au-In-Lu Au2Lu2 In U2Pt2Sn,tP20,136 P42 /mnm 0.7755,0.7755,0.7287,90,90,90 - gray light 13.02 A 29709
Au-In-Na NaAuIn2 MgCuAl2,oS16,63 Cmcm 0.4482,1.0366,0.7869,90,90,90 - gray silver 8.17 X 31060
Au-In-Na Na3AuIn2 Mn3Ni2Si,cF96,227 Fd-3m 1.35337,1.35337,1.35337,90,90,90 - - 5.31 X 44715
Au-In-Nd AuNdIn ZrNiAl,hP9,189 P-62m 0.7719,0.7719,0.4124,90,90,120 Fe2P family - 10.68 X 11077
Au-In-Nd Au2NdIn rt Cu2MnAl,cF16,225 Fm-3m 0.703,0.703,0.703,90,90,90 b.c.c. family - 12.48 X 19115
Au-In-Nd Au2NdIn4 lt NdRh2Sn4 ,oP28,62 Pnma 1.8406,0.46114,0.74073,90,90,90 - - 10.54 X 48456
Au-In-Nd Au2Nd2In Mo2FeB2,tP10,127 P4/mbm 0.7976,0.7976,0.38863,90,90,90 - gray silver 10.71 A 31700
Au-In-Nd Au3Nd2In5 Au3Ce2In5 ,oP80,31 Pmn21 0.45998,5.3382,0.7407,90,90,90 - gray light 10.62 A 36319
Au-In-Pr AuPrIn ZrNiAl,hP9,189 P-62m 0.77,0.77,0.4195,90,90,120 Fe2P family - 10.47 X 11077
Au-In-Pr Au2PrIn rt Cu2MnAl,cF16,225 Fm-3m 0.7055,0.7055,0.7055,90,90,90 b.c.c. family - 12.29 X 19115
Au-In-Pr Au2PrIn4 lt NdRh2Sn4 ,oP28,62 Pnma 1.842,0.46202,0.7376,90,90,90 - - 10.52 X 48456
Au-In-Pr Au2Pr2In Mo2FeB2,tP10,127 P4/mbm 0.80025,0.80025,0.392,90,90,90 - gray silver 10.46 A 31700
Au-In-Pr Au3Pr2In5 Au3Ce2In5 ,oP80,31 Pmn21 0.46181,5.3507,0.7422,90,90,90 - gray light 10.48 A 36319
Au-In-Pt Au2.98 Pt0.02 In Cu3Ti,oP8,59 Pmmn 0.4725,0.584,0.5135,90,90,90 close-packed structure - 16.54 A 1166
Au-In-Rb RbAu4In2 KAu4 In2,tI28,140 I4/mcm 0.88349,0.88349,0.82736,90,90,90 - - 11.34 X 46544
Au-In-Rb RbAu4In6 LiCo 6P 4,hP11,187 P-6m2 0.8079,0.8079,0.44857,90,90,120 - - 10.23 X 48447
Au-In-Rb Rb0.66 Au2 In2 K0.73 Au2In2,tP40,137 P42 /nmc 1.3305,1.3305,0.546,90,90,90 - - 9.35 X 48447
Au-In-Sb AuIn0.7 Sb0.3 ht NiAs,hP4,194 P63 /mmc 0.43014,0.43014,0.55347,90,90,120 AlB2 family - 11.75 X 13857
Au-In-Sb AuIn0.9 Sb0.1 *,o**,* - 0.358,0.43,1.0582,90,90,90 - - - N 13857
Au-In-Sb Au0.08 In1.08 Sb0.92 *,cF*,* - 0.6478,0.6478,0.6478,90,90,90 - - 6.15 N 3555
Au-In-Sc Au2ScIn Cu2MnAl,cF16,225 Fm-3m 0.6692,0.6692,0.6692,90,90,90 b.c.c. family - 12.27 X 20154
Au-In-Sc Au2Sc2In U2Pt2Sn,tP20,136 P42 /mnm 0.75669,0.75669,0.69563,90,90,90 - gray silver 9.98 A 31700
Au-In-Sm AuSmIn ZrNiAl,hP9,189 P-62m 0.7716,0.7716,0.4043,90,90,120 Fe2P family - 11.05 X 11077
Au-In-Sm Au2SmIn Cu2MnAl,cF16,225 Fm-3m 0.6973,0.6973,0.6973,90,90,90 b.c.c. family - 12.91 X 19115
Au-In-Sm Au2Sm2In Mo2FeB2,tP10,127 P4/mbm 0.79302,0.79302,0.38282,90,90,90 - gray silver 11.17 A 31700
Au-In-Sm Au3Sm2In5 Au3Ce2In5 ,oP80,31 Pmn21 0.4564,5.3325,0.7394,90,90,90 - gray light 10.82 A 36319
Au-In-Sn AuIn0.74 Sn0.26 TlI,oS8,63 Cmcm 0.36,1.049,0.428,90,90,90 CrB(TlI)-FeB - 12.85 A 4213
Au-In-Sn Au2In1.5 Sn1.5 Pt2Sn3,hP10,194 P63 /mmc 0.45,0.45,1.3047,90,90,120 - - 10.80 A 996
Au-In-Sn Au3In0.88 Sn0.12 rt Cu3Ti,oP8,59 Pmmn 0.4765,0.59,0.518,90,90,90 close-packed structure - 16.11 A 1166
Au-In-Sr SrAuIn TiNiSi,oP12,62 Pnma 0.7722,0.4786,0.844,90,90,90 AlB2 family - 8.51 X 49614
Au-In-Sr SrAuIn3 CeAl2Ga2,tI10,139 I4/mmm 0.4577,0.4577,1.2371,90,90,90 - - 8.06 X 48433
Au-In-Sr SrAu2In2 ThRu2P 2,oP20,62 Pnma 0.853,0.4598,1.2283,90,90,90 - - 9.81 X 48433
Au-In-Sr SrAu3In3 SrAu3In3,oP14,59 Pmmn 0.45526,0.7759,0.9049,90,90,90 - - 10.63 X 49001
Au-In-Sr SrAu3.36 In4.64 UCr5P3,mP18,11 P121/m1 0.8086,0.4438,1.1586,90,99.65,90 - - 10.39 X 54514
Au-In-Sr SrAu3.76 In4.24 YCo5P 3,oP36,62 Pnma 1.3946,0.4458,1.2921,90,90,90 - - 10.87 X 50418
Au-In-Sr SrAu4.3 In1.7 Cu6Ce,oP28,62 Pnma 0.91017,0.56379,1.15149,90,90,90 - gray silver 12.70 X 56273
Au-In-Sr SrAu4.76 In1.24 YbMo2Al4 ,tI14,139 I4/mmm 0.71877,0.71877,0.55279,90,90,90 - - 13.58 X 57531
Au-In-Sr Sr2Au2.85 In4.15 Hf2Co4P 3,hP36,189 P-62m 1.5016,1.5016,0.4579,90,90,120 - - 9.01 X 36210
Au-In-Sr Sr4Au9In13 Sr4Au9In13 ,hP26,187 P-6m2 1.2701,1.2701,0.4435,90,90,120 - - 9.69 X 50418
Handbook of Inorganic Substances – Edition 2015 : Data 271

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-In-Sr Sr5Au13.5 In8.5 Sr5Au13(Au0.25 In0.75)2In7,oP54,59 Pmmn 0.46737,2.9275,0.8949,90,90,90 - - 11.05 X 57495


Au-In-Tb AuTbIn ZrNiAl,hP9,189 P-62m 0.7674,0.7674,0.3909,90,90,120 Fe2P family - 11.76 X 40159
Au-In-Tb Au2 TbIn Cu2MnAl,cF16,225 Fm-3m 0.6913,0.6913,0.6913,90,90,90 b.c.c. family - 13.42 X 19115
Au-In-Tb Au2 Tb2 In Mo2 FeB2,tP10,127 P4/mbm 0.78535,0.78535,0.37658,90,90,90 - gray silver 11.82 A 31700
Au-In-Th Au2 ThIn Cu2MnAl,cF16,225 Fm-3m 0.707,0.707,0.707,90,90,90 b.c.c. family - 13.92 X 21336
Au-In-Ti Au2 TiIn Cu2MnAl,cF16,225 Fm-3m 0.6527,0.6527,0.6527,90,90,90 b.c.c. family - 13.30 X 9083
Au-In-Tm AuTmIn ZrNiAl,hP9,189 P-62m 0.766,0.766,0.383,90,90,120 Fe2P family - 12.31 A 9498
Au-In-Tm Au2 TmIn Cu2MnAl,cF16,225 Fm-3m 0.6856,0.6856,0.6856,90,90,90 b.c.c. family - 13.97 X 19115
Au-In-Tm Au2 Tm2In U2Pt2Sn,tP20,136 P42/mnm 0.77795,0.77795,0.73437,90,90,90 - gray silver 12.65 A 31700
Au-In-U Au2UIn Cu2MnAl,cF16,225 Fm-3m 0.6969,0.6969,0.6969,90,90,90 b.c.c. family - 14.66 X 21413
Au-In-Y AuYIn ZrNiAl,hP9,189 P-62m 0.7691,0.7691,0.3907,90,90,120 Fe2P family - 9.97 X 11077
Au-In-Y Au2 YIn Cu2MnAl,cF16,225 Fm-3m 0.6905,0.6905,0.6905,90,90,90 b.c.c. family - 12.06 X 16356
Au-In-Y Au2 Y2In Mo2 FeB2,tP10,127 P4/mbm 0.78367,0.78367,0.3744,90,90,90 - gray silver 9.92 A 31700
Au-In-Yb AuYbIn ZrNiAl,hP9,189 P-62m 0.77127,0.77127,0.40294,90,90,120 Fe2P family - 11.64 X 56284
Au-In-Yb AuYbIn2 MgCuAl2,oS16,63 Cmcm 0.4559,1.0764,0.7552,90,90,90 - gray 10.75 X 35686
Au-In-Yb Au2 YbIn Cu2MnAl,cF16,225 Fm-3m 0.686,0.686,0.686,90,90,90 b.c.c. family - 14.03 X 19115
Au-In-Yb Au2 YbIn4 Au2 YbIn4,mP14,11 P121/m1 0.76536,0.45424,0.9591,90,107.838,90 - gray silver 10.74 X 54273
Au-In-Yb Au2 Yb2In Mo2 FeB2,tP10,127 P4/mbm 0.7842,0.7842,0.3847,90,90,90 - gray silver 12.00 A 38623
Au-In-Yb Au3 Yb2In5 Y2Rh3Sn5,oS40,36 Cmc21 0.45351,2.6824,0.74641,90,90,90 - gray silver 11.05 X 54273
Au-In-Zn Au3Zn0.08 In0.92 Cu3Ti,oP8,59 Pmmn 0.4755,0.585,0.5155,90,90,90 close-packed structure - 16.25 A 1166
Au-In-Zr AuZr0.5 In0.5 CsCl,cP2,221 Pm-3m 0.3365,0.3365,0.3365,90,90,90 b.c.c. family - 13.07 X 9083
Au-In-Zr Au2ZrIn Cu2MnAl,cF16,225 Fm-3m 0.673,0.673,0.673,90,90,90 b.c.c. family - 13.07 X 9083
Au-In-Zr Au2Zr2In U2Pt2Sn,tP20,136 P42/mnm 0.75263,0.75263,0.70504,90,90,90 - gray silver 11.50 A 31700
Au-Ir-Nb Au0.75 Nb3Ir0.25 Cr3Si,cP8,223 Pm-3n 0.5181,0.5181,0.5181,90,90,90 Frank-Kasper phase - 11.33 X 16148
Au-K-N KAu[N3]4 KAu[N3]4,mS56,15 C12/c1 1.0493,1.04752,0.77697,90,91.22,90 - orange red 3.14 X 47595
Au-K-O KAuO2 KAuO2,oP4,47 Pmmm 0.3005,0.3585,0.5849,90,90,90 - - 7.06 X 5586
Au-K-O K3AuO CaTiO3,cP5,221 Pm-3m 0.524,0.524,0.524,90,90,90 perovskite family black 3.81 X 31071
Au-K-P K2AuP Na2CuAs,oS16,63 Cmcm 0.9787,0.7395,0.6168,90,90,90 - black 4.56 X 25668
Au-K-P K5AuP 2 K5CuAs2,hP16,194 P63/mmc 0.5636,0.5636,1.8716,90,90,120 - black 2.93 X 26036
Au-K-Pb K3Au5Pb K3Au5Pb,oI36,74 Imma 0.5646,1.95,0.8412,90,90,90 - gray silver 9.39 X 35147
Au-K-S KAuS KAuS,oS12,63 Cmcm 0.6304,0.785,0.652,90,90,90 - colorless 5.52 X 20170
Au-K-S KAuS5 KAuSe 5,oI56,72 Ibam 0.831,1.0758,1.5468,90,90,90 - orange 3.81 X 33215
Au-K-S K4Au6S5 K4Au6S5,hP30,190 P-62c 0.9631,0.9631,0.9856,90,90,120 - green 6.29 X 21302
Au-K-Sb K2AuSb Na2CuAs,oS16,63 Cmcm 1.045,0.7857,0.6501,90,90,90 - gray 4.94 X 55514
Au-K-Sb K3Au3Sb2 K3Cu3P2,hR24,166 R-3m 0.6198,0.6198,2.152,90,90,120 - gray silver 6.62 X 32479
Au-K-Se KAuSe KAuS,oS12,63 Cmcm 0.6494,0.8107,0.6672,90,90,90 - yellow 5.96 X 20170
Au-K-Se KAuSe 2 KAuSe 2,tP8,127 P4/mbm 0.7699,0.7699,0.3665,90,90,90 - black 6.02 X 33215
Au-K-Se KAuSe 5 KAuSe 5,oI56,72 Ibam 0.8625,1.1293,1.6425,90,90,90 - black 5.24 X 33215
Au-K-Se K3AuSe 13 K3AuSe13,mP34,13 P12/c1 1.4949,0.4858,1.3723,90,93.86,90 - - 4.48 X 23246
Au-K-Se K3AuSe 2 Na3AuS2,hR36,167 R-3c 0.8903,0.8903,1.809,90,90,120 - yellow 3.79 X 31125
Au-K-Sn KAu3Sn3 SrAu3In3,oP14,59 Pmmn 0.46614,0.7659,0.9271,90,90,90 - - 9.89 X 50425
Au-K-Sn KAu4Sn2 KAu4Sn2,tI28,120 I-4c2 0.8847,0.8847,0.8178,90,90,90 - - 11.05 X 12004
Au-K-Sn KAu4Sn6 KAu4Sn6,oF88,70 Fddd 0.8709,1.0028,2.4157,90,90,90 - - 9.69 X 50425
Au-K-Sn K12Au21Sn4 K12Au21Sn4,oP74,59 Pmmn 1.2162,1.8058,0.8657,90,90,90 - - 8.87 X 52242
Au-K-Sn K23Au12Sn9 K23Au12Sn9,tI88,121 I-42m 2.0834,2.0834,0.68183,90,90,90 - gray silver 4.86 X 54298
Au-K-Sn K3AuSn4 K3AuSn4,oP16,59 Pmmn 0.6938,1.2544,0.6523,90,90,90 - gray silver 4.62 X 35218
Au-K-Te KAuTe BeZrSi,hP6,194 P63/mmc 0.4646,0.4646,0.9744,90,90,120 AlB2 family - 6.63 X 23533
Au-La-Mg MgAuLa ZrNiAl,hP9,189 P-62m 0.781,0.781,0.42549,90,90,120 Fe2P family gray light 7.98 A 38196
Au-La-Ni Au0.5 LaNi4.5 CaCu5,hP6,191 P6/mmm 0.5081,0.5081,0.40323,90,90,120 - - 9.24 X 56225
Au-La-Ni Au4LaNi Be5Au,cF24,216 F-43m 0.76488,0.76488,0.76488,90,90,90 Friauf-Laves phase - 14.63 A 56225
Au-La-O AuLaO3 AuLaO3,oP20,57 Pbcm 0.40335,1.3073,0.56952,90,90,90 - yellow 8.49 X 27728
Au-La-O Au2La4O9 Au2La4O9,oP60,60 Pbcn 1.21216,0.63199,1.21067,90,90,90 - yellow 7.83 X 28744
Au-La-P AuLa2P 3 U2NiC3,oP24,62 Pnma 0.78362,0.4254,1.6275,90,90,90 - - 6.95 A 39464
Au-La-Pb AuLaPb CaIn2,hP6,194 P63/mmc 0.482,0.482,0.7842,90,90,120 AlB2 family - 11.43 X 21319
Au-La-Pb Au2La2Pb U2Pt2Sn,tP20,136 P42/mnm 0.81582,0.81582,0.80053,90,90,90 - - 10.96 A 58526
Au-La-Sb AuLaSb2 CuHfSi2,tP8,129 P4/nmm 0.4436,0.4436,1.0432,90,90,90 - - 9.37 X 31814
Au-La-Sb Au1.5 LaSb0.5 Hg2U,hP3,191 P6/mmm 0.47413,0.47413,0.37633,90,90,120 AlB2 family - 11.22 X 48564
Au-La-Sb Au3La3Sb4 Au3 Y3Sb4,cI40,220 I-43d 1.0123,1.0123,1.0123,90,90,90 - - 9.57 A 25454
Au-La-Si Au2LaSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4337,0.4337,1.018,90,90,90 - - 10.22 A 7464
Au-La-Sn AuLaSn CaIn2,hP6,194 P63/mmc 0.47404,0.47404,0.78819,90,90,120 AlB2 family - 9.84 X 39026
Au-La-Zn Au1.09 Zn0.91 La TiNiSi,oP12,62 Pnma 0.7331,0.4643,0.7981,90,90,90 AlB2 family - 10.10 X 56239
Au-Li-Mg Li2MgAu Cu2MnAl,cF16,225 Fm-3m 0.6442,0.6442,0.6442,90,90,90 b.c.c. family - 5.84 X 4310
Au-Li-O Li2.5 Au0.5 O2 Li2CuO2,oI10,71 Immm 0.294,0.3673,0.9505,90,90,90 - colorless 4.78 X 5586
Au-Li-O Li3AuO3 Li3AuO3,tP28,136 P42/mnm 0.9111,0.9111,0.3576,90,90,90 - yellow 5.95 X 5586
Au-Li-Pb Li2AuPb Li2AgSb,cF16,216 F-43m 0.6601,0.6601,0.6601,90,90,90 b.c.c. family violet 9.65 X 4311
Au-Li-S LiAuS mon LiAuS,mS24,15 C12/c1 0.8994,0.8956,0.71967,90,128.638,90 - orange 6.92 X 34363
Au-Li-S LiAuS orth LiAuS,oF48,70 Fddd 0.89252,0.89686,1.12062,90,90,90 - orange 6.99 X 38646
Au-Li-S Li3AuS2 Na3AgO2,oI24,72 Ibam 0.5763,1.1281,0.6276,90,90,90 - yellow 4.59 X 38646
Au-Li-Sb LiAu0.5 Sb0.5 cub2 NaTl,cF16,227 Fd-3m 0.6441,0.6441,0.6441,90,90,90 b.c.c. family - 8.27 X 4313
Au-Li-Sb Li2AuSb cub1 Li2AgSb,cF16,216 F-43m 0.6442,0.6442,0.6442,90,90,90 b.c.c. family gray 8.26 X 4311
Au-Li-Si LiAu0.5 Si0.5 NaTl,cF16,227 Fd-3m 0.6078,0.6078,0.6078,90,90,90 b.c.c. family yellowish 7.07 X 4311
Au-Li-Sn LiAuSn BeZrSi,hP6,194 P63/mmc 0.46708,0.46708,0.6037,90,90,120 AlB2 family - 9.39 X 40380
Au-Li-Sn LiAu3Sn4 LiAu3Sn4,hP16,186 P63mc 0.44831,0.44831,2.0557,90,90,120 - - 9.96 X 40380
Au-Li-Sn Li2AuSn Li2AgSb,cF16,216 F-43m 0.6438,0.6438,0.6438,90,90,90 b.c.c. family orange 8.20 X 4311
Au-Li-Sn Li2AuSn2 Li2AuSn2,tI20,141 I41/amd 0.4556,0.4556,1.9574,90,90,90 - gray dark 7.33 X 42763
Au-Li-Tl Li2AuTl Li2AgSb,cF16,216 F-43m 0.6549,0.6549,0.6549,90,90,90 b.c.c. family yellow 9.82 X 4311
Au-Lu-Ni AuLuNi4 MgCu4Sn,cF24,216 F-43m 0.6948,0.6948,0.6948,90,90,90 Friauf-Laves phase - 12.02 A 9105
Au-Lu-Pb Au2Lu2Pb U2Pt2Sn,tP20,136 P42/mnm 0.78322,0.78322,0.72603,90,90,90 - - 14.18 A 58526
272 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-Lu-Sb Au3Lu3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9723,0.9723,0.9723,90,90,90 - - 11.58 A 10372


Au-Lu-Si AuLuSi AuScSi,hP6,187 P-6m2 0.4267,0.4267,0.7151,90,90,120 AlB2 family - 11.78 X 26155
Au-Lu-Sn AuLuSn cub MgAgAs,cF12,216 F-43m 0.65652,0.65652,0.65652,90,90,90 - gray silver 11.52 X 47516
Au-Lu-Sn AuLuSn hex LiGaGe,hP6,186 P63 mc 0.4565,0.4565,0.7398,90,90,120 AlB2 family - 12.20 X 49619
Au-Lu-Sn Au2Lu2Sn U2Pt2Sn,tP20,136 P42 /mnm 0.7728,0.7728,0.7342,90,90,90 - gray light 13.07 A 29701
Au-Lu-Te AuLu6 Te2 Sc6PdTe2,oP36,62 Pnma 2.10731,0.4003,1.1267,90,90,90 - - 10.50 X 58293
Au-Lu-Te Au2Lu5 Te 2 Tm5Sb2Si2 ,oS36,64 Cmce 1.5056,0.77491,0.77547,90,90,90 - - 11.19 X 56271
Au-Lu-Te Au2Lu7 Te 2 Au2Er7Te2 ,mS44,12 C12/m1 1.7536,0.39719,1.6695,90,104.33,90 - - 11.05 A 54113
Au-Lu-Zn AuZnLu ZrNiAl,hP9,189 P-62m 0.739,0.739,0.3782,90,90,120 Fe2P family - 12.18 A 56239
Au-Mg-Nd MgAuNd ZrNiAl,hP9,189 P-62m 0.7672,0.7672,0.4181,90,90,120 Fe2P family gray light 8.55 A 38196
Au-Mg-Pr Mg0.988 Au1.012Pr ZrNiAl,hP9,189 P-62m 0.7708,0.7708,0.4195,90,90,120 Fe2P family gray light 8.41 X 38196
Au-Mg-Sm MgAuSm ZrNiAl,hP9,189 P-62m 0.76191,0.76191,0.41498,90,90,120 Fe2P family gray light 8.88 A 38196
Au-Mg-Sn MgAuSn MgAgAs,cF12,216 F-43m 0.641,0.641,0.641,90,90,90 - red violet 8.58 X 13867
Au-Mg-Sr SrMg2Au MgCuAl2,oS16,63 Cmcm 0.44155,1.1316,0.83324,90,90,90 - - 5.32 A 59742
Au-Mg-Tb MgAuTb ZrNiAl,hP9,189 P-62m 0.7546,0.7546,0.41082,90,90,120 Fe2P family gray light 9.35 A 38196
Au-Mg-Tm MgAuTm ZrNiAl,hP9,189 P-62m 0.7464,0.7464,0.40524,90,90,120 Fe2P family gray light 9.94 A 38196
Au-Mg-Y MgAuY ZrNiAl,hP9,189 P-62m 0.7523,0.7523,0.4094,90,90,120 Fe2P family gray light 7.70 A 38196
Au-Mg-Yb MgAuYb TiNiSi,oP12,62 Pnma 0.7384,0.4362,0.8646,90,90,90 AlB2 family gray light 9.41 X 38196
Au-Mg-Yb MgAuYb4 Gd4RhIn,cF96,216 F-43m 1.45126,1.45126,1.45126,90,90,90 - - 7.94 A 59572
Au-Mn-N AuMn3N CaTiO3,cP5,221 Pm-3m 0.40235,0.40235,0.40235,90,90,90 perovskite family - 9.58 X 3487
Au-Mn-Sb AuMnSb MgAgAs,cF12,216 F-43m 0.6376,0.6376,0.6376,90,90,90 - - 9.58 X 10084
Au-Mn-Sn AuMnSn MgAgAs,cF12,216 F-43m 0.6338,0.6338,0.6338,90,90,90 - brown 9.67 X 34537
Au-Mn-Sn Au0.85 Mn0.02 Sn0.13 ht Mg,hP2,194 P63 /mmc 0.2918,0.2918,0.4783,90,90,120 close-packed structure - 17.32 X 1733
Au-N-Nb Au2Nb3Nx Mg3Ru2,cP20,213 P4132 0.7085,0.7085,0.7085,90,90,90 - - 12.56 F 2740
Au-N-O [NO]Au[NO3]4 [NO]Au[NO3]4,mP38,14 P121/c1 0.82701,0.72638,0.97443,90,120.039,90 - yellow 3.11 X 57545
Au-N-O [NO2]Au[NO3]4 [NO2]Au[NO3]4,mP40,14 P121/c1 0.7751,0.8102,0.93353,90,117.338,90 - yellow 3.13 X 50169
Au-N-Rb RbAu[N3 ]4 KAu[N3]4,mS56,15 C12/c1 1.03393,1.0642,0.80979,90,89.678,90 - orange red 3.36 X 47595
Au-N-Sr Sr2AuN Ca2AuN,oS16,63 Cmcm 0.379,1.9005,0.5244,90,90,90 - - 6.79 X 40912
Au-N-V AuV3N CaTiO3,cP5,221 Pm-3m 0.3962,0.3962,0.3962,90,90,90 perovskite family - 9.71 X 2740
Au-Na-O NaAuO2 KCuO2,oS16,63 Cmcm 0.38956,1.1373,0.5685,90,90,90 - orange pale 6.64 X 39621
Au-Na-O Na0.67 Au2.67 O4 Cu3AsS4,cP8,215 P-43m 0.4832,0.4832,0.4832,90,90,90 adamantane structure - 8.91 X 4749
Au-Na-O Na3AuO2 tet Na3AuO2,tP24,136 P42 /mnm 0.9705,0.9705,0.4578,90,90,90 - golden 4.59 X 20810
Au-Na-O Na3AuO3 orth *,oP*,* - 0.856,0.9,1.051,90,90,90 - - - N 5586
Au-Na-S NaAuS NaAuS,oS96,68 Ccce 1.4658,2.1043,0.7118,90,90,90 - yellow 6.10 X 34363
Au-Na-S Na3AuS2 Na3AuS2,hR36,167 R-3c 0.7623,0.7623,1.6672,90,90,120 - colorless 3.92 X 20200
Au-Na-S Na7Au5S6 Na7Au5S6,oP72,60 Pbcn 1.0424,0.7024,2.227,90,90,90 - colorless 5.45 X 26092
Au-Na-Sb Na2AuSb Na2CuAs,oS16,63 Cmcm 0.9279,0.7562,0.5841,90,90,90 - gray 5.91 X 13859
Au-Na-Se NaAuSe2 NaAuSe2,mP16,14 P121/c1 0.6991,0.8374,0.6724,90,105.23,90 - black 6.61 X 33215
Au-Na-Se Na5AuSe12 Na5AuSe12 ,mP36,4 P1211 0.7145,1.679,0.8291,90,107.13,90 - red 4.40 X 34505
Au-Na-Si NaAu3Si NaAu3Si,cP40,205 Pa-3 0.8916,0.8916,0.8916,90,90,90 - - 12.03 X 13873
Au-Na-Si Na26Au40.5 Si14.5 Na26(Na0.67 Au0.33)6A...,cI162,204 Im-3 1.4438,1.4438,1.4438,90,90,90 Frank-Kasper phase gray 9.91 X 12877
Au-Na-Sn Na2AuSn3 Lu2CoGa3 ,hP24,194 P63 /mmc 0.9585,0.9585,0.7516,90,90,120 AlB2 family gray silver 6.65 X 39526
Au-Na-Sn Na26Au38.54 Sn13.45 Na26(Na0.67 Au0.33)6A...,cI162,204 Im-3 1.50194,1.50194,1.50194,90,90,90 Frank-Kasper phase gray 9.59 X 58394
Au-Na-Te NaAuTe BeZrSi,hP6,194 P63 /mmc 0.4567,0.4567,0.8483,90,90,120 AlB2 family - 7.53 X 26121
Au-Na-Tl Na4AuTl Na4AuTl,oF48,69 Fmmm 0.5453,1.0006,2.3387,90,90,90 - gray silver 5.14 X 33765
Au-Na-Zn Na0.72 Au2 Zn2 Na0.72 Au2Zn2,tP12,127 P4/mbm 0.78799,0.78799,0.27326,90,90,90 - - 10.59 X 58402
Au-Na-Zn Na0.97 Au2 Zn4 Na0.97 Au2Zn4,tP36,127 P4/mbm 0.79859,0.79859,0.79709,90,90,90 - - 8.86 X 58402
Au-Nb-Os Au0.5 Nb3Os0.5 Cr3Si,cP8,223 Pm-3n 0.5165,0.5165,0.5165,90,90,90 Frank-Kasper phase - 11.38 X 1488
Au-Nb-Pt Au0.668 Nb3.044Pt0.288 Cr3Si,cP8,223 Pm-3n 0.519,0.519,0.519,90,90,90 Frank-Kasper phase - 11.18 X 16612
Au-Nb-Rh Au0.5 Nb3Rh0.5 Cr3Si,cP8,223 Pm-3n 0.51688,0.51688,0.51688,90,90,90 Frank-Kasper phase - 10.31 X 2765
Au-Nb-Zn Au0.2 Zn0.2 Nb0.6 (N) Mn,cP20,213 P4132 0.7052,0.7052,0.7052,90,90,90 - - 10.25 A 2740
Au-Nd-O Au2Nd4O9 rt Au2La4O9,oP60,60 Pbcn 1.19813,0.61474,1.19641,90,90,90 - brown 8.40 X 38190
Au-Nd-P AuNd2P 3 AuNd2P 3,mP24,14 P121/c1 0.41614,0.76887,1.6471,90,104.06,90 - - 7.51 X 39464
Au-Nd-Pb AuNdPb CaIn2,hP6,194 P63 /mmc 0.4764,0.4764,0.7628,90,90,120 AlB2 family - 12.15 X 21319
Au-Nd-Pb Au2Nd2Pb U2Pt2Sn,tP20,136 P42 /mnm 0.8035,0.8035,0.77853,90,90,90 - - 11.76 A 58526
Au-Nd-Sb AuNdSb2 CuHfSi2,tP8,129 P4/nmm 0.4387,0.4387,1.0192,90,90,90 - - 9.90 A 28806
Au-Nd-Sb Au3Nd3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9961,0.9961,0.9961,90,90,90 - - 10.15 A 10372
Au-Nd-Si AuNdSi AlB2,hP3,191 P6/mmm 0.4285,0.4285,0.4192,90,90,120 AlB2 family - 9.20 X 34403
Au-Nd-Si Au0.2 NdSi1.8 ThSi2,tI12,141 I41/amd 0.41768,0.41768,1.39893,90,90,90 - - 6.37 X 34403
Au-Nd-Si Au0.7 NdSi1.3 AlB2,hP3,191 P6/mmm 0.4274,0.4274,0.4216,90,90,120 AlB2 family - 7.93 X 34403
Au-Nd-Si Au2NdSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4276,0.4276,1.019,90,90,90 - - 10.59 A 9139
Au-Nd-Sn AuNdSn LiGaGe,hP6,186 P63 mc 0.47115,0.47115,0.75737,90,90,120 AlB2 family - 10.49 X 33324
Au-Nd-Zn Au1.22 Zn0.78 Nd TiNiSi,oP12,62 Pnma 0.7088,0.4596,0.7912,90,90,90 AlB2 family - 11.22 X 56239
Au-Ni-Sc AuScNi4 MgCu4Sn,cF24,216 F-43m 0.6828,0.6828,0.6828,90,90,90 Friauf-Laves phase - 9.95 A 9105
Au-Ni-Sn AuNiSn2 rt AuNiSn2,hP4,164 P-3m1 0.41241,0.41241,0.52924,90,90,120 - gray 10.50 X 47574
Au-Ni-Sn AuNi2Sn4 AuNi2Sn4,hR21,166 R-3m 0.4226,0.4226,2.6566,90,90,120 - - 9.57 X 30677
Au-Ni-Sn Au0.5 Ni0.5 Sn NiAs,hP4,194 P63 /mmc 0.41,0.41,0.529,90,90,120 AlB2 family - 10.63 X 32039
Au-Ni-Sn Au0.852 Ni0.02 Sn0.128 Mg,hP2,194 P63 /mmc 0.2914,0.2914,0.47855,90,90,120 close-packed structure - 17.38 X 1733
Au-Ni-Sn Au0.906 Ni0.094 Sn4 PtSn4,oS20,68 Ccce 0.6523,1.1676,0.6485,90,90,90 - - 8.86 X 40144
Au-Ni-Tb AuTbNi4 MgCu4Sn,cF24,216 F-43m 0.7094,0.7094,0.7094,90,90,90 Friauf-Laves phase - 10.99 A 11015
Au-Ni-Ti Au0.36 TiNi0.64 cub CsCl,cP2,221 Pm-3m 0.30872,0.30872,0.30872,90,90,90 b.c.c. family - 8.83 X 56066
Au-Ni-Ti Au0.36 TiNi0.64 orth AuCd,oP4,51 Pmma 0.44005,0.28886,0.46323,90,90,90 close-packed structure - 8.82 A 56066
Au-Ni-Tm AuTmNi4 MgCu4Sn,cF24,216 F-43m 0.6982,0.6982,0.6982,90,90,90 Friauf-Laves phase - 11.72 A 11015
Au-Ni-Y AuYNi4 MgCu4Sn,cF24,216 F-43m 0.7059,0.7059,0.7059,90,90,90 Friauf-Laves phase - 9.83 A 9105
Au-Ni-Yb AuYbNi4 MgCu4Sn,cF24,216 F-43m 0.6952,0.6952,0.6952,90,90,90 Friauf-Laves phase - 11.96 A 11015
Au-Np-Si Au2NpSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4248,0.4248,1.0221,90,90,90 - - 12.37 X 27417
Au-O-Rb RbAuO KAgO,tI24,139 I4/mmm 0.9937,0.9937,0.58193,90,90,90 - colorless 6.90 X 39636
Au-O-Rb RbAuO2 KCuO2,oS16,63 Cmcm 0.456,1.23,0.596,90,90,90 - - 6.25 X 5586
Handbook of Inorganic Substances – Edition 2015 : Data 273

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-O-Rb Rb3AuO CaTiO3,cP5,221 Pm-3m 0.5501,0.5501,0.5501,90,90,90 perovskite family blackish 4.68 X 31071
Au-O-Rb Rb5Au3O2 Rb5Au3O2,oP20,55 Pbam 0.7364,1.4308,0.5679,90,90,90 - - 5.83 X 37735
Au-O-Rb Rb7Au5O2 Rb7Au5O2,oI28,71 Immm 0.5671,0.9301,1.6594,90,90,90 - - 6.13 X 36807
Au-O-S Au[SO4] Au[SO4],oP48,61 Pbca 0.8249,1.0011,0.8549,90,90,90 - red 5.51 X 39485
Au-O-Se Au2Se 4O11 Au2Se4O11,mS68,15 C12/c1 2.0344,0.413,1.3254,90,115.88,90 - yellow 5.87 X 14783
Au-O-Se Au2[SeO3]2O Au2[SeO3]2O,oP22,32 Pba2 0.6592,1.1837,0.3998,90,90,90 - red 7.07 X 16750
Au-O-Se Au2[SeO3]2[SeO4] Au2[SeO3]2[SeO4],oS60,36 Cmc21 1.6891,0.63013,0.8327,90,90,90 - orange 5.93 X 43003
Au-O-Sm AuSm3O6 AuGd3O6,aP10,2 P-1 0.37272,0.56311,0.70734,90.932,102.983,90.822 - yellow 8.54 X 39538
Au-O-Sm Au2Sm4O9 rt Au2La4O9,oP60,60 Pbcn 1.18689,0.6036,1.18469,90,90,90 - yellow 8.92 X 38190
Au-O-Sr SrAu2O4 rt UPd2S4,tI28,88 I41/a 0.6183,0.6183,1.01704,90,90,90 - - 9.32 X 30656
Au-O-Sr Sr5Au2O8 Sr5Au2O8,oF60,22 F222 0.65155,1.17407,1.17449,90,90,90 - yellow 7.10 X 26137
Au-P-Pb Au2PbP 2 Au2PbP 2,oS20,63 Cmcm 0.32373,1.1373,1.1216,90,90,90 - - 10.67 X 40483
Au-P-Pr AuPr2P 3 U2NiC3,oP24,62 Pnma 0.77092,0.41875,1.6056,90,90,90 - - 7.33 X 39464
Au-P-S AuPS4 AuPS4,aP12,2 P-1 0.5891,0.6961,0.8063,78.18,87.59,79.29 - red dark 3.72 X 42353
Au-P-Si AuSiP AuSiP,hR9,160 R3m 0.3458,0.3458,1.7205,90,90,120 - black 7.16 X 33975
Au-P-Sn Au0.64 Sn1.36P 14 (Au0.64 Sn0.36 )SnP14,oP68,62 Pnma 1.2595,0.982,1.0562,90,90,90 - - 3.67 X 40944
Au-P-Sn Au3SnP 7 Au3SnP 7,mP22,11 P121/m1 0.6219,1.0836,0.6318,90,108.65,90 - - 7.63 X 47803
Au-P-Sr SrAuP BeZrSi,hP6,194 P63/mmc 0.4324,0.4324,0.8415,90,90,120 AlB2 family gray 7.69 X 32708
Au-P-Tl Au2 TlP 2 Au2 TlP 2,oS28,63 Cmcm 0.3237,1.135,1.1213,90,90,90 - - 10.65 X 40483
Au-Pb-Pd Au0.5 Pd0.5Pb2 CuAl2,tI12,140 I4/mcm 0.706,0.706,0.58,90,90,90 - - 13.01 A 6743
Au-Pb-Pr AuPrPb CaIn2,hP6,194 P63/mmc 0.4785,0.4785,0.7681,90,90,120 AlB2 family - 11.89 X 21319
Au-Pb-Pr Au2Pr2Pb U2Pt2Sn,tP20,136 P42/mnm 0.80686,0.80686,0.78254,90,90,90 - - 11.51 A 58526
Au-Pb-Rb Rb3AuPb4 K3AuSn4,oP16,59 Pmmn 0.7078,1.322,0.6787,90,90,90 - gray silver 6.71 X 35218
Au-Pb-Sm AuSmPb CaIn2,hP6,194 P63/mmc 0.4742,0.4742,0.7575,90,90,120 AlB2 family - 12.49 X 21319
Au-Pb-Sm Au2Sm2Pb U2Pt2Sn,tP20,136 P42/mnm 0.80125,0.80125,0.762,90,90,90 - - 12.25 A 58526
Au-Pb-Tb AuTbPb MgAgAs,cF12,216 F-43m 0.6747,0.6747,0.6747,90,90,90 - - 12.18 X 21319
Au-Pb-Tb Au2 Tb2Pb U2Pt2Sn,tP20,136 P42/mnm 0.79406,0.79406,0.74538,90,90,90 - - 12.99 A 58526
Au-Pb-Tm Au2 Tm2Pb U2Pt2Sn,tP20,136 P42/mnm 0.78619,0.78619,0.731,90,90,90 - - 13.80 A 58526
Au-Pb-Y AuYPb MgAgAs,cF12,216 F-43m 0.6729,0.6729,0.6729,90,90,90 - - 10.75 X 21319
Au-Pb-Y Au2 Y2Pb U2Pt2Sn,tP20,136 P42/mnm 0.79158,0.79158,0.74358,90,90,90 - - 11.10 X 58526
Au-Pb-Yb Au2 Yb2Pb U2Pt2Sn,tP20,136 P42/mnm 0.8037,0.8037,0.7465,90,90,90 - gray 13.05 X 39613
Au-Pd-Pt Au0.33 Pt0.34Pd0.33 Cu,cF4,225 Fm-3m 0.393,0.393,0.393,90,90,90 close-packed structure - 18.21 X 722
Au-Pd-Sb Au0.25 Pd0.75 Sb2 FeS2 ,cP12,205 Pa-3 0.65,0.65,0.65,90,90,90 pyrite-marcasite family - 9.01 A 3417
Au-Pd-Sn Au0.5 Pd0.5 Sn NiAs,hP4,194 P63/mmc 0.4158,0.4158,0.5571,90,90,120 AlB2 family gray 10.77 X 47585
Au-Pd-Sn Au0.56 Pd0.67 Sn Co1.75 Ge,hP6,194 P63/mmc 0.43,0.43,0.55801,90,90,120 AlB2 family - 11.16 X 59336
Au-Pd-Te Au0.167 Pd0.167 Te0.666 m Po,cP1,221 Pm-3m 0.2885,0.2885,0.2885,90,90,90 - - 9.38 X 6938
Au-Pd-U Au0.6 UPd2.4 Mg3 Cd,hP8,194 P63/mmc 0.5738,0.5738,0.4987,90,90,120 close-packed structure - 14.28 A 30302
Au-Pd-Zn Au0.1 ZnPd0.9 rt CuTi,tP2,123 P4/mmm 0.2876,0.2876,0.3404,90,90,90 b.c.c. family - 10.67 X 9927
Au-Pd-Zn Au0.3 Zn11Pd1.7 Zn9(Zn0.5 Fe0.5)2Fe2,cI52,217 I-43m 0.90953,0.90953,0.90953,90,90,90 γ-brass - 8.47 X 57416
Au-Pd-Zn Au0.5 ZnPd0.5 CsCl,cP2,221 Pm-3m 0.3093,0.3093,0.3093,90,90,90 b.c.c. family - 12.18 X 9927
Au-Pd-Zn Au1.6 Zn44Pd6.4 Zn40.10Pd8.12 Al2.68 ,cF432,216 F-43m 1.81827,1.81827,1.81827,90,90,90 - - 8.56 X 57416
Au-Pr-Sb AuPrSb2 CuHfSi2,tP8,129 P4/nmm 0.43933,0.43933,1.029,90,90,90 - - 9.72 A 28806
Au-Pr-Sb Au1.5 PrSb0.5 Hg2U,hP3,191 P6/mmm 0.47135,0.47135,0.36336,90,90,120 AlB2 family - 11.81 X 48564
Au-Pr-Sb Au3Pr3Sb4 Au3 Y3Sb4,cI40,220 I-43d 1.0013,1.0013,1.0013,90,90,90 - - 9.93 A 25454
Au-Pr-Si Au2PrSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4303,0.4303,1.019,90,90,90 - - 10.40 A 7464
Au-Pr-Sn AuPrSn LiGaGe,hP6,186 P63mc 0.47199,0.47199,0.76192,90,90,120 AlB2 family - 10.32 X 33324
Au-Pr-Sn AuPrSnx ht2 CsCl,cP2,221 Pm-3m 0.3629,0.3629,0.3629,90,90,90 b.c.c. family - 11.74 X 51925
Au-Pr-Sn AuPr5Sn3 CuHf5Sn3,hP18,193 P63/mcm 0.9458,0.9458,0.6779,90,90,120 AlB2 family - 7.95 A 51925
Au-Pr-Sn Au0.32 PrSn2.68 Cu3Au,cP4,221 Pm-3m 0.4686,0.4686,0.4686,90,90,90 close-packed structure - 8.42 X 51925
Au-Pr-Sn Au1.55 PrSn0.45 Hg2U,hP3,191 P6/mmm 0.47257,0.47257,0.35995,90,90,120 AlB2 family - 11.92 X 51925
Au-Pr-Sn Au11 Pr4Sn5 *,hP*,* - 0.9511,0.9511,0.9577,90,90,120 - - - N 51925
Au-Pr-Sn Au12.90 Pr3Sn5.31 Au12.90 Pr3Sn5.31 ,cI208,204 Im-3 1.5155,1.5155,1.5155,90,90,90 - - 13.72 X 51925
Au-Pr-Sn Au3Pr2Sn6 Cu3Nd2Sn6,tI22,107 I4mm 0.4569,0.4569,2.589,90,90,90 - - 9.74 A 51925
Au-Pr-Sn Au3.72 Pr3Sn0.28 Pu3Pd4,hR42,148 R-3 1.3791,1.3791,0.6149,90,90,120 b.c.c. family - 11.69 A 51925
Au-Pr-Sn Au33.88 Pr17Sn2.12 Au36 Nd17,tP106,129 P4/nmm 1.5967,1.5967,0.9366,90,90,90 - - 12.96 A 51925
Au-Pr-Sn Au42.55 Pr14Sn8.45 Ag51 Gd14,hP68,175 P6/m 1.2875,1.2875,0.9368,90,90,120 - - 14.02 A 51925
Au-Pr-Sn Au6Pr3Sn5 Ce3Pd6Sb5,oP28,59 Pmmn 0.4556,1.3548,1.0208,90,90,90 - - 11.59 X 51925
Au-Pr-Zn AuZnPr TiNiSi,oP12,62 Pnma 0.7161,0.4633,0.796,90,90,90 AlB2 family - 10.14 A 56239
Au-Pt-Sn AuPt2Sn4 *,mS*,* - 0.5431,0.5274,0.9313,90,101.17,90 - - - N 38766
Au-Pt-Sn Au0.45 Pt1.68 Sn2.87 Pt2Sn3,hP10,194 P63/mmc 0.4351,0.4351,1.3004,90,90,120 - - 11.79 A 38766
Au-Pt-Sn Au0.8 Pt0.2Sn NiAs,hP4,194 P63/mmc 0.42625,0.42625,0.55375,90,90,120 AlB2 family - 12.02 X 38766
Au-Pt-Sr SrAu0.5 Pt0.5 TlI,oS8,63 Cmcm 0.4262,1.1435,0.4632,90,90,90 CrB(TlI)-FeB black 8.35 X 55366
Au-Pt-Ti Au0.5 Ti3Pt0.5 Cr3Si,cP8,223 Pm-3n 0.5068,0.5068,0.5068,90,90,90 Frank-Kasper phase - 8.67 X 4248
Au-Pt-U AuUPt4 MgCu4Sn,cF24,216 F-43m 0.747,0.747,0.747,90,90,90 Friauf-Laves phase - 19.37 A 21420
Au-Pt-U Au3UPt2 Be5Au,cF24,216 F-43m 0.7592,0.7592,0.7592,90,90,90 Friauf-Laves phase - 18.51 A 21412
Au-Pu-Si Au2PuSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4251,0.4251,1.0195,90,90,90 - - 12.51 X 27417
Au-Rb-S RbAuS KAuS,oS12,63 Cmcm 0.6639,0.8119,0.6596,90,90,90 - colorless 5.88 X 26121
Au-Rb-S Rb4Au6S5 K4Au6S5,hP30,190 P-62c 0.9983,0.9983,0.995,90,90,120 - yellow 6.51 X 31791
Au-Rb-Sb Rb3Au3Sb2 K3Cu3P2,hR24,166 R-3m 0.6443,0.6443,2.169,90,90,120 - gray silver 6.97 X 32479
Au-Rb-Se RbAuSe KAuS,oS12,63 Cmcm 0.6782,0.8332,0.6744,90,90,90 - yellow 6.30 X 32564
Au-Rb-Se RbAu3Se2 CsAu3S2,hP6,164 P-3m1 0.6112,0.6112,0.5224,90,90,120 - yellowish 8.20 X 31788
Au-Rb-Sn RbAu4Sn6 KAu4Sn6,oF88,70 Fddd 0.8759,1.0096,2.4207,90,90,90 - - 9.84 A 50425
Au-Rb-Sn Rb3AuSn4 K3AuSn4,oP16,59 Pmmn 0.7147,1.3081,0.6558,90,90,90 - gray silver 5.03 X 35218
Au-Rb-Sn Rb4Au7Sn2 Rb4Au7Sn2,hR39,166 R-3m 0.6801,0.6801,2.909,90,90,120 - black 8.37 X 14810
Au-Rb-Te RbAuTe hp BeZrSi,hP6,194 P63/mmc 0.46806,0.46806,1.0375,90,90,120 AlB2 family black 6.92 X 28767
Au-Rb-Te RbAuTe rt RbAuTe,oP6,51 Pmma 0.5936,0.5078,0.7205,90,90,90 - red 6.27 X 26121
Au-S-Ta AuTa14S2 AuTa14S2,hR51,148 R-3 0.7459,0.7459,1.8337,90,90,120 - gray silver 15.76 X 29606
Au-S-Ta AuTa5S AuTa5S,cF112,216 F-43m 1.25082,1.25082,1.25082,90,90,90 - - 15.39 X 34836
274 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Au-S-Tl Au4 Tl2S3 *,oP18,47 Pmmm 0.4688,0.7507,1.1919,90,90,90 - - 10.24 N 34204


Au-S-V AuVS2 AuVS2,hP10,194 P63 /mmc 0.3224,0.3224,1.5039,90,90,120 - - 7.66 X 40708
Au-Sb-Sm AuSmSb2 CuHfSi2,tP8,129 P4/nmm 0.43653,0.43653,1.0134,90,90,90 - - 10.16 X 28806
Au-Sb-Sm Au3Sm3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9909,0.9909,0.9909,90,90,90 - - 10.44 A 10372
Au-Sb-Sr SrAuSb BeZrSi,hP6,194 P63 /mmc 0.4672,0.4672,0.8696,90,90,120 AlB2 family - 8.21 X 23592
Au-Sb-Tb Au2 Tb5Sb Mo5SiB2,tI32,140 I4/mcm 0.79753,0.79753,1.32116,90,90,90 - - 10.36 X 48631
Au-Sb-Tb Au3 Tb3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9834,0.9834,0.9834,90,90,90 - - 10.86 A 10372
Au-Sb-Te Au0.125 Sb0.75 Te0.125 hp Po,cP1,221 Pm-3m 0.3018,0.3018,0.3018,90,90,90 - - 7.97 X 17352
Au-Sb-Tl AuTlSb AuTlSb,oP24,33 Pna21 0.65507,1.42871,0.65254,90,90,90 pyrite-marcasite family gray silver 11.38 X 46703
Au-Sb-Tm Au3 Tm3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9752,0.9752,0.9752,90,90,90 - - 11.35 A 10372
Au-Sb-U AuUSb2 CuHfSi2,tP8,129 P4/nmm 0.4375,0.4375,0.9831,90,90,90 - - 11.98 X 51881
Au-Sb-Y Au3 Y3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9818,0.9818,0.9818,90,90,90 - - 9.44 X 10372
Au-Sb-Yb AuYbSb NdPtSb,hP6,186 P63 mc 0.4635,0.4635,0.7765,90,90,120 AlB2 family gray light 11.31 X 23592
Au-Sb-Yb Au3 Yb3Sb4 Au3 Y3Sb4,cI40,220 I-43d 0.9821,0.9821,0.9821,90,90,90 - - 11.20 A 10372
Au-Sc-Si AuScSi AuScSi,hP6,187 P-6m2 0.4212,0.4212,0.6803,90,90,120 AlB2 family - 8.58 X 26155
Au-Sc-Sn AuScSn cub MgAgAs,cF12,216 F-43m 0.64194,0.64194,0.64194,90,90,90 - gray silver 9.05 X 47516
Au-Sc-Sn AuScSn hex LiGaGe,hP6,186 P63 mc 0.4593,0.4593,0.7202,90,90,120 AlB2 family - 9.10 X 49619
Au-Sc-Sn Au2Sc2Sn U2Pt2Sn,tP20,136 P42 /mnm 0.75282,0.75282,0.70237,90,90,90 - gray silver 10.05 A 31700
Au-Sc-Te Au0.89 Sc6Te 2 Sc6PdTe2,oP36,62 Pnma 2.0191,0.39199,1.07452,90,90,90 - - 5.47 X 58293
Au-Se-Te AuTe1.7 Se 0.3 AuTe2,mS6,12 C12/m1 0.717,0.4385,0.5014,90,90.,90 - - 9.22 A 4006
Au-Se-Te Au2 TeSe *,oP16,* - 0.5741,0.756,0.8924,90,90,90 - - 10.30 N 4006
Au-Se-Tl AuTl4Se3 In5Bi3,tI32,140 I4/mcm 0.8697,0.8697,1.2535,90,90,90 - - 8.77 A 25681
Au-Si-Sm Au2SmSi2 CeAl2Ga2,tI10,139 I4/mmm 0.426,0.426,1.017,90,90,90 - - 10.81 X 7464
Au-Si-Sr SrAu2Si2 CeAl2Ga2,tI10,139 I4/mmm 0.437,0.437,1.014,90,90,90 - - 9.22 X 10313
Au-Si-Tb Au2 TbSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4214,0.4214,1.0141,90,90,90 - - 11.23 X 26251
Au-Si-Th AuThSi LiBaSi,hP3,187 P-6m2 0.426,0.426,0.4164,90,90,120 AlB2 family - 11.60 X 28773
Au-Si-Th Au0.5 ThSi1.5 ThSi2,tI12,141 I41/amd 0.41972,0.41972,1.4303,90,90,90 - - 9.82 A 28773
Au-Si-Th Au0.9 ThSi1.1 AlB2,hP3,191 P6/mmm 0.4259,0.4259,0.4173,90,90,120 AlB2 family - 11.15 X 28773
Au-Si-Th Au2 ThSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4295,0.4295,1.0347,90,90,90 - - 11.87 X 10747
Au-Si-U AuUSi LiBaSi,hP3,187 P-6m2 0.4195,0.4195,0.3972,90,90,120 AlB2 family gray faint 12.70 X 31884
Au-Si-U Au0.5 USi1.5 AlB2,hP3,191 P6/mmm 0.4145,0.4145,0.3989,90,90,120 AlB2 family - 10.59 X 27456
Au-Si-U Au2USi2 CeAl2Ga2,tI10,139 I4/mmm 0.4229,0.4229,1.025,90,90,90 - - 12.47 X 10747
Au-Si-Y AuYSi LiGaGe,hP6,186 P63 mc 0.4288,0.4288,0.7546,90,90,120 AlB2 family - 8.68 X 26155
Au-Si-Y Au2 YSi2 CeAl2Ga2,tI10,139 I4/mmm 0.423,0.423,1.018,90,90,90 - - 9.83 A 9139
Au-Si-Yb AuYbSi ht AuEuGe,oI12,44 Imm2 0.4397,0.7023,0.7572,90,90,90 - - 11.31 X 36681
Au-Si-Yb AuYbSi rt Sr(Ag0.5 Ge0.5)2,mS30,12 C12/m1 1.0385,0.4364,1.3198,90,98.71,90 - - 11.18 A 36681
Au-Si-Yb Au0.63 YbSi1.37 AlB2,hP3,191 P6/mmm 0.4163,0.4163,0.4009,90,90,120 AlB2 family - 9.26 X 36681
Au-Si-Yb Au1.25 YbSi0.75 KHg2,oI12,74 Imma 0.4431,0.7018,0.7631,90,90,90 AlB2 family - 12.33 X 36681
Au-Si-Yb Au2 YbSi2 CeAl2Ga2,tI10,139 I4/mmm 0.4287,0.4287,1.005,90,90,90 - - 11.20 X 12456
Au-Sm-Sn AuSmSn cub MgAgAs,cF12,216 F-43m 0.6829,0.6829,0.6829,90,90,90 - - 9.72 X 49619
Au-Sm-Sn AuSmSn hex NdPtSb,hP6,186 P63 mc 0.4673,0.4673,0.7489,90,90,120 AlB2 family gray silver 10.93 X 47761
Au-Sm-Zn Au0.93 Zn1.07 Sm TiNiSi,oP12,62 Pnma 0.7048,0.4554,0.7828,90,90,90 AlB2 family - 10.67 X 56239
Au-Sn-Sr SrAuSn AuYbGe,oP36,62 Pnma 2.3414,0.4818,0.8267,90,90,90 - - 8.62 X 40784
Au-Sn-Sr SrAuSn2 CeNiSi2,oS16,63 Cmcm 0.4602,2.0388,0.4603,90,90,90 - gray silver 8.03 X 44099
Au-Sn-Sr SrAu1.4 Sn2.6 CeAl2Ga2,tI10,139 I4/mmm 0.46447,0.46447,1.1403,90,90,90 - - 9.07 X 49008
Au-Sn-Tb AuTbSn LiGaGe,hP6,186 P63 mc 0.46556,0.46556,0.74027,90,90,120 AlB2 family - 11.34 X 33324
Au-Sn-Tb Au2 Tb2Sn Mo2FeB2,tP10,127 P4/mbm 0.7829,0.7829,0.3775,90,90,90 - gray light 11.92 A 29709
Au-Sn-Ti AuTi5Sn3 CuHf5Sn3,hP18,193 P63 /mcm 0.8224,0.8224,0.5654,90,90,120 AlB2 family - 7.95 A 37362
Au-Sn-Tm AuTmSn cub MgAgAs,cF12,216 F-43m 0.65854,0.65854,0.65854,90,90,90 - gray silver 11.27 X 47761
Au-Sn-Tm AuTmSn hex LiGaGe,hP6,186 P63 mc 0.4691,0.4691,0.734,90,90,120 AlB2 family - 11.51 X 49619
Au-Sn-Tm Au2 Tm2Sn U2Pt2Sn,tP20,136 P42 /mnm 0.776,0.776,0.738,90,90,90 - gray light 12.71 A 29701
Au-Sn-U AuUSn CaIn2,hP6,194 P63 /mmc 0.47116,0.47116,0.72035,90,90,120 AlB2 family - 13.28 X 27967
Au-Sn-U Au0.7 USn2.3 Cu3Au,cP4,221 Pm-3m 0.4561,0.4561,0.4561,90,90,90 close-packed structure - 11.36 X 37363
Au-Sn-U Au2USn ht Cu2MnAl,cF16,225 Fm-3m 0.7002,0.7002,0.7002,90,90,90 b.c.c. family - 14.52 X 30419
Au-Sn-U Au2USn rt LiCu2Sn,hP8,194 P63 /mmc 0.4719,0.4719,0.9202,90,90,120 - - 14.05 A 37363
Au-Sn-U Au3U3Sn4 Au3 Y3Sb4,cI40,220 I-43d 0.9819,0.9819,0.9819,90,90,90 - - 12.49 A 37363
Au-Sn-U Au4U3Sn2 *,hP*,* - 0.8241,0.8241,0.9462,90,90,120 - - - N 37363
Au-Sn-Y AuYSn NdPtSb,hP6,186 P63 mc 0.46355,0.46355,0.73726,90,90,120 AlB2 family gray silver 9.79 X 47516
Au-Sn-Y Au2 Y2Sn U2Pt2Sn,tP20,136 P42 /mnm 0.7814,0.7814,0.7535,90,90,90 - gray light 9.97 A 29701
Au-Sn-Yb AuYbSn orth1 TiNiSi,oP12,62 Pnma 0.7303,0.47082,0.8123,90,90,90 AlB2 family - 11.62 A 36472
Au-Sn-Yb AuYbSn orth2 AuYbSn,oI36,44 Imm2 0.4697,2.1912,0.8127,90,90,90 - - 11.64 X 38551
Au-Sn-Yb Au3 Yb2Sn2 Au3 Yb2Sn2,hR42,166 R-3m 0.47684,0.47684,4.6898,90,90,120 - gray light 12.67 X 55558
Au-Tb-Te Au2 Tb7 Te 2 Au2Er7Te2 ,mS44,12 C12/m1 1.8215,0.40279,1.7164,90,104.37,90 - - 9.59 A 58293
Au-Tb-Zn AuZnTb TiNiSi,oP12,62 Pnma 0.6884,0.4556,0.7851,90,90,90 AlB2 family - 11.36 A 56239
Au-Te-Y AuY6 Te2 Sc6PdTe2,oP36,62 Pnma 2.1634,0.40931,1.1507,90,90,90 - - 6.43 A 58293
Au-Te-Y Au2 Y5 Te2 Tm5Sb2Si2 ,oS36,64 Cmce 1.5307,0.79179,0.7906,90,90,90 - - 7.58 A 56271
Au-Te-Y Au2 Y7 Te2 Er7Ni2Te2 ,oI22,44 Imm2 0.4041,1.553,0.9687,90,90,90 - - 6.95 A 53504
Au-Ti-Zr Au0.81 ZrTi1.19 MgZn2,hP12,194 P63 /mmc 0.5413,0.5413,0.8778,90,90,120 Friauf-Laves phase - 9.18 A 26054
Au-Tm-Zn AuZnTm ZrNiAl,hP9,189 P-62m 0.7366,0.7366,0.3807,90,90,120 Fe2P family - 12.01 A 56239
Au-Y-Zn Au1.25 Zn0.75 Y ZrNiAl,hP9,189 P-62m 0.74299,0.74299,0.3853,90,90,120 Fe2P family - 10.39 X 56239
Au-Yb-Zn AuZnYb TiNiSi,oP12,62 Pnma 0.7135,0.4456,0.7898,90,90,90 AlB2 family - 11.52 X 49356
B-Ba-F Ba[BF4 ]2 mon1 Ba[BF4 ]2,mS22,12 C12/m1 1.2513,0.50135,0.47628,90,111.854,90 - - 3.72 X 47867
B-Ba-F Ba[BF4 ]2 mon2 BaB2[OH]8,mP88,14 P121/c1 0.8339,1.653,1.11827,90,118.96,90 - colorless 3.06 X 34688
B-Ba-H H12BaB12 H12SrB12,hP26,159 P31c 0.72599,0.72599,1.1716,90,90,120 - - 1.73 X 58496
B-Ba-Ir BaIr2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3935,0.3935,1.1407,90,90,90 - gray 10.22 A 12862
B-Ba-Ir Ba7Ir12B12 Ba7Ir12B12 ,hR93,166 R-3m 1.5222,1.5222,0.8358,90,90,120 - black 10.09 X 12862
B-Ba-N Ba3B2N4 Ba3B2N4,oP36,19 P212121 0.42473,1.1056,1.47572,90,90,90 - yellow 4.69 X 41726
B-Ba-N Ba4.5 B3N6 Sr4.5 B3N6,cI28,229 Im-3m 0.80044,0.80044,0.80044,90,90,90 - - 4.76 X 41726
Handbook of Inorganic Substances – Edition 2015 : Data 275

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Ba-Na Na0.43 Ba0.57 B6 CaB6,cP7,221 Pm-3m 0.4232,0.4232,0.4232,90,90,90 - - 3.35 A 583


B-Ba-Ni BaNi12B6 SrNi12B6,hR57,166 R-3m 0.9689,0.9689,0.747,90,90,120 - gray 7.44 X 13817
B-Ba-Ni BaNi2B2 *,o*20,* - 0.3929,0.7586,1.0917,90,90,90 - - - N 13817
B-Ba-Ni Ba2Ni9B6 rt Ba2Ni9B6,hR102,167 R-3c 1.0029,1.0029,1.4533,90,90,120 - - 6.83 X 13820
B-Ba-O BaB2O4 ht BaB2O4,hR126,167 R-3c 0.7235,0.7235,3.9192,90,90,120 - - 3.75 X 2913
B-Ba-O BaB2O4 rt BaB2O4,hR126,161 R3c 1.2531,1.2531,1.2721,90,90,120 - colorless 3.85 X 45938
B-Ba-O BaB4O7 mon BaB4O7,mP96,14 P121/c1 1.05724,0.81981,1.30314,90,104.924,90 - - 3.56 X 58132
B-Ba-O BaB4O7 orth KP 4 N7,oP48,62 Pnma 0.9017,1.0994,0.43073,90,90,90 - colorless 4.55 X 53360
B-Ba-O BaB8O13 BaB8O13,tP88,91 P4122 0.856,0.856,1.32,90,90,90 - - 2.97 X 4400
B-Ba-O Ba2B2O5 rt *,mP171,* - 1.1014,1.2684,1.6856,90,99.82,90 - - 5.12 N 4818
B-Ba-O Ba5B2[BO3]2O5 Ba5B2[BO3]2O5,oP240,19 P212121 0.959,1.6659,2.2919,90,90,90 - colorless 4.93 X 46279
B-Ba-Pd BaPd4B SrPd4B,oP24,62 Pnma 0.60883,0.56066,1.2005,90,90,90 - - 9.30 X 55527
B-Ba-Pt Ba0.67Pt3B2 Ba0.67Pt3B2,hP12,194 P63/mmc 0.6161,0.6161,0.5268,90,90,120 - - 13.40 X 11636
B-Ba-Rh BaRh2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3915,0.3915,1.125,90,90,90 - black 7.03 X 12862
B-Ba-S BaB2S4 BaB2S4,mS28,9 C1c1 0.66465,1.5699,0.60306,90,110.96,90 - colorless 3.25 X 40928
B-Ba-S Ba7B4S13 (Ba0.4 Sr0.6)7B4S13,mS96,15 C12/c1 1.0175,2.397,1.01692,90,90.095,90 - yellowish 3.81 X 42969
B-Ba-Se BaB2Se6 BaB2Se6,oS36,64 Cmce 1.1326,0.7659,1.0315,90,90,90 - yellow 4.70 X 40866
B-Ba-Se Ba2B4Se13 Ba2B4Se13,mP76,14 P121/c1 1.279,1.156,1.2862,90,103.22,90 - red dark 4.82 X 40866
B-Ba-Se Ba7B4Se13 Ba7B4Se13,mS100,15 C12/c1 1.0513,2.5021,1.0513,90,90.1,90 - colorless 4.88 X 39431
B-Ba-Sr Ba0.64 Sr0.36 B6 CaB6,cP7,221 Pm-3m 0.4217,0.4217,0.4217,90,90,90 - - 4.08 A 3561
B-Ba-Y Ba0.05 Y0.95 B6 CaB6,cP7,221 Pm-3m 0.41086,0.41086,0.41086,90,90,90 - - 3.74 A 12458
B-Be-C BeB2C2 BeB2C2,oP20,59 Pmmn 0.5422,0.61343,0.46928,90,90,90 - - 2.33 X 49780
B-Be-H Be[BH4]2 Be[BH4]2,tI48,110 I41cd 1.362,1.362,0.91,90,90,90 - - 0.61 X 6668
B-Be-H H10BeB5[BH4] lt H10BeB5[BH4],mP28,14 P121/c1 0.8604,0.8337,1.27012,90,124.029,90 - - 0.77 X 11494
B-Be-H H16BeB6 H16BeB6,mP28,14 P121/c1 1.0503,0.7641,1.12264,90,116.822,90 - colorless 0.74 X 9884
B-Be-Hf Be0.3 HfB1.7 AlB2 ,hP3,191 P6/mmm 0.329,0.329,0.345,90,90,120 AlB2 family - 10.25 X 1481
B-Be-Ni Be1.85 Ni0.65 B0.5 MgCu2,cF24,227 Fd-3m 0.5767,0.5767,0.5767,90,90,90 Friauf-Laves phase - 4.17 X 3273
B-Be-Ta BeTaB AlB2 ,hP3,191 P6/mmm 0.3239,0.3239,0.3253,90,90,120 AlB2 family - 11.28 X 9440
B-Be-Ti Be0.76 TiB1.24 AlB2 ,hP3,191 P6/mmm 0.3159,0.3159,0.3231,90,90,120 AlB2 family - 4.05 X 9440
B-Be-Zr Be0.96 ZrB1.04 AlB2 ,hP3,191 P6/mmm 0.3331,0.3331,0.3505,90,90,120 AlB2 family - 5.48 X 9440
B-Bi-Ni Ni20.56 Bi2.44 B6 Cr23 C6,cF116,225 Fm-3m 1.0575,1.0575,1.0575,90,90,90 - gray 10.01 X 55678
B-Bi-O BiB3O6 mon1 BiB3 O6,mS20,5 C121 0.713,0.4999,0.651,90,105.53,90 - - 5.01 X 49684
B-Bi-O BiB3O6 mon2 BiB3 O6-a,mP40,14 P121/c1 0.4429,0.67514,1.39264,90,95.991,90 - white 5.41 X 44733
B-Bi-O BiB3O6 mon3 BiB3 O6-b,mP40,14 P121/c1 0.42596,1.17093,0.72757,90,91.069,90 - white 6.18 X 44733
B-Bi-O BiB3O6 orth CeB3O6,oP40,29 Pca21 1.8448,0.44495,0.42806,90,90,90 - colorless 6.38 X 45910
B-Bi-O BiB3O6 tricl BiB3 O6,aP10,1 P1 0.3934,0.42017,0.62321,76.728,86.27,62.849 - - 6.29 X 51858
B-Bi-O Bi[BO3] m1 Bi[BO3],mP20,14 P121/c1 0.6585,0.5027,0.8349,90,108.91,90 - colorless 6.80 X 44105
B-Bi-O Bi[BO3] m2 Bi[BO3],mP10,7 P1c1 0.41181,0.49774,0.6714,90,111.763,90 - - 6.96 X 45785
B-Bi-O Bi12.25 B0.5 O19.125 Ga0.5 Bi12.5 O19.5 ,cI74,197 I23 1.0123,1.0123,1.0123,90,90,90 - yellowish 9.19 X 39969
B-Bi-O Bi2B8O15 ht Bi2B8O15,mP50,4 P1211 0.43191,2.2175,0.64739,90,105.44,90 - colorless 4.14 X 46294
B-Bi-O Bi2B8O15 rt Bi2B8O15,aP50,2 P-1 0.43159,0.64604,2.2485,87.094,86.538,74.42 - - 4.10 X 55017
B-Bi-O Bi3B5O12 Bi3B5O12,oP80,62 Pnma 0.653,0.7726,1.8578,90,90,90 - - 6.19 X 43535
B-Bi-O Bi4[BO3]2O3 Bi4[BO3]2O3,mP60,14 P121/c1 1.1112,0.6625,1.1042,90,91.04,90 - - 8.19 X 49436
B-Br-Ce Ce4B4Br5 La4B4Br5,mS52,12 C12/m1 1.8062,0.4283,1.9073,90,117.865,90 - green blue 5.11 A 33371
B-Br-Cs CsB6Br6 rt CsB6Cl6,hR156,148 R-3 0.99792,0.99792,4.7664,90,90,120 - - 3.28 X 43939
B-Br-Gd Gd10 B2Br15 La10 Os2I15,aP27,2 P-1 0.8984,0.9816,1.0552,91.14,114.61,110.94 - black 5.99 X 38186
B-Br-Gd Gd13 B3Br18 Tb13 B3Br18,oI82,71 Immm 0.39923,1.70462,2.83039,90,90,90 - golden 6.06 X 39718
B-Br-Gd Gd3 BBr3 Ca3PI3,cI56,214 I4132 1.1275,1.1275,1.1275,90,90,90 - - 6.69 A 39490
B-Br-H H13B10Br H13B10Cl,mP44,14 P121/c1 1.2391,0.77367,1.1203,90,114.947,90 - - 1.37 X 50475
B-Br-H H6B5Br H6B5Br,mP48,14 P121/c1 1.3323,0.7416,1.18875,90,111.464,90 - colorless 1.70 X 11505
B-Br-La La2B3Br La2B3Cl,hP24,174 P-6 0.7834,0.7834,0.844,90,90,120 - black 5.78 X 49566
B-Br-La La4B4Br5 La4B4Br5,mS52,12 C12/m1 1.82559,0.42942,1.9253,90,118.07,90 - green blue 4.98 X 33371
B-Br-P BPBr6 BPBr6,oP32,62 Pnma 1.2195,1.1054,0.7053,90,90,90 - colorless 3.64 X 37104
B-Br-Pr Pr3BBr3 Ca3PI3,cI56,214 I4132 1.161,1.161,1.161,90,90,90 - - 5.72 A 39490
B-Br-Pr Pr4B4Br5 La4B4I5,mS28,12 C12/m1 1.7907,0.4273,0.96,90,111.87,90 - green blue 4.90 A 33371
B-Br-S BSBr BSBr-b,mP36,14 P121/c1 1.406,0.414,1.788,90,115.5,90 - - 2.60 X 8681
B-Br-Tb Tb10 B2Br15 La10 Os2I15,aP27,2 P-1 0.8939,0.9788,1.0502,91.19,114.51,111.1 - black 6.10 X 38186
B-Br-Tb Tb13 B3Br18 Tb13 B3Br18,oI82,71 Immm 0.39637,1.69063,2.81068,90,90,90 - golden 6.24 X 42411
B-Br-Tb Tb16 B4Br23 Tb16 B4Br23,mS86,12 C12/m1 1.7523,1.2008,1.1901,90,103.95,90 - golden 6.05 X 39513
B-Br-Tb Tb3BBr3 Ca3PI3,cI56,214 I4132 1.1196,1.1196,1.1196,90,90,90 - - 6.88 A 39490
B-Br-Tb Tb4BBr6 Y4BBr6,mS88,15 C12/c1 1.7825,1.11644,1.2541,90,97.92,90 - black 6.05 X 38297
B-Br-Y Y3BBr3 Ca3PI3,cI56,214 I4132 1.1141,1.1141,1.1141,90,90,90 - - 4.97 A 39490
B-Br-Y Y4BBr6 Y4BBr6,mS88,15 C12/c1 1.772,1.1113,1.2486,90,97.56,90 - black 4.61 X 33946
B-Br-Zr Zr6BBr12 *,hR*,148 R-3 1.3633,1.3633,0.9307,90,90,120 - - - N 22583
B-C-Ca CaB2C2 CaB2C2,tI20,140 I4/mcm 0.53733,0.53733,0.74155,90,90,90 - brown 2.66 X 35777
B-C-Ca Ca0.24 B0.5C1.5 AlB2 ,hP3,191 P6/mmm 0.25839,0.25839,0.4436,90,90,120 AlB2 family - 2.14 X 55447
B-C-Ca Ca0.92 B2C4 LiC6 ,hP7,191 P6/mmm 0.45597,0.45597,0.4402,90,90,120 GIC black 2.23 X 55447
B-C-Ce CeBC LaBC,oP60,19 P212121 0.85021,0.85217,1.23834,90,90,90 - - 6.03 X 53366
B-C-Ce CeB2C ThB2C,hR36,166 R-3m 0.66138,0.66138,1.12594,90,90,120 - - 6.09 X 23490
B-C-Ce CeB2C2 CeB2C2,tP10,127 P4/mbm 0.53903,0.53903,0.386,90,90,90 - - 5.50 X 39239
B-C-Ce Ce10 B9C12 Ce10 B9C12,tP124,92 P41212 0.84785,0.84785,2.535,90,90,90 - black 5.99 X 32599
B-C-Ce Ce5B2C6 Ce5B2C6,tP64,75 P4 0.83654,0.83654,1.25217,90,90,90 - - 6.02 A 38795
B-C-Ce Ce5B2C6.2 La5(B0.7 C0.3)3.6 C3.8 ,tP56,130 P4/ncc 0.8356,0.8356,1.2518,90,90,90 - - 6.05 X 44100
B-C-Ce Ce5B4C5 Ce5B4C5,oP112,33 Pna21 2.4426,0.84636,0.85007,90,90,90 - black 6.08 X 32597
B-C-Co Co22 B4C2 Cr23 C6,cF116,225 Fm-3m 1.047,1.047,1.047,90,90,90 - - 7.89 A 5972
B-C-Cr Cr23 B1.2 C4.8 Cr23 C6,cF116,225 Fm-3m 1.0688,1.0688,1.0688,90,90,90 - - 6.89 A 11125
B-C-Cr Cr3B0.44 C1.41 m Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.2857,0.9233,0.6967,90,90,90 - gray 6.42 X 15719
B-C-Dy DyBC YBC,oS12,65 Cmmm 0.3384,1.3727,0.3647,90,90,90 - - 7.27 X 6575
276 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-C-Dy DyB2C orth DyB2C,oP16,55 Pbam 0.67776,0.67893,0.37254,90,90,90 - - 7.60 X 57366


B-C-Dy DyB2C tet YB2C,tP32,135 P42 /mbc 0.68,0.68,0.7445,90,90,90 - - 7.57 X 6575
B-C-Dy DyB2C2 rt CeB2C2,tP10,127 P4/mbm 0.53437,0.53437,0.35572,90,90,90 - - 6.81 X 39239
B-C-Dy Dy15B4C14 Tb15B4C14 ,tP70,128 P4/mnc 0.80882,0.80882,1.58846,90,90,90 - - 8.47 X 54963
B-C-Dy Dy2B4C Dy2B4C,oI14,71 Immm 0.32772,0.6567,0.7542,90,90,90 - - 7.78 X 49080
B-C-Dy Dy5B2C5 Sm5B2C5,tP48,130 P4/ncc 0.8071,0.8071,1.0826,90,90,90 - - 8.42 X 44100
B-C-Dy Dy5B2C6 Ce5B2C6,tP64,75 P4 0.80512,0.80512,1.1499,90,90,90 - - 8.08 A 38795
B-C-Er ErB2C orth DyB2C,oP16,55 Pbam 0.67515,0.67807,0.36585,90,90,90 - - 7.97 A 58915
B-C-Er ErB2C tet YB2C,tP32,135 P42 /mbc 0.6753,0.6753,0.7321,90,90,90 - - 7.99 X 9122
B-C-Er ErB2C2 CeB2C2,tP10,127 P4/mbm 0.53329,0.53329,0.35065,90,90,90 - - 7.09 X 39239
B-C-Er ErB28.5 C4 YB28.5 C4,hR207,166 R-3m 0.564,0.564,5.6868,90,90,120 - - 3.33 A 43516
B-C-Er Er15B4C14 Tb15B4C14 ,tP70,128 P4/mnc 0.7932,0.7932,1.5685,90,90,90 - - 9.16 X 54963
B-C-Er Er2B4C Dy2B4C,oI14,71 Immm 0.32528,0.65462,0.74048,90,90,90 - - 8.21 A 49080
B-C-Er Er5B2C5 Sm5B2C5,tP48,130 P4/ncc 0.79892,0.79892,1.074,90,90,90 - - 8.89 A 37696
B-C-Er Er5B2C6 Ce5B2C6,tP64,75 P4 0.7948,0.7948,1.13,90,90,90 - - 8.65 A 38795
B-C-Eu EuB2C2 *,tP5,* - 0.377,0.377,0.403,90,90,90 - - - N 4755
B-C-Eu EuB5.95 C0.05 CaB6,cP7,221 Pm-3m 0.41801,0.41801,0.41801,90,90,90 - - 4.93 X 14625
B-C-Fe Fe23B2.4 C3.6 Cr23C6,cF116,225 Fm-3m 1.06,1.06,1.06,90,90,90 - - 7.55 A 10843
B-C-Fe Fe3B0.6 C0.4 m Fe3C-b,oP16,62 Pnma 0.533,0.666,0.447,90,90,90 - - 7.49 A 20126
B-C-Gd GdBC YBC,oS12,65 Cmmm 0.3456,1.3796,0.3697,90,90,90 - - 6.79 A 6575
B-C-Gd GdB2C2 YB2C2,tP10,131 P42 /mmc 0.3787,0.3787,0.7278,90,90,90 - - 6.46 A 28658
B-C-Gd Gd10B9.2 C9.8 Tb10B9.2 C9.8 ,mP120,14 P121/c1 0.8023,2.3954,1.1317,90,133.72,90 - - 7.56 A 55438
B-C-Gd Gd15B4C14 Tb15B4C14 ,tP70,128 P4/mnc 0.82103,0.82103,1.6096,90,90,90 - - 7.87 A 54963
B-C-Gd Gd2B3C2 Gd2B3C2,oS14,65 Cmmm 0.3445,1.3733,0.37107,90,90,90 - - 7.02 X 28658
B-C-Gd Gd4B3C4 Gd4B3C4,aP11,2 P-1 0.3637,0.3674,1.1859,93.34,96.77,90.24 - - 7.50 X 37229
B-C-Gd Gd5B2C5 Sm5B2C5,tP48,130 P4/ncc 0.82455,0.82455,1.0855,90,90,90 - - 7.81 X 37696
B-C-Gd Gd5B2C6 Ce5B2C6,tP64,75 P4 0.81493,0.81493,1.1799,90,90,90 - - 7.46 A 38795
B-C-Hf HfB0.06 C0.97 *,cF*,* - 0.464,0.464,0.464,90,90,90 rocksalt family - - N 10682
B-C-Ho HoBC ht YBC,oS12,65 Cmmm 0.3384,1.3697,0.3594,90,90,90 - - 7.49 A 18104
B-C-Ho HoBC rt *,t**,* - 0.3546,0.3546,4.64,90,90,90 - - - N 18104
B-C-Ho HoB2C YB2C,tP32,135 P42 /mbc 0.6778,0.6778,0.7389,90,90,90 - - 7.77 X 9122
B-C-Ho HoB2C2 CeB2C2,tP10,127 P4/mbm 0.53414,0.53414,0.35361,90,90,90 - - 6.93 X 39239
B-C-Ho HoB28.5 C4 YB28.5 C4,hR207,166 R-3m 0.5638,0.5638,5.6881,90,90,120 - - 3.32 A 43516
B-C-Ho Ho15B2C17 Sc15C19,tP68,114 P-42 1c 0.8004,0.8004,1.5857,90,90,90 - - 8.83 A 18104
B-C-Ho Ho15B4C14 Tb15B4C14 ,tP70,128 P4/mnc 0.7998,0.7998,1.5854,90,90,90 - - 8.79 A 54963
B-C-Ho Ho2BC3 ht *,tI*,* - 0.3561,0.3561,1.2455,90,90,90 - - - N 18104
B-C-Ho Ho2BC3 rt *,tP*,* - 0.3567,0.3567,2.4514,90,90,90 - - - N 18104
B-C-Ho Ho2B4C Dy2B4C,oI14,71 Immm 0.3266,0.6551,0.7462,90,90,90 - - 8.01 A 49080
B-C-Ho Ho5B2C5 Sm5B2C5,tP48,130 P4/ncc 0.8051,0.8051,1.065,90,90,90 - - 8.72 X 44100
B-C-Ho Ho5B2C6 Ho5B2C6,tP52,130 P4/ncc 0.799,0.799,1.1396,90,90,90 - - 8.38 X 44100
B-C-K KB5C CaB6,cP7,221 Pm-3m 0.41281,0.41281,0.41281,90,90,90 - - 2.48 X 35654
B-C-La LaBC LaBC,oP60,19 P212121 0.8646,0.8691,1.2479,90,90,90 - black 5.73 X 45636
B-C-La LaB2C2 CeB2C2,tP10,127 P4/mbm 0.5402,0.5402,0.39587,90,90,90 - - 5.31 X 39239
B-C-La La10B9C12 Ce10B9C12 ,tP124,92 P41212 0.86447,0.86447,2.5787,90,90,90 - black 5.62 X 44061
B-C-La La15B14C19 La15B14C19 ,mP96,14 P121/c1 0.8671,0.8656,1.9953,90,94.45,90 - black 5.48 X 32598
B-C-La La5B2C6 La5B2C6,tP76,75 P4 0.8585,0.8585,1.2313,90,90,90 - - 5.77 X 16178
B-C-La La5B2C6.25 La5(B0.7 C0.3)3.6 C3.8 ,tP56,130 P4/ncc 0.859,0.859,1.2398,90,90,90 - gray 5.74 X 39555
B-C-La La5B2.1 C5.1 La5(B0.52 C0.48)4C3.2,tP52,130 P4/ncc 0.85571,0.85571,1.24129,90,90,90 - - 5.69 X 45724
B-C-La La5B4C4.85 Ce5B4C5,oP112,33 Pna21 2.4657,0.86051,0.8654,90,90,90 - black 5.76 X 42487
B-C-Li LiBC BeZrSi,hP6,194 P63 /mmc 0.2749,0.2749,0.7053,90,90,120 AlB2 family golden 2.14 X 59561
B-C-Li LiB13C2 LiB13C2,oI64,74 Imma 0.5668,1.082,0.804,90,90,90 - colorless 2.31 X 45893
B-C-Li LiB6C LiB6C,oS32,38 Amm2 0.4706,0.901,0.5652,90,90,90 - greenish 2.32 X 45893
B-C-Lu LuB2C orth DyB2C,oP16,55 Pbam 0.67429,0.67341,0.3589,90,90,90 - - 8.50 X 58915
B-C-Lu LuB2C tet YB2C,tP32,135 P42 /mbc 0.67546,0.67546,0.71781,90,90,90 - - 8.46 X 15283
B-C-Lu LuB2C2 CeB2C2,tP10,127 P4/mbm 0.53212,0.53212,0.34471,90,90,90 - - 7.51 X 39239
B-C-Lu Lu15B4C14 Tb15B4C14 ,tP70,128 P4/mnc 0.78225,0.78225,1.5603,90,90,90 - - 9.86 A 54963
B-C-Lu Lu3BC3 Lu3BC3,oS28,63 Cmcm 0.4978,0.501,1.567,90,90,90 - gray silver 9.72 X 39444
B-C-Mg MgB12C2 mon MgB12C2,mS64,15 C12/c1 0.72736,0.87768,0.72817,90,105.33,90 - brown gray 2.64 X 48136
B-C-Mg MgB12C2 orth ScB12(B0.5 C0.5 )2,oI60,74 Imma 0.56133,0.9828,0.79329,90,90,90 - black 2.70 X 48136
B-C-Mg MgB2C2 hp MgB2C2,oP10,58 Pnnm 0.46179,0.71963,0.27771,90,90,90 - gray 2.52 X 55487
B-C-Mg MgB2C2 MgB2C2,oS80,64 Cmce 1.0922,0.9461,0.7459,90,90,90 AlB2 family red dark 2.41 X 28841
B-C-Mg Mg0.92 B1.792 C0.208 AlB2,hP3,191 P6/mmm 0.30517,0.30517,0.35205,90,90,120 AlB2 family black 2.59 X 45453
B-C-Mg Mg1.2 B25C4 rt Mg1.2 B25C4,mS66,12 C12/m1 0.8908,0.56623,0.9605,90,105.6,90 - black 2.47 X 54436
B-C-Mg Mg2B24C Mg2B24C,tP54,118 P-4n2 0.89391,0.89391,0.50745,90,90,90 - black 2.62 X 46999
B-C-Mn Mn23B1.2 C4.8 rt Cr23C6,cF116,225 Fm-3m 1.0635,1.0635,1.0635,90,90,90 - - 7.37 A 11125
B-C-Mo Mo2BC Mo2BC,oS16,63 Cmcm 0.3086,1.735,0.3047,90,90,90 - - 8.74 X 4436
B-C-N BCN *,t**,* - 1.6204,1.6204,1.781,90,90,90 - - - N 47260
B-C-N B0.86 C0.41 N0.73 ht-hp ZnS,cF8,216 F-43m 0.36443,0.36443,0.36443,90,90,90 adamantane structure yellow 3.35 X 50493
B-C-N B3C10N3 B3C10N3,oP32,51 Pmma 0.661,0.4977,0.8509,90,90,90 - - 2.31 X 50077
B-C-Na NaB5C CaB6,cP7,221 Pm-3m 0.40925,0.40925,0.40925,90,90,90 - black 2.16 X 34206
B-C-Nb NbB0.14 C0.93 *,cF*,* - 0.44736,0.44736,0.44736,90,90,90 rocksalt family - - N 10678
B-C-Nb Nb0.78 B1.97 C0.03 AlB2,hP3,191 P6/mmm 0.30894,0.30894,0.33129,90,90,120 AlB2 family - 5.71 X 44182
B-C-Nb Nb3B3C Nb3B3C,oS28,63 Cmcm 0.32647,2.871,0.31285,90,90,90 - - 7.32 X 38350
B-C-Nb Nb4B3C2 Nb4B3C2,oS36,63 Cmcm 0.32287,3.7544,0.31331,90,90,90 - - 7.49 X 38350
B-C-Nb Nb7B4C4 Nb7B4C4,oI30,71 Immm 0.31541,0.32166,3.226,90,90,90 - - 7.53 X 38350
B-C-Nb Nb7B6C3 Nb7B6C3,oS32,65 Cmmm 0.31341,3.3161,0.32428,90,90,90 - - 7.40 X 38350
B-C-Nd NdBC LaBC,oP60,19 P212121 0.837,0.8392,1.2253,90,90,90 - - 6.45 X 53366
B-C-Nd NdB2C2 CeB2C2,tP10,127 P4/mbm 0.53786,0.53786,0.37741,90,90,90 - - 5.78 X 39239
Handbook of Inorganic Substances – Edition 2015 : Data 277

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-C-Nd Nd10 B9C12 Ce10 B9C12,tP124,92 P41212 0.83834,0.83834,2.5352,90,90,90 - black 6.28 X 49483
B-C-Nd Nd15 B6C20 Pr15B6C20,aP45,2 P-1 0.8284,0.8309,0.9228,84.74,84.17,89.68 - - 6.52 X 50908
B-C-Nd Nd2 BC Nd2BC,mS16,12 C12/m1 1.2732,0.36848,0.9398,90,130.43,90 - black 6.16 X 57469
B-C-Nd Nd25 B12C28 Nd25 B12C28,aP136,2 P-1 0.83209,0.83231,2.9888,83.73,83.294,89.764 - - 6.62 X 56847
B-C-Nd Nd25 B14C26 Pr25B14C26,mP134,14 P121/c1 0.83404,0.83096,3.05296,90,105.606,90 - - 6.63 X 56847
B-C-Nd Nd5 B2C5 Sm5 B2C5,tP48,130 P4/ncc 0.84872,0.84872,1.09591,90,90,90 - - 6.76 A 37696
B-C-Nd Nd5 B2C6 Ce5B2C6,tP64,75 P4 0.835,0.835,1.2146,90,90,90 - - 6.39 A 38795
B-C-Nd Nd5 B2C6.8 Pr5(B0.5C0.5)4C4.5,tP60,130 P4/ncc 0.8348,0.8348,1.2347,90,90,90 - - 6.36 X 44100
B-C-Nd Nd5 B4C5 Ce5B4C5,oP112,33 Pna21 2.4301,0.83126,0.83545,90,90,90 - - 6.49 X 52802
B-C-Ni Ni2.40 B0.80 C0.20 Fe3C-b,oP16,62 Pnma 0.517,0.6631,0.4402,90,90,90 - - 6.69 X 52089
B-C-Ni Ni23 B3C3 Cr23 C6,cF116,225 Fm-3m 1.04668,1.04668,1.04668,90,90,90 - - 8.22 A 43607
B-C-O B13C1.33 O0.67 B13C2,hR45,166 R-3m 0.5618,0.5618,1.2122,90,90,120 - brown red 2.51 X 39257
B-C-Pr PrBC LaBC,oP60,19 P212121 0.84478,0.84719,1.2325,90,90,90 - - 6.16 X 53366
B-C-Pr PrB2C2 CeB2C2,tP10,127 P4/mbm 0.53846,0.53846,0.38172,90,90,90 - - 5.60 X 39239
B-C-Pr Pr10 B9C12 Ce10 B9C12,tP124,92 P41212 0.84365,0.84365,2.5468,90,90,90 - black 6.05 X 49483
B-C-Pr Pr15 B6C20 Pr15B6C20,aP45,2 P-1 0.83431,0.83581,0.92492,84.72,84.23,89.68 - - 6.29 X 50908
B-C-Pr Pr2BC *,mS16,12 C12/m1 1.3088,0.3674,0.9488,90,131.03,90 - - - N 47617
B-C-Pr Pr25 B14C26 Pr25B14C26,mP134,14 P121/c1 0.84243,0.84095,3.08223,90,105.842,90 - - 6.30 X 56847
B-C-Pr Pr5B2C5 Sm5 B2C5,tP48,130 P4/ncc 0.8448,0.8448,1.097,90,90,90 - black 6.67 X 47731
B-C-Pr Pr5B2C6 tet Ce5B2C6,tP64,75 P4 0.83954,0.83954,1.2248,90,90,90 - - 6.14 A 38795
B-C-Pr Pr5B2C6 tricl *,aP*,2 P-1 0.83431,0.83581,0.92492,84.72,84.23,89.68 - - - N 44612
B-C-Pr Pr5B2C6.3 La5(B0.7 C0.3)3.6 C3.8 ,tP56,130 P4/ncc 0.8402,0.8402,1.21,90,90,90 - - 6.24 X 44100
B-C-Pr Pr5B2C6.5 Pr5(B0.5C0.5)4C4.5,tP60,130 P4/ncc 0.838,0.838,1.23,90,90,90 - - 6.18 X 44100
B-C-Pr Pr5B4C5 Ce5B4C5,oP112,33 Pna21 2.4592,0.84563,0.84918,90,90,90 - - 6.08 X 52802
B-C-Sc ScB13C ScB12(B0.5 C0.5 )2,oI60,74 Imma 0.56829,1.00488,0.80375,90,90,90 - - 2.86 X 39634
B-C-Sc ScB2C YB2 C,tP32,135 P42/mbc 0.6651,0.6651,0.6763,90,90,90 - - 3.49 X 15283
B-C-Sc ScB2C2 ScB2C2,oP20,55 Pbam 0.5175,1.0075,0.344,90,90,90 - - 3.36 X 2499
B-C-Sc Sc2BC2 Na2HgO2,tI10,139 I4/mmm 0.33259,0.33259,1.06741,90,90,90 - - 3.51 X 36308
B-C-Sc Sc3B0.75 C3 Sc3B0.75 C3,tP7,123 P4/mmm 0.33315,0.33315,0.76737,90,90,90 - black 3.49 X 37313
B-C-Sc Sc3B51C0.75 Sc3B51C0.75 ,hP212,191 P6/mmm 1.45501,1.45501,0.89543,90,90,120 - gray silver 2.81 X 37691
B-C-Sc Sc98 B54C157 Sc98(B0.33 C0.67)162 C49 ,hP309,164 P-3m1 2.371,2.371,0.6703,90,90,120 - - 3.50 X 36322
B-C-Si Si0.03 B12.97 C2 Al0.33 B12.67 (B0.33 C0.67)2,hR63,166 R-3m 0.55841,0.55841,1.23014,90,90,120 - - 2.48 X 20552
B-C-Si Si3.33 B101 C1.17 rhom1 Si3.3 B101.4 C1.2,hR375,166 R-3m 1.10152,1.10152,2.38625,90,90,120 β-boron family black 2.38 X 43499
B-C-Sm SmBC LaBC,oP60,19 P212121 0.8252,0.8281,1.2241,90,90,90 - - 6.88 A 45636
B-C-Sm SmB2C2 tet1 YB2 C2,tP10,131 P42/mmc 0.3804,0.3804,0.7393,90,90,90 - - 6.09 A 14641
B-C-Sm SmB2C2 tet2 CeB2C2,tP10,127 P4/mbm 0.5366,0.5366,0.369,90,90,90 - - 6.13 X 47790
B-C-Sm Sm5 B2C5 Sm5 B2C5,tP48,130 P4/ncc 0.8331,0.8331,1.0926,90,90,90 - - 7.30 X 37696
B-C-Sm Sm5 B2C6 Ce5B2C6,tP64,75 P4 0.82409,0.82409,1.1971,90,90,90 - - 6.91 A 38795
B-C-Tb TbB2C orth DyB2C,oP16,55 Pbam 0.67844,0.67907,0.37883,90,90,90 - - 7.33 A 58915
B-C-Tb TbB2C tet YB2 C,tP32,135 P42/mbc 0.6791,0.6791,0.7522,90,90,90 - - 7.37 X 9122
B-C-Tb TbB2C2 CeB2C2,tP10,127 P4/mbm 0.5355,0.5355,0.35888,90,90,90 - - 6.60 X 39239
B-C-Tb Tb10 B9.2 C9.8 Tb10 B9.2 C9.8 ,mP120,14 P121/c1 0.7937,2.3786,1.1172,90,133.74,90 - - 7.87 X 55438
B-C-Tb Tb15 B4C14 Tb15 B4C14,tP70,128 P4/mnc 0.81251,0.81251,1.5861,90,90,90 - - 8.23 X 54963
B-C-Tb Tb2B2C3 Gd2B3C2,oS14,65 Cmmm 0.3412,1.3699,0.3669,90,90,90 - - 7.27 X 51662
B-C-Tb Tb2B4C Dy2B4C,oI14,71 Immm 0.32877,0.6569,0.7593,90,90,90 - - 7.56 A 49080
B-C-Tb Tb5B2C5 Sm5 B2C5,tP48,130 P4/ncc 0.81382,0.81382,1.0861,90,90,90 - - 8.09 A 37696
B-C-Tb Tb5B2C6 Ce5B2C6,tP64,75 P4 0.8102,0.8102,1.1658,90,90,90 - - 7.71 A 38795
B-C-Th ThBC ThBC,tP24,91 P4122 0.3762,0.3762,2.5246,90,90,90 - - 9.48 X 11666
B-C-Th ThB2C ThB2C,hR36,166 R-3m 0.66761,0.66761,1.1376,90,90,120 - - 9.04 X 22535
B-C-Th Th3B2C3 rt Th3B2C3,mP8,10 P12/m1 0.3703,0.3773,0.9146,90,100.06,90 - - 9.95 X 12487
B-C-Ti TiB0.10 C0.85 NaCl,cF8,225 Fm-3m 0.4322,0.4322,0.4322,90,90,90 rocksalt family - 4.87 X 10660
B-C-Ti Ti0.93 B24C Ti0.93 B24C,tP52,134 P42/nnm 0.8876,0.8876,0.5062,90,90,90 - - 2.63 X 13077
B-C-Tm TmB2C orth DyB2C,oP16,55 Pbam 0.67323,0.67452,0.36383,90,90,90 - - 8.14 A 58915
B-C-Tm TmB2C tet YB2 C,tP32,135 P42/mbc 0.6735,0.6735,0.7284,90,90,90 - - 8.14 X 9122
B-C-Tm TmB2C2 CeB2C2,tP10,127 P4/mbm 0.53265,0.53265,0.34743,90,90,90 - - 7.23 X 39239
B-C-Tm TmB28.5 C4 YB28.5 C4,hR207,166 R-3m 0.56224,0.56224,5.66488,90,90,120 - - 3.37 A 38906
B-C-Tm Tm15 B4C14 Tb15 B4C14,tP70,128 P4/mnc 0.79214,0.79214,1.5751,90,90,90 - - 9.23 A 54963
B-C-Tm Tm4 B3C4 Gd4B3C4,aP11,2 P-1 0.3485,0.3522,1.16972,92.86,96.43,90.14 - - 8.81 X 59346
B-C-Tm Tm5 B2C5 Sm5 B2C5,tP48,130 P4/ncc 0.7925,0.7925,1.0814,90,90,90 - - 9.06 X 44100
B-C-Tm Tm5 B2C6 Ho5B2C6,tP52,130 P4/ncc 0.789,0.789,1.127,90,90,90 - - 8.88 X 44100
B-C-U UBC UBC,oS12,63 Cmcm 0.35899,1.19781,0.33473,90,90,90 - - 12.04 X 27707
B-C-U UB2 C ht ThB2C,hR36,166 R-3m 0.653,0.653,1.0764,90,90,120 - - 10.21 X 46786
B-C-U UB2 C rt UB2 C,oP8,51 Pmma 0.60338,0.35177,0.41067,90,90,90 - - 10.35 X 24999
B-C-U U5B2C7 *,t**,* - 0.784,0.784,2.358,90,90,90 - - - N 22508
B-C-V V0.645 B24C Ti0.93 B24C,tP52,134 P42/nnm 0.8857,0.8857,0.507,90,90,90 - - 2.54 X 13077
B-C-Y YBC YBC,oS12,65 Cmmm 0.3388,1.3693,0.3627,90,90,90 - - 4.41 X 6156
B-C-Y YB2 C orth DyB2C,oP16,55 Pbam 0.67815,0.67904,0.37535,90,90,90 - - 4.71 A 58915
B-C-Y YB2 C tet YB2 C,tP32,135 P42/mbc 0.6793,0.6793,0.7438,90,90,90 - - 4.74 X 9122
B-C-Y YB2 C2 YB2 C2,tP10,131 P42/mmc 0.3796,0.3796,0.7124,90,90,90 - - 4.35 X 6156
B-C-Y YB24 C4.8 YB24 C4.8 ,mS276,12 C12/m1 1.6024,2.1758,0.56411,90,90.18,90 - - 2.74 X 40172
B-C-Y YB25 C5 *,mP*,10 P12/m1 0.5636,1.0884,1.5991,90,90.16,90 - - - N 40172
B-C-Y YB28.5 C4 YB28.5 C4,hR207,166 R-3m 0.56457,0.56457,5.68873,90,90,120 - - 2.82 X 38906
B-C-Y YB5.1 C0.1 *,t**,* - 0.7079,0.7079,0.4014,90,90,90 - - - N 34553
B-C-Y Y0.6 B14C0.6 Y0.6 B14C0.6 ,mS72,12 C12/m1 1.01038,1.0327,0.586,90,124.988,90 - - 2.81 X 40172
B-C-Y Y10.1 B7C9.9 Y10.1 B7C9.9 ,mS216,15 C12/c1 1.1273,1.1159,2.3566,90,98.15,90 - - 4.95 X 52811
B-C-Y Y15B4C14 Tb15 B4C14,tP70,128 P4/mnc 0.80503,0.80503,1.6041,90,90,90 - - 4.94 A 54963
B-C-Y Y2B3C2 Gd2B3C2,oS14,65 Cmmm 0.3405,1.3765,0.3631,90,90,90 - - 4.57 X 37296
B-C-Y Y5B2C5 Sm5 B2C5,tP48,130 P4/ncc 0.8079,0.8079,1.0938,90,90,90 - - 4.90 X 44100
278 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-C-Yb YbB2C orth DyB2C,oP16,55 Pbam 0.67212,0.67304,0.36268,90,90,90 - - 8.37 A 58915


B-C-Yb YbB2C tet YB2C,tP32,135 P42 /mbc 0.6724,0.6724,0.7248,90,90,90 - - 8.38 X 9122
B-C-Yb YbB2C2 YB2C2,tP10,131 P42 /mmc 0.3775,0.3775,0.712,90,90,90 - - 7.16 A 3630
B-C-Yb YbB5.97 C0.03 CaB6,cP7,221 Pm-3m 0.41476,0.41476,0.41476,90,90,90 - - 5.54 A 13285
B-C-Yb Yb15B4C14 Tb15B4C14 ,tP70,128 P4/mnc 0.78601,0.78601,1.5504,90,90,90 - - 9.73 X 59419
B-C-Zr ZrB0.03 C0.97 NaCl,cF8,225 Fm-3m 0.4691,0.4691,0.4691,90,90,90 rocksalt family - 6.64 X 1277
B-Ca-D Ca[BD4]2 ht Ca[BH4]2,tP6,84 P42 /m 0.69468,0.69468,0.43661,90,90,90 - - 1.23 X 50843
B-Ca-D Ca[BD4]2 lt Ca[BH4]2,oP24,61 Pbca 0.75107,1.30584,0.83881,90,90,90 - - 1.26 X 52788
B-Ca-D Ca[BD4]2 rt Ca[BH4]2,oF24,70 Fddd 0.7466,0.87461,1.30942,90,90,90 - - 1.21 X 50843
B-Ca-Er Ca0.2 Er0.8B6 CaB6,cP7,221 Pm-3m 0.4098,0.4098,0.4098,90,90,90 - - 4.99 X 7497
B-Ca-F Ca[BF4 ]2 m Ca[BF4 ]2,oP88,61 Pbca 0.89103,1.33719,0.92792,90,90,90 - - 2.57 X 8851
B-Ca-H Ca[BH4]2 ht Ca[BH4]2,tP6,84 P42 /m 0.69241,0.69241,0.43492,90,90,90 - - 1.11 X 53184
B-Ca-H Ca[BH4]2 lt Ca[BH4]2,tI12,122 I-42d 0.58446,0.58446,1.32279,90,90,90 - - 1.03 X 51683
B-Ca-H Ca[BH4]2 rt Ca[BH4]2,oF24,70 Fddd 0.74887,0.87782,1.3129,90,90,90 - - 1.07 X 54513
B-Ca-H H12CaB12 H12CaB12,mS52,15 C12/c1 0.7242,1.1971,1.0744,90,90.18,90 - - 1.30 X 54895
B-Ca-H H2CaB2 H2CaB2,oP12,62 Pnma 1.28105,0.40825,0.39034,90,90,90 - - 2.07 X 52701
B-Ca-Ir CaIr2B2 CaRh2B2,oF40,70 Fddd 0.5877,0.9257,1.0727,90,90,90 - gray 10.16 X 12009
B-Ca-N Ca3BN3 Sc3B0.75 C3 ,tP7,123 P4/mmm 0.35494,0.35494,0.82136,90,90,90 - gray light 2.78 X 40897
B-Ca-N Ca3B2N4 rt Ca3B2N4,oS108,64 Cmce 1.02418,0.73243,2.0916,90,90,90 - white 2.51 X 45128
B-Ca-N Ca4.5 B3N6 ht Sr4.5 B3N6,cI28,229 Im-3m 0.73224,0.73224,0.73224,90,90,90 - colorless 2.51 X 34397
B-Ca-Ni CaNi12B6 SrNi12B6,hR57,166 R-3m 0.9528,0.9528,0.7407,90,90,120 - gray 6.92 X 25619
B-Ca-Ni CaNi4B CeCo 4B,hP12,191 P6/mmm 0.5066,0.5066,0.6844,90,90,120 - gray 6.24 X 25619
B-Ca-Ni Ca2Ni21B6 m Cr21W2C6 ,cF116,225 Fm-3m 1.0471,1.0471,1.0471,90,90,90 - - 7.97 A 11074
B-Ca-Ni Ca3Ni7B2 Ca3Cu2Al7 ,hR36,166 R-3m 0.5157,0.5157,2.1433,90,90,120 Laves-CaCu5 gray 5.58 X 25619
B-Ca-Ni Ca5Ni15B4 Ca5Ni15B4 ,hP48,194 P63 /mmc 0.5115,0.5115,2.7946,90,90,120 Laves-CaCu5 gray 5.90 X 25619
B-Ca-O CaB2O4 hp1 CaB2O4,oP56,56 Pccn 0.838,1.382,0.5006,90,90,90 calciborite - 2.88 X 5210
B-Ca-O CaB2O4 hp2 CaB2O4,oP84,33 Pna21 1.138,0.6382,1.1304,90,90,90 - - 3.05 X 4444
B-Ca-O CaB2O4 hp3 CaB2O4,cP84,205 Pa-3 0.9008,0.9008,0.9008,90,90,90 - - 3.43 X 4445
B-Ca-O CaB2O4 CaB2O4,oP28,60 Pbcn 1.15865,0.42747,0.62046,90,90,90 - colorless 2.72 X 19966
B-Ca-O CaB4O7 hp SrB4O7,oP24,31 Pmn21 1.0584,0.4369,0.4194,90,90,90 - colorless 3.34 X 42502
B-Ca-O CaB4O7 CaB4O7,mP96,14 P121/c1 0.785,0.995,1.43805,90,120.96,90 - - 2.69 X 10979
B-Ca-O CaB6O10 CaB6O10,mP68,14 P121/c1 0.9799,0.8705,0.9067,90,116.65,90 - colorless 2.55 X 50663
B-Ca-O Ca2B2O5 Sr2B2O5,mP36,14 P121/c1 0.7212,0.5177,1.1498,90,93.11,90 shimazakiite colorless 2.82 X 35478
B-Ca-O Ca2B6O11 Ca2B6O11,mP76,14 P121/c1 0.868,1.078,0.856,90,111.,90 - - 2.85 X 10172
B-Ca-O Ca3[BO3]2 Ca3[BO3]2 ,hR66,167 R-3c 0.86377,0.86377,1.1849,90,90,120 takedaite colorless 3.10 X 8739
B-Ca-Os Ca2Os3B5 Ca2Os3B5,mS20,5 C121 1.04164,0.4013,0.7971,90,124.202,90 - black 8.49 X 19668
B-Ca-Pd CaPd3B CaTiO3,cP5,221 Pm-3m 0.4205,0.4205,0.4205,90,90,90 perovskite family - 8.27 X 43342
B-Ca-Pt Ca0.67Pt3B2 Ba0.67Pt3B2,hP12,194 P63 /mmc 0.5989,0.5989,0.5127,90,90,120 - - 13.22 A 11636
B-Ca-Rh CaRh2B2 CaRh2B2,oF40,70 Fddd 0.5832,0.924,1.0606,90,90,90 - gray 6.22 X 12009
B-Ca-Rh CaRh3B2 CeCo 3B2,hP6,191 P6/mmm 0.5551,0.5551,0.2919,90,90,120 - - 7.90 X 17131
B-Ca-Rh Ca2Rh5B4 Ca2Rh5B4,oF44,69 Fmmm 0.546,0.9727,1.122,90,90,90 - - 7.11 X 17131
B-Ca-Rh Ca3Rh8B6 Ca3Rh8B6,oF68,69 Fmmm 0.55,0.9698,1.7047,90,90,90 - - 7.37 X 17131
B-Ca-Rh Ca7Rh20B14 Ca7Rh20B14 ,oF164,69 Fmmm 0.553,0.9652,4.042,90,90,90 - - 7.67 X 17131
B-Ca-S CaB2S4 CaB2O4,cP84,205 Pa-3 1.121,1.121,1.121,90,90,90 - white 2.69 X 42101
B-Ca-Y Ca0.17 Y0.83 B6 CaB6,cP7,221 Pm-3m 0.4108,0.4108,0.4108,90,90,90 - - 3.48 A 12458
B-Cd-F Cd[BF4]2 Ca[BF4 ]2,oP88,61 Pbca 0.8746,1.323,0.9127,90,90,90 - - 3.60 X 44656
B-Cd-H Cd[BH4]2 ht Cu2O,cP6,224 Pn-3m 0.58949,0.58949,0.58949,90,90,90 - - 2.30 X 57552
B-Cd-H Cd[BH4]2 rt Mg[BH4]2 ,tP6,102 P42nm 0.56295,0.56295,0.63285,90,90,90 - - 2.35 X 57552
B-Cd-O CdB2O4 ht *,cP189,215 P-43m 1.248,1.248,1.248,90,90,90 - green - N 16061
B-Cd-O CdB2O4 rt BaAl2O4,hP56,173 P63 0.8852,0.8852,0.71672,90,90,120 - - 5.41 X 50069
B-Cd-O CdB4O7 CdB4O7,oP96,61 Pbca 0.821,0.87,1.418,90,90,90 - - 3.51 X 2884
B-Cd-O Cd2B2O5 Co2B2O5,aP18,2 P-1 0.3449,0.63603,0.99502,105.441,90.807,91.933 - colorless 5.16 X 41241
B-Cd-O Cd3[BO3]2 Ni3[BO3]2 ,oP22,58 Pnnm 0.4786,0.5968,0.9012,90,90,90 - colorless 5.87 X 47962
B-Ce-Cl Ce4B4Cl5 La4B4Cl5,mS26,12 C12/m1 1.6391,0.4251,0.918,90,120.2,90 - colorless 4.69 A 51557
B-Ce-Co CeCoB *,hP*,164 P-3m1 0.861,0.861,0.554,90,90,120 - - - N 8233
B-Ce-Co CeCo 12B6 SrNi12B6,hR57,166 R-3m 0.9515,0.9515,0.7458,90,90,120 - - 7.77 A 20276
B-Ce-Co CeCo 3B2 CeCo 3B2,hP6,191 P6/mmm 0.5057,0.5057,0.3036,90,90,120 - - 8.36 X 4607
B-Ce-Co CeCo 4B CeCo 4B,hP12,191 P6/mmm 0.5005,0.5005,0.6932,90,90,120 - - 8.54 X 8545
B-Ce-Co CeCo 4B4 CeCo 4B4,tP18,137 P42 /nmc 0.5059,0.5059,0.7063,90,90,90 - - 7.70 X 6989
B-Ce-Co Ce2Co5B2 Ce2Co5B2 ,hP36,194 P63 /mmc 0.506,0.506,2.043,90,90,120 Laves-CaCu5 - 8.75 X 12317
B-Ce-Co Ce2Co7B3 Ce2Co7B3 ,hP24,191 P6/mmm 0.5053,0.5053,1.297,90,90,120 - - 8.40 X 8545
B-Ce-Co Ce3Co11B4 Ce3Co11B4 ,hP18,191 P6/mmm 0.5045,0.5045,0.9925,90,90,120 - - 8.44 X 8545
B-Ce-Co Ce3Co20B *,t**,* - 0.874,0.874,1.1791,90,90,90 - - - N 20601
B-Ce-Co Ce5Co2B6 Pr5Co2B6,hR39,166 R-3m 0.5541,0.5541,2.426,90,90,120 - - 6.82 A 23385
B-Ce-Cr CeCrB4 YCrB4,oP24,55 Pbam 0.5974,1.153,0.3536,90,90,90 - - 6.42 A 7400
B-Ce-Cr CeCr2B6 CeCr2B6,oI18,71 Immm 0.3105,0.6562,0.8341,90,90,90 - gray dark 6.04 X 31723
B-Ce-Eu Ce0.59 Eu0.39 B6 CaB6,cP7,221 Pm-3m 0.4151,0.4151,0.4151,90,90,90 - - 4.80 A 13632
B-Ce-Fe CeFeB4 ht YCrB4,oP24,55 Pbam 0.5934,1.15,0.3511,90,90,90 - - 6.63 A 11028
B-Ce-Fe Ce0.05 Fe0.83 B0.12 m *,c**,* - 1.238,1.238,1.238,90,90,90 - - - N 28322
B-Ce-Fe Ce1.12 Fe4B4 *,tP594,86 P42 /n 0.709,0.709,12.904,90,90,90 - - - N 20418
B-Ce-Fe Ce2Fe14B Nd2Fe14B,tP68,136 P42 /mnm 0.87602,0.87602,1.21102,90,90,90 - - 7.67 X 20174
B-Ce-Fe Ce5Fe2B6 Pr5Co2B6,hR39,166 R-3m 0.5482,0.5482,2.443,90,90,120 - - 6.87 A 19086
B-Ce-I Ce4B4I5 La4B4I5,mS28,12 C12/m1 1.9033,0.4324,1.0135,90,107.77,90 - green blue 5.18 A 33371
B-Ce-Ir CeIr2B2 CaRh2B2,oF40,70 Fddd 0.6019,0.9379,1.0645,90,90,90 - - 12.07 X 24867
B-Ce-Ir CeIr3B2 CeCo 3B2,hP6,191 P6/mmm 0.552,0.552,0.3066,90,90,120 - - 15.16 X 41709
B-Ce-Ir CeIr4B4 NdCo4B4,tP18,86 P42 /n 0.7642,0.7642,0.397,90,90,90 - - 13.64 A 12590
B-Ce-Ir Ce2Ir5B2 Ce2Ir5B2,hR54,166 R-3m 0.5477,0.5477,3.1518,90,90,120 - - 15.37 X 41710
B-Ce-La La0.25 Ce0.75 B5.6 CaB6,cP7,221 Pm-3m 0.41443,0.41443,0.41443,90,90,90 - - 4.67 X 22357
Handbook of Inorganic Substances – Edition 2015 : Data 279

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Ce-Mn CeMnB4 YCrB4,oP24,55 Pbam 0.5977,1.153,0.3517,90,90,90 - - 6.53 A 9397


B-Ce-N CeBN2 LaBN2,aP24,2 P-1 0.6583,0.6775,0.773,106.05,90.73,115.52 - - 6.03 X 35398
B-Ce-N Ce15 B8N25 Ce15 B8N25,hR288,167 R-3c 1.45003,1.45003,2.11555,90,90,120 - - 6.57 X 18254
B-Ce-N Ce3B2N4 Ce3B2N4,oI18,71 Immm 0.3562,0.6319,1.07191,90,90,90 - black 6.86 X 36674
B-Ce-N Ce4B2N5 Ce4B2N5,mS22,12 C12/m1 1.2382,0.35732,0.90521,90,129.7,90 - black 7.03 X 39554
B-Ce-Nd Ce0.5 Nd0.5 B6 CaB6,cP7,221 Pm-3m 0.41423,0.41423,0.41423,90,90,90 - - 4.84 X 53219
B-Ce-Ni CeNiB4 ErNiB4,tI48,139 I4/mmm 0.7626,0.7626,0.86,90,90,90 - - 6.43 A 17494
B-Ce-Ni CeNi12B6 CeNi12B6,oS76,36 Cmc21 0.9586,0.7409,1.1071,90,90,90 - - 7.68 X 17914
B-Ce-Ni CeNi4B CeCo 4B,hP12,191 P6/mmm 0.5005,0.5005,0.6992,90,90,120 - - 8.45 A 18068
B-Ce-Ni Ce2NiB10 Th2NiB10,oP26,55 Pbam 0.5654,1.1258,0.4196,90,90,90 - - 5.56 X 37695
B-Ce-Ni Ce2Ni21B6 Cr21 W2C6,cF116,225 Fm-3m 1.0676,1.0676,1.0676,90,90,90 - - 8.61 X 5973
B-Ce-Ni Ce2Ni5B4 Nd2Ni5B4,mS22,12 C12/m1 0.9759,0.5117,0.67203,90,125.22,90 - - 7.47 A 18989
B-Ce-Ni Ce3Ni13B2 Nd3Ni13B2,hP18,191 P6/mmm 0.4954,0.4954,1.0972,90,90,120 - - 8.58 A 14138
B-Ce-O CeB3O6 hp CeB3O6,oP40,29 Pca21 1.8457,0.4468,0.4295,90,90,90 - colorless 5.04 X 43986
B-Ce-O CeB3O6 rt mon1 LaB3O6,mS40,15 C12/c1 0.98973,0.81266,0.64468,90,126.907,90 - white 4.30 X 42620
B-Ce-O CeB3O6 rt mon2 BiB3 O6-b,mP40,14 P121/c1 0.42252,1.1697,0.7252,90,91.33,90 - colorless 4.98 X 49764
B-Ce-O Ce[BO3] ht La[BO3],mP10,11 P121/m1 0.41311,0.50593,0.63022,90,107.528,90 - brown light 5.26 X 43552
B-Ce-O Ce[BO3] rt Ca[CO3]-a,oP20,62 Pnma 0.58125,0.5078,0.81947,90,90,90 - white 5.46 X 43552
B-Ce-O Ce4B14O27 La4B14O27,mS180,15 C12/c1 1.1178,0.6409,2.5317,90,100.2,90 - colorless 4.26 X 59728
B-Ce-Os CeOs2B2 CeRu2B2,oF40,22 F222 0.65574,0.90599,1.0043,90,90,90 - - 12.07 A 20360
B-Ce-Os CeOs4B4 NdCo 4B4,tP18,86 P42/n 0.7538,0.7538,0.4005,90,90,90 - - 13.78 A 12590
B-Ce-Pd CePd3B0.6 calc CaTiO3,cP5,221 Pm-3m 0.41935,0.41935,0.41935,90,90,90 perovskite family - 10.49 X 40171
B-Ce-Pd CePd8B1.54 CePd8B1.54 ,mS132,15 C12/c1 1.78104,1.03723,1.16314,90,118.515,90 - - 10.64 X 54891
B-Ce-Pd Ce2Pd15B5 Nd2Pd14.9 B4.9,tI96,141 I41/amd 0.8591,0.8591,1.662,90,90,90 - - 10.45 A 52631
B-Ce-Pd Ce3Pd23.13 B7.95 La3Pd23.12 B7.95 ,mP146,14 P121/c1 1.17274,1.05537,1.60271,90,102.265,90 - - 10.17 X 54891
B-Ce-Pd Ce3Pd23.75 B6 Ce3Pd23.75 B6,mP140,14 P121/c1 1.17453,1.04571,1.59759,90,102.132,90 - - 10.43 X 52812
B-Ce-Pd Ce6Pd46.8 B6 La6Pd46.81 B6,mS130,12 C12/m1 1.03594,1.80782,1.01997,90,108.321,90 - - 10.78 X 54891
B-Ce-Pr Ce0.8 Pr0.2 B6 CaB6,cP7,221 Pm-3m 0.41484,0.41484,0.41484,90,90,90 - - 4.77 X 51262
B-Ce-Pt CePt2B CePt2B,hP12,180 P6222 0.54898,0.54898,0.7886,90,90,120 - - 13.10 X 37390
B-Ce-Pt CePt2B1.3 CePt2B1.3,oS10,21 C222 0.31648,0.54799,0.7884,90,90,90 - - 13.22 X 37320
B-Ce-Pt CePt3B CePt3B,tP5,99 P4mm 0.40031,0.40031,0.50736,90,90,90 - - 15.04 X 40171
B-Ce-Pt CePt4B CeCo 4B,hP12,191 P6/mmm 0.544,0.544,0.7598,90,90,120 - - 15.88 X 42926
B-Ce-Re CeReB4 YCrB4,oP24,55 Pbam 0.6013,1.1619,0.3626,90,90,90 - - 9.69 X 31667
B-Ce-Re CeRe 4B4 *,t**,* - 0.746,0.746,1.06,90,90,90 - - - N 15782
B-Ce-Re Ce2Re3B6 Pr2Re3B6,mS44,15 C12/c1 0.6744,1.0581,0.7539,90,90.75,90 - - 11.16 A 22919
B-Ce-Re Ce8Re13B12 Pr8Re12.6 B12,hR99,166 R-3m 1.065,1.065,1.4496,90,90,120 - - 12.85 A 26001
B-Ce-Rh CeRh3B CaTiO3,cP5,221 Pm-3m 0.41883,0.41883,0.41883,90,90,90 perovskite family - 10.39 X 19125
B-Ce-Rh CeRh3B2 CeCo 3B2,hP6,191 P6/mmm 0.5484,0.5484,0.3087,90,90,120 - - 9.72 X 20396
B-Ce-Rh CeRh4B4 ht-hp CeCo 4B4,tP18,137 P42/nmc 0.534,0.534,0.747,90,90,90 - - 9.28 A 20236
B-Ce-Rh Ce0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5611,0.5611,0.8522,90,90,120 - - 8.58 A 18158
B-Ce-Ru CeRuB2 LuRuB2,oP16,62 Pnma 0.58948,0.53633,0.64561,90,90,90 - - 8.55 A 18331
B-Ce-Ru CeRu2B2 CeRu2B2,oF40,22 F222 0.64861,0.90573,1.00263,90,90,90 - - 8.21 X 20360
B-Ce-Ru CeRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5527,0.5527,0.2991,90,90,120 - - 9.76 X 23950
B-Ce-Ru CeRu4B4 LuRu4B4,tI72,142 I41/acd 0.74747,0.74747,1.5064,90,90,90 - gray 9.28 X 55439
B-Ce-S CeBS3 CeBS3,oP20,33 Pna21 0.76087,0.60168,0.89319,90,90,90 - - 4.01 X 55036
B-Ce-Sm Ce0.5 Sm0.5 B6 CaB6,cP7,221 Pm-3m 0.41418,0.41418,0.41418,90,90,90 - - 4.91 A 13632
B-Ce-Y Y0.4 Ce0.6 B6 CaB6,cP7,221 Pm-3m 0.4125,0.4125,0.4125,90,90,90 - - 4.36 A 19651
B-Ce-Y Y0.5 Ce0.5 B4 UB4 ,tP20,127 P4/mbm 0.705,0.705,0.404,90,90,90 - - 5.22 A 19651
B-Ce-Zn Zn17 Ce2B0.45 Pr2Mn17C1.77 ,hR66,166 R-3m 0.90872,0.90872,1.32825,90,90,120 CaCu5-Zr4Al3 - 7.32 X 56903
B-Cl-Cs CsB6Cl6 rt CsB6Cl6,hR156,148 R-3 0.95967,0.95967,4.5642,90,90,120 - - 2.25 X 43939
B-Cl-F [ClF2][BF4] [ClF2][BF4],mP32,14 P121/c1 0.5644,0.8873,0.9822,90,116.84,90 - - 2.43 X 21746
B-Cl-H H13B10Cl H13B10Cl,mP44,14 P121/c1 1.2444,0.76026,1.11468,90,115.766,90 - - 1.10 X 50475
B-Cl-Hf Hf6BCl14 Zr6CI14,oS84,64 Cmce 1.4014,1.2576,1.1602,90,90,90 - - 5.13 A 28691
B-Cl-La La2B3Cl hex1 La2B3Cl,hP24,174 P-6 0.7872,0.7872,0.8219,90,90,120 - black 5.21 X 49566
B-Cl-La La2B3Cl hex2 La2B3Cl,hP28,191 P6/mmm 0.7872,0.7872,0.8219,90,90,120 - black 5.21 X 49566
B-Cl-La La2B3Cl trig La2B3Cl,hP288,143 P3 2.7262,2.7262,0.82116,90,90,120 - black 5.21 X 49566
B-Cl-La La4B4Cl5 La4B4Cl5,mS26,12 C12/m1 1.6484,0.4263,0.9276,90,120.06,90 - gray steel 4.57 X 51557
B-Cl-N BNCl2 BNCl2,hR36,146 R3 0.8847,0.8847,1.0321,90,90,120 - - 2.04 X 6417
B-Cl-N B[N3]Cl2 B[N3]Cl2,mP72,14 P121/c1 0.8874,1.4494,1.0538,90,99.74,90 - - 1.85 X 6324
B-Cl-N B2NCl3 B2NCl3,tP72,92 P41212 0.98256,0.98256,1.64708,90,90,90 - - 1.78 X 50278
B-Cl-P B2PCl2 *,oP80,60 Pbcn 2.2706,0.6002,1.2401,90,90,90 - colorless - N 21062
B-Cl-Pr Pr8B7Cl7 Pr8B7Cl7,aP44,2 P-1 0.7731,0.903,1.4194,81.55,82.18,64.76 - golden 5.45 X 36521
B-Cl-S BSCl *,mP36,14 P121/c1 1.368,0.4101,1.722,90,115.4,90 - - - N 8083
B-Cl-Sc Sc4BCl6 Sc4BCl6,oP22,55 Pbam 1.1741,1.2187,0.35988,90,90,90 - - 2.60 X 19311
B-Cl-Sc Sc7BCl12 Sc7NCl12,hR60,148 R-3 1.3014,1.3014,0.8899,90,90,120 - - 2.87 X 19311
B-Cl-Tb Tb3BCl3 Ca3PI3,cI56,214 I4132 1.087,1.087,1.087,90,90,90 - - 6.14 A 39490
B-Cl-Y Y3BCl3 Ca3PI3,cI56,214 I4132 1.0808,1.0808,1.0808,90,90,90 - - 4.04 A 39490
B-Cl-Zr Zr6BCl14 Zr6CI14,oS84,64 Cmce 1.4243,1.264,1.1546,90,90,90 - black 3.37 X 22583
B-Co-Cr Cr0.9 Co1.1B CuAl2,tI12,140 I4/mcm 0.5098,0.5098,0.4235,90,90,90 - - 7.39 A 3795
B-Co-Cr Cr2Co21B6 Cr21 W2C6,cF116,225 Fm-3m 1.0471,1.0471,1.0471,90,90,90 - - 8.14 X 3118
B-Co-Dy DyCoB4 YCrB4,oP24,55 Pbam 0.5885,1.14,0.3403,90,90,90 - - 7.70 A 11028
B-Co-Dy DyCo 12B6 SrNi12B6,hR57,166 R-3m 0.9455,0.9455,0.7451,90,90,120 - - 8.07 A 20276
B-Co-Dy DyCo 2B2 CeAl2Ga2,tI10,139 I4/mmm 0.35548,0.35548,0.9331,90,90,90 - - 8.51 A 20234
B-Co-Dy DyCo 3B2 CeCo 3B2,hP6,191 P6/mmm 0.5031,0.5031,0.3018,90,90,120 - - 9.06 X 28865
B-Co-Dy DyCo 4B CeCo 4B,hP12,191 P6/mmm 0.4987,0.4987,0.687,90,90,120 - - 9.18 A 22429
B-Co-Dy DyCo 4B4 CeCo 4B4,tP18,137 P42/nmc 0.5026,0.5026,0.7014,90,90,90 - - 8.28 A 6989
B-Co-Dy Dy2 Co7B3 Ce2Co7B3,hP24,191 P6/mmm 0.5046,0.5046,1.284,90,90,120 - - 9.03 A 8545
B-Co-Dy Dy3 Co11B4 Ce3Co11B4,hP18,191 P6/mmm 0.5043,0.5043,0.9836,90,90,120 - - 9.04 A 31918
280 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Co-Dy Dy4CoB13 Er4NiB13,tP36,128 P4/mnc 0.7123,0.7123,0.783,90,90,90 - - 7.10 A 24679


B-Co-Dy Dy5Co2B6 Pr5Co2B6,hR39,166 R-3m 0.54,0.54,2.302,90,90,120 - - 8.53 A 19086
B-Co-Er ErCoB4 YCrB4,oP24,55 Pbam 0.5869,1.134,0.3353,90,90,90 - - 8.02 A 11028
B-Co-Er ErCo 12B6 SrNi12B6,hR57,166 R-3m 0.9438,0.9438,0.7431,90,90,120 - - 8.16 A 22490
B-Co-Er ErCo 2B0.07 MgCu2,cF24,227 Fd-3m 0.714,0.714,0.714,90,90,90 Friauf-Laves phase - 10.43 F 58827
B-Co-Er ErCo 2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3545,0.3545,0.9161,90,90,90 - - 8.85 A 20234
B-Co-Er ErCo 3B2 CeCo 3B2,hP6,191 P6/mmm 0.5005,0.5005,0.3029,90,90,120 - - 9.24 X 7662
B-Co-Er ErCo 4B CeCo 4B,hP12,191 P6/mmm 0.4979,0.4979,0.6869,90,90,120 - - 9.32 A 20271
B-Co-Er ErCo 4B4 CeCo 4B4,tP18,137 P42 /nmc 0.502,0.502,0.7,90,90,90 - - 8.40 A 26059
B-Co-Er Er2Co7B3 Ce2Co7B3 ,hP24,191 P6/mmm 0.5006,0.5006,1.287,90,90,120 - - 9.27 A 8545
B-Co-Er Er3Co11B4 Ce3Co11B4 ,hP18,191 P6/mmm 0.502,0.502,0.985,90,90,120 - - 9.22 A 30445
B-Co-Er Er4CoB13 Er4NiB13,tP36,128 P4/mnc 0.7071,0.7071,0.778,90,90,90 - - 7.42 A 24679
B-Co-Er Er5Co2B6 Pr5Co2B6,hR39,166 R-3m 0.5388,0.5388,2.257,90,90,120 - - 8.95 A 23385
B-Co-Eu EuCo12B6 SrNi12B6,hR57,166 R-3m 0.9472,0.9472,0.7456,90,90,120 - - 7.95 A 14139
B-Co-Fe FeCo 2B Fe3C-b,oP16,62 Pnma 0.5307,0.66359,0.44255,90,90,90 - - 7.86 A 17199
B-Co-Ga Co20Ga3B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0502,1.0502,1.0502,90,90,90 - - 8.33 A 16223
B-Co-Ga Co21.9 Ga1.1 B6 Cr21W2C6 ,cF116,225 Fm-3m 1.04844,1.04844,1.04844,90,90,90 - - 8.25 X 52971
B-Co-Gd GdCoB4 YCrB4,oP24,55 Pbam 0.5913,1.1451,0.3462,90,90,90 - - 7.35 X 49586
B-Co-Gd GdCo12B6 SrNi12B6,hR57,166 R-3m 0.9495,0.9495,0.7474,90,90,120 - - 7.93 X 49586
B-Co-Gd GdCo2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3575,0.3575,0.9561,90,90,90 - - 8.07 X 17541
B-Co-Gd GdCo3B2 CeCo 3B2,hP6,191 P6/mmm 0.5074,0.5074,0.3039,90,90,120 - - 8.72 X 28865
B-Co-Gd GdCo4B CeCo 4B,hP12,191 P6/mmm 0.5059,0.5059,0.6901,90,90,120 - - 8.77 X 49586
B-Co-Gd GdCo4B4 CeCo 4B4,tP18,137 P42 /nmc 0.5043,0.5043,0.7049,90,90,90 - - 8.08 A 6989
B-Co-Gd Gd2CoB3 *,hP6,* - 0.313,0.313,0.7894,90,90,120 - - 10.06 N 12002
B-Co-Gd Gd2Co14B Nd2Fe14B,tP68,136 P42 /mnm 0.8633,0.8633,1.1779,90,90,90 - - 8.70 A 37284
B-Co-Gd Gd2Co7B3 Ce2Co7B3 ,hP24,191 P6/mmm 0.5067,0.5067,1.294,90,90,120 - - 8.77 A 37284
B-Co-Gd Gd3Co11B4 Ce3Co11B4 ,hP18,191 P6/mmm 0.5087,0.5087,0.9829,90,90,120 - - 8.77 X 49586
B-Co-Gd Gd4CoB13 Er4NiB13,tP36,128 P4/mnc 0.7178,0.7178,0.7911,90,90,90 - - 6.75 A 24679
B-Co-Gd Gd5Co2B6 Pr5Co2B6,hR39,166 R-3m 0.5419,0.5419,2.34,90,90,120 - - 8.11 A 23385
B-Co-Ge Co21Ge2B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0501,1.0501,1.0501,90,90,90 - - 8.30 A 16223
B-Co-Hf HfCo 3B2 ZrCo 3B2,hR54,148 R-3 0.838,0.838,0.912,90,90,120 - - 10.16 A 6260
B-Co-Hf Hf1.5 Co21.5 B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0574,1.0574,1.0574,90,90,90 - - 8.99 A 4809
B-Co-Ho HoCoB4 YCrB4,oP24,55 Pbam 0.5879,1.136,0.3375,90,90,90 - - 7.87 A 11028
B-Co-Ho HoCo12B6 SrNi12B6,hR57,166 R-3m 0.9449,0.9449,0.7439,90,90,120 - - 8.12 A 22490
B-Co-Ho HoCo2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3351,0.3351,0.9245,90,90,90 - - 9.74 A 25987
B-Co-Ho HoCo3B2 CeCo 3B2,hP6,191 P6/mmm 0.50142,0.50142,0.30261,90,90,120 - - 9.16 X 45404
B-Co-Ho HoCo4B CeCo 4B,hP12,191 P6/mmm 0.4976,0.4976,0.6873,90,90,120 - - 9.27 A 25987
B-Co-Ho HoCo4B4 CeCo 4B4,tP18,137 P42 /nmc 0.502,0.502,0.7003,90,90,90 - - 8.35 A 25987
B-Co-Ho Ho2Co7B3 Ce2Co7B3 ,hP24,191 P6/mmm 0.5033,0.5033,1.288,90,90,120 - - 9.11 A 25987
B-Co-Ho Ho2.51 CoB3 Ho2.5 CoB3 ,hP30,194 P63 /mmc 0.54,0.54,1.5151,90,90,120 - - 8.77 X 25987
B-Co-Ho Ho3Co11B4 Ce3Co11B4 ,hP18,191 P6/mmm 0.503,0.503,0.984,90,90,120 - - 9.14 A 31918
B-Co-Ho Ho4CoB13 Er4NiB13,tP36,128 P4/mnc 0.711,0.711,0.78,90,90,90 - - 7.24 A 24679
B-Co-Ho Ho5Co2B6 Pr5Co2B6,hR39,166 R-3m 0.539,0.539,2.28,90,90,120 - - 8.75 A 19086
B-Co-In Co22.5 In0.5 B6 Cr21W2C6 ,cF116,225 Fm-3m 1.04618,1.04618,1.04618,90,90,90 - - 8.40 A 52971
B-Co-Ir Co12.3 Ir8.9 B10.5 (Co 0.58Ir0.42 )21.2 B10.5 ,cF148,225 Fm-3m 1.09393,1.09393,1.09393,90,90,90 - - 12.93 X 52971
B-Co-Ir Co13.6 Ir7.56 B10 Co0.16(Co0.64 Ir0.36)21B10,cF128,216 F-43m 1.0936,1.0936,1.0936,90,90,90 - - 12.00 X 54251
B-Co-Ir Co16.2 Ir6.8 B6 Cr23C6,cF116,225 Fm-3m 1.07979,1.07979,1.07979,90,90,90 - - 12.28 X 52971
B-Co-La LaCo12B6 SrNi12B6,hR57,166 R-3m 0.953,0.953,0.7505,90,90,120 - - 7.69 A 26066
B-Co-La LaCo2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3616,0.3616,1.0215,90,90,90 - - 6.92 X 7255
B-Co-La LaCo4B CeCo 4B,hP12,191 P6/mmm 0.518,0.518,0.689,90,90,120 - - 8.00 A 31922
B-Co-La LaCo4B4 NdCo4B4,tP18,86 P42 /n 0.7151,0.7151,0.3811,90,90,90 - - 7.12 A 11477
B-Co-La La2Co14B Nd2Fe14B,tP68,136 P42 /mnm 0.8675,0.8675,1.2,90,90,90 - - 8.19 A 21298
B-Co-La La5Co2B6 Pr5Co2B6,hR39,166 R-3m 0.551,0.551,2.46,90,90,120 - - 6.76 A 19086
B-Co-Lu LuCoB4 YCrB4,oP24,55 Pbam 0.5827,1.128,0.3327,90,90,90 - - 8.42 A 11028
B-Co-Lu LuCo3B2 CeCo 3B2,hP6,191 P6/mmm 0.4959,0.4959,0.3035,90,90,120 - - 9.59 X 4607
B-Co-Lu LuCo4B CeCo 4B,hP12,191 P6/mmm 0.494,0.494,0.6867,90,90,120 - - 9.65 A 8545
B-Co-Lu LuCo4B4 CeCo 4B4,tP18,137 P42 /nmc 0.4998,0.4998,0.6947,90,90,90 - - 8.69 A 6989
B-Co-Lu Lu2CoB6 Y2ReB6,oP36,55 Pbam 0.899,1.1312,0.3494,90,90,90 - - 8.86 X 21185
B-Co-Lu Lu3Co11B4 Ce3Co11B4 ,hP18,191 P6/mmm 0.4982,0.4982,0.9867,90,90,120 - - 9.52 A 8545
B-Co-Lu Lu4CoB13 Er4NiB13,tP36,128 P4/mnc 0.7093,0.7093,0.7594,90,90,90 - - 7.82 X 21185
B-Co-Mg Mg0.98 Co0.02 B2 AlB2,hP3,191 P6/mmm 0.30828,0.30828,0.35224,90,90,120 AlB2 family - 2.67 X 51351
B-Co-Mg Mg10Co13 B6 Cr23C6,cF116,225 Fm-3m 1.056,1.056,1.056,90,90,90 - - 6.06 A 52971
B-Co-Mn MnCoB CuAl2,tI12,140 I4/mcm 0.5095,0.5095,0.4223,90,90,90 - - 7.55 A 12564
B-Co-Mn Mn0.21 Co0.79 B FeB-b,oP8,62 Pnma 0.537,0.3032,0.3987,90,90,90 CrB(TlI)-FeB - 7.05 A 12255
B-Co-Mn Mn2.3 Co0.36 B4 Ta3B4,oI14,71 Immm 0.2958,0.3032,1.277,90,90,90 - - 5.53 A 3183
B-Co-Mn Mn2.84 Co20.16 B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0518,1.0518,1.0518,90,90,90 - - 8.04 X 3090
B-Co-Mo MoCoB TiNiSi,oP12,62 Pnma 0.5741,0.3232,0.6634,90,90,90 AlB2 family - 8.94 X 3859
B-Co-Mo MoCo2B4 MoFe2B4,oI14,71 Immm 0.3018,0.3079,1.257,90,90,90 - - 7.31 X 3106
B-Co-Mo Mo0.9Co0.1 B ht TlI,oS8,63 Cmcm 0.316,0.8424,0.3064,90,90,90 CrB(TlI)-FeB - 8.39 A 3195
B-Co-Mo Mo1.88 Co0.12 B CuAl2,tI12,140 I4/mcm 0.5529,0.5529,0.4728,90,90,90 - - 9.11 A 3795
B-Co-Mo Mo2CoB2 W2CoB2,oI10,71 Immm 0.3164,0.4564,0.7087,90,90,90 - - 8.84 X 3200
B-Co-Mo Mo2Co21B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0589,1.0589,1.0589,90,90,90 - - 8.36 X 3118
B-Co-Mo Mo3CoB3 W3CoB3,oS28,63 Cmcm 0.3162,0.8428,1.073,90,90,90 - - 8.81 A 4792
B-Co-Nb NbCoB NbCoB,oP30,59 Pmmn 0.3266,1.7177,0.5947,90,90,90 - - 8.10 X 5695
B-Co-Nb NbCoB2 NbCoB2,oP16,62 Pnma 0.6057,0.3127,0.8215,90,90,90 - - 7.41 X 10164
B-Co-Nb Nb2Co21B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0546,1.0546,1.0546,90,90,90 - - 8.43 A 16223
B-Co-Nb Nb3Co4B7 Nb3Co4B7 ,oS56,63 Cmcm 0.3202,1.8432,0.8917,90,90,90 - - 7.45 X 19574
B-Co-Nb Nb3Co5B2 Ti3Co5B2,tP20,127 P4/mbm 0.846,0.846,0.3073,90,90,90 - - 8.98 A 12761
Handbook of Inorganic Substances – Edition 2015 : Data 281

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Co-Nd NdCo 12B6 SrNi12B6,hR57,166 R-3m 0.9502,0.9502,0.7471,90,90,120 - - 7.81 A 37027


B-Co-Nd NdCo 2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3592,0.3592,0.9838,90,90,90 - - 7.42 X 17541
B-Co-Nd NdCo 4B CeCo 4B,hP12,191 P6/mmm 0.5101,0.5101,0.6881,90,90,120 - - 8.37 X 48672
B-Co-Nd NdCo 4B4 NdCo 4B4,tP18,86 P42/n 0.707,0.707,0.3822,90,90,90 - - 7.36 X 11477
B-Co-Nd Nd2 CoB3 *,hR*,* - 0.5423,0.5423,2.431,90,90,120 - - - N 16084
B-Co-Nd Nd2 Co14B Nd2Fe14B,tP68,136 P42/mnm 0.8642,0.8642,1.1859,90,90,90 - - 8.43 X 19047
B-Co-Nd Nd2 Co23B3 m Nd2Fe23B3,cI224,220 I-43d 1.386,1.386,1.386,90,90,90 - - 8.36 A 28880
B-Co-Nd Nd2 Co5B2 Ce2Co5B2,hP36,194 P63/mmc 0.5115,0.5115,2.0565,90,90,120 Laves-CaCu5 - 8.62 A 37027
B-Co-Nd Nd2 Co5B3 *,oS*,68 Ccce 0.513,3.82,1.077,90,90,90 - - - N 37027
B-Co-Nd Nd2 Co7B3 Ce2Co7B3,hP24,191 P6/mmm 0.5159,0.5159,1.2767,90,90,120 - - 8.28 A 37027
B-Co-Nd Nd3 Co11B4 Ce3Co11B4,hP18,191 P6/mmm 0.512,0.512,0.981,90,90,120 - - 8.38 X 34667
B-Co-Nd Nd3 Co13B2 Nd3Ni13B2,hP18,191 P6/mmm 0.50722,0.50722,1.0784,90,90,120 - - 8.44 X 37027
B-Co-Nd Nd5 Co19B6 Lu5Ni19B6,hP30,191 P6/mmm 0.51328,0.51328,1.66519,90,90,120 - - 8.33 X 37027
B-Co-Nd Nd5 Co21B4 Nd5Co 21B4,hP30,191 P6/mmm 0.50987,0.50987,1.76523,90,90,120 - - 8.37 X 38923
B-Co-O CoB2O4 hp NiB2O4,mS28,15 C12/c1 0.9346,0.562,0.4433,90,108.2,90 - violet 4.34 X 55594
B-Co-O CoB4O7 ht ZnB4O7,oS48,63 Cmcm 1.087,0.6468,0.5174,90,90,90 - - 3.91 X 53446
B-Co-O CoB4O7 rt CdB4O7,oP96,61 Pbca 0.81189,0.8621,1.3737,90,90,90 - purple 2.96 X 41952
B-Co-O Co2 B2O5 Co2B2O5,aP18,2 P-1 0.31689,0.6153,0.92734,104.253,90.821,92.098 - purple 4.16 X 41952
B-Co-O Co3 [BO3]O2 Fe3[BO3]O2,oP36,55 Pbam 0.9275,1.2146,0.30265,90,90,90 - purple 5.21 X 23065
B-Co-O Co3 [BO3]2 Ni3[BO3]2,oP22,58 Pnnm 0.4529,0.5462,0.8436,90,90,90 - - 4.69 X 17645
B-Co-O Co4 B6O13 Zn4B6O13,cI46,217 I-43m 0.74825,0.74825,0.74825,90,90,90 zeolite SOD violet 4.03 X 41952
B-Co-P Co3 B0.65P0.35 Ni3P,tI32,82 I-4 0.865,0.865,0.43,90,90,90 - - 8.04 A 24105
B-Co-P Co3 B0.7P 0.3 Ti3P,tP32,86 P42/n 0.8726,0.8726,0.4297,90,90,90 - - 7.86 A 24105
B-Co-P Co5 B2P Mo5 SiB2,tI32,140 I4/mcm 0.5419,0.5419,1.0198,90,90,90 - - 7.70 A 24105
B-Co-Pr PrCo 12B6 SrNi12B6,hR57,166 R-3m 0.9486,0.9486,0.7475,90,90,120 - - 7.81 A 21367
B-Co-Pr PrCo 2B2 CeAl2Ga2,tI10,139 I4/mmm 0.35985,0.35985,0.9951,90,90,90 - - 7.23 A 20234
B-Co-Pr PrCo 4B CeCo 4B,hP12,191 P6/mmm 0.51167,0.51167,0.68838,90,90,120 - - 8.24 A 52494
B-Co-Pr PrCo 4B4 NdCo 4B4,tP18,86 P42/n 0.7085,0.7085,0.3815,90,90,90 - - 7.28 A 2159
B-Co-Pr Pr2Co14B Nd2Fe14B,tP68,136 P42/mnm 0.8633,0.8633,1.1876,90,90,90 - - 8.39 A 21367
B-Co-Pr Pr2Co5B2 Ce2Co5B2,hP36,194 P63/mmc 0.5192,0.5192,2.029,90,90,120 Laves-CaCu5 - 8.39 A 17979
B-Co-Pr Pr2Co5B3 *,oS*,68 Ccce 0.514,3.84,1.08,90,90,90 - - - N 17979
B-Co-Pr Pr2Co7B3 Ce2Co7B3,hP24,191 P6/mmm 0.515,0.515,1.275,90,90,120 - - 8.24 A 35911
B-Co-Pr Pr3Co11B4 Ce3Co11B4,hP18,191 P6/mmm 0.5154,0.5154,0.9749,90,90,120 - - 8.25 A 35911
B-Co-Pr Pr3Co13B2 Nd3Ni13B2,hP18,191 P6/mmm 0.50672,0.50672,1.0685,90,90,120 - - 8.46 X 36008
B-Co-Pr Pr5Co19B6 Lu5Ni19B6,hP30,191 P6/mmm 0.51264,0.51264,1.65602,90,90,120 - - 8.32 X 37982
B-Co-Pr Pr5Co2B6 Pr5Co2B6,hR39,166 R-3m 0.5457,0.5457,2.4718,90,90,120 - - 6.93 X 16006
B-Co-Re ReCoB TiNiSi,oP12,62 Pnma 0.5648,0.3221,0.6554,90,90,90 AlB2 family - 14.26 X 7402
B-Co-Re Re0.2 Co0.8 B FeB-b,oP8,62 Pnma 0.5335,0.3048,0.4005,90,90,90 CrB(TlI)-FeB - 9.71 A 7402
B-Co-Re Re1.44 Co1.56 B Ti3P,tP32,86 P42/n 0.8863,0.8863,0.4441,90,90,90 - - 14.12 X 7402
B-Co-Re Re17.25 Co5.75B6 Cr23 C6,cF116,225 Fm-3m 1.1246,1.1246,1.1246,90,90,90 - - 16.89 A 7402
B-Co-Re Re5Co2B4 Re4(Re 0.5Co0.5 )2CoB4,tP22,127 P4/mbm 0.5347,0.5347,0.7921,90,90,90 - - 16.02 X 6643
B-Co-Re Re6.23 Co0.77 B3 Th7Fe3,hP20,186 P63mc 0.7402,0.7402,0.4781,90,90,120 - - 18.12 A 7402
B-Co-Rh CoRh6B3 Th7Fe3,hP20,186 P63mc 0.743,0.743,0.47427,90,90,120 - - 10.38 X 56259
B-Co-Ru Ru6.5 Co0.5 B3 Th7Fe3,hP20,186 P63mc 0.74436,0.74436,0.46946,90,90,120 - - 10.60 A 55424
B-Co-Sb Co21 Sb2B6 Cr21 W2C6,cF116,225 Fm-3m 1.0594,1.0594,1.0594,90,90,90 - - 8.64 X 2626
B-Co-Sc ScCoB4 YCrB4,oP24,55 Pbam 0.5762,1.1172,0.325,90,90,90 - - 4.67 A 21196
B-Co-Sc ScCo 3B2 CeCo 3B2,hP6,191 P6/mmm 0.4864,0.4864,0.2997,90,90,120 - - 6.58 X 7662
B-Co-Sc Sc2Co21B6 Cr21 W2C6,cF116,225 Fm-3m 1.0537,1.0537,1.0537,90,90,90 - - 7.91 A 3738
B-Co-Si Co4.7 Si2B Nb5Sn2Si,tI32,140 I4/mcm 0.8615,0.8615,0.425,90,90,90 - - 7.24 X 1081
B-Co-Sm SmCo 12B6 SrNi12B6,hR57,166 R-3m 0.9471,0.9471,0.7458,90,90,120 - - 7.93 A 20276
B-Co-Sm SmCo 2B2 CeAl2Ga2,tI10,139 I4/mmm 0.35806,0.35806,0.9673,90,90,90 - - 7.76 A 20234
B-Co-Sm SmCo 3B2 CeCo 3B2,hP6,191 P6/mmm 0.511,0.511,0.2995,90,90,120 - - 8.55 X 28865
B-Co-Sm SmCo 4B CeCo 4B,hP12,191 P6/mmm 0.5081,0.5081,0.6861,90,90,120 - - 8.59 A 18068
B-Co-Sm Sm11 Co40B40 Sm11 Co40B40,tP182,114 P-421c 0.7051,0.7051,3.8709,90,90,90 - - 7.67 X 24078
B-Co-Sm Sm2 Co14B Nd2Fe14B,tP68,136 P42/mnm 0.8584,0.8584,1.1727,90,90,90 - - 8.74 A 37354
B-Co-Sm Sm2 Co5B2 Ce2Co5B2,hP36,194 P63/mmc 0.5146,0.5146,2.018,90,90,120 Laves-CaCu5 - 8.86 A 17979
B-Co-Sm Sm2 Co7B3 Ce2Co7B3,hP24,191 P6/mmm 0.51087,0.51087,1.277,90,90,120 - - 8.58 X 28857
B-Co-Sm Sm3 Co11B4 Ce3Co11B4,hP18,191 P6/mmm 0.5102,0.5102,0.9781,90,90,120 - - 8.61 A 16229
B-Co-Sm Sm4 Co3B3 *,t**,* - 0.704,0.704,1.755,90,90,90 - - - N 13263
B-Co-Sm Sm5 Co2B6 Pr5Co2B6,hR39,166 R-3m 0.542,0.542,2.382,90,90,120 - - 7.68 A 19086
B-Co-Sn Co21.4 Sn1.6 B6 Cr21 W2C6,cF116,225 Fm-3m 1.05553,1.05553,1.05553,90,90,90 - - 8.56 X 52971
B-Co-Ta TaCoB NbCoB,oP30,59 Pmmn 0.3259,1.707,0.592,90,90,90 - - 12.64 A 7362
B-Co-Ta TaCoB2 NbCoB2,oP16,62 Pnma 0.6007,0.3115,0.8191,90,90,90 - - 11.33 A 11759
B-Co-Ta Ta2Co 21B6 Cr21 W2C6,cF116,225 Fm-3m 1.0552,1.0552,1.0552,90,90,90 - - 9.41 X 23069
B-Co-Ta Ta3Co 5B2 Ti3Co 5B2,tP20,127 P4/mbm 0.846,0.846,0.3083,90,90,90 - - 12.93 A 12761
B-Co-Tb TbCoB4 YCrB4,oP24,55 Pbam 0.5899,1.143,0.3421,90,90,90 - - 7.52 A 11028
B-Co-Tb TbCo 1.8 B2 CeAl2Ga2,tI10,139 I4/mmm 0.3567,0.3567,0.9489,90,90,90 - - 7.88 X 17541
B-Co-Tb TbCo 12B6 SrNi12B6,hR57,166 R-3m 0.9454,0.9454,0.7444,90,90,120 - - 8.05 A 22490
B-Co-Tb TbCo 3B2 lt TbCo 3B2,oS12,65 Cmmm 0.50496,0.87487,0.29971,90,90,90 - - 8.96 X 45474
B-Co-Tb TbCo 3B2 rt CeCo 3B2,hP6,191 P6/mmm 0.50523,0.50523,0.30022,90,90,120 - - 8.94 X 45474
B-Co-Tb TbCo 4B CeCo 4B,hP12,191 P6/mmm 0.5037,0.5037,0.6886,90,90,120 - - 8.90 A 37694
B-Co-Tb TbCo 4B4 CeCo 4B4,tP18,137 P42/nmc 0.5038,0.5038,0.703,90,90,90 - - 8.15 A 6989
B-Co-Tb Tb2Co 14B Nd2Fe14B,tP68,136 P42/mnm 0.8581,0.8581,1.171,90,90,90 - - 8.89 A 21398
B-Co-Tb Tb2Co 5B2 *,hR*,166 R-3m 0.5106,0.5106,3.0122,90,90,120 - - - N 21850
B-Co-Tb Tb2Co 7B3 Ce2Co7B3,hP24,191 P6/mmm 0.5061,0.5061,1.283,90,90,120 - - 8.90 A 8545
B-Co-Tb Tb3Co 11B4 Ce3Co11B4,hP18,191 P6/mmm 0.5057,0.5057,0.9819,90,90,120 - - 8.92 A 31918
B-Co-Tb Tb4CoB13 Er4NiB13,tP36,128 P4/mnc 0.7235,0.7235,0.7535,90,90,90 - - 7.03 X 21850
B-Co-Tb Tb4.15Co2.85 B6 Pr5Co2B6,hR39,166 R-3m 0.5401,0.5401,2.334,90,90,120 - - 7.54 X 19086
282 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Co-Th ThCo4B CeCo4B,hP12,191 P6/mmm 0.5083,0.5083,0.7001,90,90,120 - - 10.15 X 41765


B-Co-Th Th2CoB10 Th2NiB10,oP26,55 Pbam 0.5624,1.1228,0.4185,90,90,90 - - 7.93 X 31227
B-Co-Ti Ti3Co20B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0549,1.0549,1.0549,90,90,90 - - 7.85 A 16223
B-Co-Ti Ti3Co5B2 Ti3Co5B2,tP20,127 P4/mbm 0.8489,0.8489,0.3038,90,90,90 - - 6.98 X 6133
B-Co-Tm TmCoB4 YCrB4,oP24,55 Pbam 0.5858,1.131,0.3342,90,90,90 - - 8.13 A 11028
B-Co-Tm TmCo12B6 SrNi12B6,hR57,166 R-3m 0.9435,0.9435,0.7417,90,90,120 - - 8.20 A 22490
B-Co-Tm TmCo3B2 CeCo 3B2,hP6,191 P6/mmm 0.4999,0.4999,0.3019,90,90,120 - - 9.34 X 7662
B-Co-Tm TmCo4B CeCo 4B,hP12,191 P6/mmm 0.4948,0.4948,0.6862,90,90,120 - - 9.48 A 8545
B-Co-Tm TmCo4B4 CeCo 4B4,tP18,137 P42 /nmc 0.5009,0.5009,0.698,90,90,90 - - 8.49 A 6989
B-Co-Tm Tm2Co7B3 Ce2Co7B3 ,hP24,191 P6/mmm 0.5002,0.5002,1.285,90,90,120 - - 9.34 A 8545
B-Co-Tm Tm3Co11B4 Ce3Co11B4 ,hP18,191 P6/mmm 0.501,0.501,0.9851,90,90,120 - - 9.29 A 28984
B-Co-Tm Tm4CoB13 Er4NiB13,tP36,128 P4/mnc 0.7057,0.7057,0.7737,90,90,90 - - 7.54 A 24679
B-Co-U UCoB4 YCrB4,oP24,55 Pbam 0.5883,1.1402,0.343,90,90,90 - - 9.82 A 12511
B-Co-U UCo3B2 rt CeCo 3B2,hP6,191 P6/mmm 0.4956,0.4956,0.3072,90,90,120 - - 11.09 X 8176
B-Co-U UCo4B CeCo 4B,hP12,191 P6/mmm 0.4899,0.4899,0.6939,90,90,120 - - 11.16 A 8176
B-Co-U UCo4B4 CeCo 4B4,tP18,137 P42 /nmc 0.5097,0.5097,0.7037,90,90,90 - - 9.39 X 11544
B-Co-U U2Co21B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0575,1.0575,1.0575,90,90,90 - - 9.99 X 2626
B-Co-U U3Co7B2 Dy3Ni7B2,hP24,194 P63 /mmc 0.498,0.498,1.3947,90,90,120 Laves-CaCu5 - 12.73 X 13273
B-Co-V VCoB3 VCoB3,oS20,63 Cmcm 0.304,1.755,0.298,90,90,90 - - 5.95 X 7409
B-Co-V V0.26 Co1.74 B CuAl2,tI12,140 I4/mcm 0.5046,0.5046,0.4231,90,90,90 - - 7.81 A 7409
B-Co-V V3Co20B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0497,1.0497,1.0497,90,90,90 - - 8.02 A 2859
B-Co-W WCoB TiNiSi,oP12,62 Pnma 0.5745,0.3203,0.6652,90,90,90 AlB2 family - 13.76 X 4665
B-Co-W W0.9 Co0.1B ht TlI,oS8,63 Cmcm 0.3163,0.841,0.3073,90,90,90 CrB(TlI)-FeB - 14.80 A 3195
B-Co-W W2CoB2 W2CoB2,oI10,71 Immm 0.3177,0.4561,0.7075,90,90,90 - - 14.52 X 3200
B-Co-W W2Co21B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0498,1.0498,1.0498,90,90,90 - - 9.59 X 3118
B-Co-W W3CoB3 W3CoB3,oS28,63 Cmcm 0.317,0.8422,1.0728,90,90,90 - - 14.91 X 4792
B-Co-Y YCoB4 YCrB4,oP24,55 Pbam 0.5878,1.148,0.341,90,90,90 - - 5.52 A 11028
B-Co-Y YCo12B6 SrNi12B6,hR57,166 R-3m 0.9443,0.9443,0.7435,90,90,120 - - 7.47 A 30324
B-Co-Y YCo2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3561,0.3561,0.9358,90,90,90 - - 6.39 X 7255
B-Co-Y YCo3B2 CeCo 3B2,hP6,191 P6/mmm 0.5051,0.5051,0.3035,90,90,120 - - 7.12 X 28865
B-Co-Y YCo4B CeCo 4B,hP12,191 P6/mmm 0.502,0.502,0.6893,90,90,120 - - 7.41 X 38921
B-Co-Y YCo4B4 CeCo 4B4,tP18,137 P42 /nmc 0.5038,0.5038,0.7014,90,90,90 - - 6.86 A 26059
B-Co-Y Y2Co14B Nd2Fe14B,tP68,136 P42 /mnm 0.861,0.861,1.174,90,90,90 - - 7.74 A 27815
B-Co-Y Y2Co7B3 Ce2Co7B3 ,hP24,191 P6/mmm 0.5036,0.5036,1.2899,90,90,120 - - 7.30 X 38946
B-Co-Y Y3Co11B4 Ce3Co11B4 ,hP18,191 P6/mmm 0.5041,0.5041,0.9853,90,90,120 - - 7.34 X 38946
B-Co-Y Y3Co13B2 Nd3Ni13B2 ,hP18,191 P6/mmm 0.5006,0.5006,1.0851,90,90,120 - - 7.44 A 45452
B-Co-Y Y4CoB13 Er4NiB13,tP36,128 P4/mnc 0.71,0.71,0.7971,90,90,90 - - 4.59 X 24679
B-Co-Y Y5Co2B6 Pr5Co2B6,hR39,166 R-3m 0.5422,0.5422,2.386,90,90,120 - - 5.14 A 23385
B-Co-Yb YbCoB4 YCrB4,oP24,55 Pbam 0.5857,1.1343,0.336,90,90,90 - - 8.19 X 43673
B-Co-Yb YbCo3B2 CeCo 3B2,hP6,191 P6/mmm 0.4985,0.4985,0.302,90,90,120 - - 9.49 X 7662
B-Co-Yb YbCo4B4 CeCo 4B4,tP18,137 P42 /nmc 0.4989,0.4989,0.6979,90,90,90 - - 8.64 X 14664
B-Co-Zr ZrCo 3B2 ZrCo 3B2,hR54,148 R-3 0.8418,0.8418,0.9132,90,90,120 - - 7.72 X 6260
B-Co-Zr Zr2Co21B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0607,1.0607,1.0607,90,90,90 - - 8.27 A 16223
B-Cr-Dy DyCrB4 YCrB4,oP24,55 Pbam 0.5792,1.148,0.3451,90,90,90 - - 7.46 A 5557
B-Cr-Er ErCrB4 YCrB4,oP24,55 Pbam 0.5774,1.144,0.3433,90,90,90 - - 7.69 A 5557
B-Cr-Er Er3CrB7 Er3CrB7,oS44,63 Cmcm 0.34201,1.5678,0.9307,90,90,90 - - 8.38 X 18520
B-Cr-Fe Cr0.4 Fe0.6 B FeB-b,oP8,62 Pnma 0.558,0.295,0.4157,90,90,90 CrB(TlI)-FeB - 6.32 A 20542
B-Cr-Fe Cr0.9 Fe1.1 B Mg2Cu,oF48,70 Fddd 0.422,0.732,1.457,90,90,90 - - 7.03 X 2092
B-Cr-Gd GdCrB4 YCrB4,oP24,55 Pbam 0.5953,1.1527,0.3494,90,90,90 - - 6.99 A 12511
B-Cr-H H16CrB6 H16CrB6,aP7,2 P-1 0.43898,0.5694,0.9023,105.192,93.81,111.102 - blue 1.11 X 48411
B-Cr-Ho HoCrB4 YCrB4,oP24,55 Pbam 0.5774,1.148,0.3444,90,90,90 - - 7.57 A 5557
B-Cr-Ho Ho3CrB7 Er3CrB7,oS44,63 Cmcm 0.3422,1.5714,0.9304,90,90,90 - - 8.26 X 27953
B-Cr-Ir Cr2IrB2 orth1 Mo2IrB2,oP20,58 Pnnm 0.7112,0.921,0.29833,90,90,90 - - 10.80 X 51406
B-Cr-Ir Cr2IrB2 orth2 Cr2IrB2,oS40,63 Cmcm 0.30024,0.9945,1.3236,90,90,90 - - 10.68 X 51406
B-Cr-Ir Cr7.9 Ir14.1 B6 Cr23C6,cF116,225 Fm-3m 1.1202,1.1202,1.1202,90,90,90 - - 15.05 X 51406
B-Cr-Lu LuCrB4 YCrB4,oP24,55 Pbam 0.5726,1.138,0.3404,90,90,90 - - 8.09 A 5557
B-Cr-Mg Mg0.98 Cr0.02 B2 AlB2,hP3,191 P6/mmm 0.3087,0.3087,0.35233,90,90,120 AlB2 family - 2.66 X 45427
B-Cr-Mn Cr0.5Mn0.5 B FeB-b,oP8,62 Pnma 0.56,0.2931,0.4183,90,90,90 CrB(TlI)-FeB - 6.22 A 14483
B-Cr-Mn Cr0.61 Mn0.39 B2 AlB2,hP3,191 P6/mmm 0.2987,0.2987,0.3057,90,90,120 AlB2 family - 5.26 X 4886
B-Cr-Mn Cr0.667Mn1.333 B0.667 Mg2Cu,oF48,70 Fddd 0.424,0.732,1.458,90,90,90 - - 6.76 A 4886
B-Cr-Mn Cr0.8Mn0.2 B TlI,oS8,63 Cmcm 0.2931,0.7839,0.2971,90,90,90 CrB(TlI)-FeB - 6.17 A 4886
B-Cr-Mn Cr2.02 Mn0.98 B4 Ta3B4,oI14,71 Immm 0.295,0.301,1.29,90,90,90 - - 5.86 A 4886
B-Cr-Mn Cr4.6Mn0.4 B3 Cr5B3,tI32,140 I4/mcm 0.5461,0.5461,1.0088,90,90,90 - - 6.48 A 4886
B-Cr-Mo CrMo2B2 Mo2FeB2,tP10,127 P4/mbm 0.5825,0.5825,0.3115,90,90,90 - - 8.34 A 4865
B-Cr-Mo Cr0.2Mo0.8 B TlI,oS8,63 Cmcm 0.3139,0.8406,0.307,90,90,90 CrB(TlI)-FeB - 8.03 A 4865
B-Cr-Mo Cr0.3Mo0.7 B2 AlB2,hP3,191 P6/mmm 0.3028,0.3028,0.3129,90,90,120 AlB2 family - 6.98 X 20460
B-Cr-Mo Cr0.3Mo1.7 B CuAl2,tI12,140 I4/mcm 0.5517,0.5517,0.4704,90,90,90 - - 8.79 A 4865
B-Cr-Mo Cr1.16 Mo3.84 B3 Cr5B3,tI32,140 I4/mcm 0.5753,0.5753,1.0865,90,90,90 - - 8.52 A 4865
B-Cr-Mo Cr1.76 Mo0.24 B CuAl2,tI12,140 I4/mcm 0.5215,0.5215,0.4352,90,90,90 - - 7.03 A 4865
B-Cr-Mo Cr1.82 Mo0.18 B Mg2Cu,oF48,70 Fddd 0.4293,0.7409,1.5003,90,90,90 - - 6.83 A 4865
B-Cr-Mo Cr2.4Mo0.6 B4 Ta3B4,oI14,71 Immm 0.29783,0.30628,1.314,90,90,90 - - 6.25 A 30290
B-Cr-Nb Nb0.21 Cr2.79 B4 Ta3B4,oI14,71 Immm 0.2958,0.3015,1.3025,90,90,90 - - 5.94 A 37707
B-Cr-Nb Nb0.55 Cr0.45 B2 AlB2,hP3,191 P6/mmm 0.305,0.305,0.3268,90,90,120 AlB2 family - 6.06 X 4865
B-Cr-Nb Nb1.75 Cr1.25 B2 U3Si2,tP10,127 P4/mbm 0.59,0.59,0.325,90,90,90 - - 7.32 A 4865
B-Cr-Nd NdCrB4 YCrB4,oP24,55 Pbam 0.6025,1.169,0.3547,90,90,90 - - 6.37 A 10614
B-Cr-Nd NdCr2B6 CeCr2B6,oI18,71 Immm 0.3113,0.6597,0.8319,90,90,90 - - 6.09 A 8991
B-Cr-Ni Cr1.5 Ni0.5 B3 V2B3,oS20,63 Cmcm 0.3034,1.811,0.2956,90,90,90 - - 5.72 X 6703
B-Cr-Ni Cr2Ni3B6 V5B6,oS22,65 Cmmm 0.2971,2.034,0.3011,90,90,90 - - 6.30 X 6703
Handbook of Inorganic Substances – Edition 2015 : Data 283

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Cr-O Cr[BO3] rt Ca[CO3],hR30,167 R-3c 0.456,0.456,1.461,90,90,120 - green 4.20 A 51089


B-Cr-O Cr3BO6 Mg3 [SiO4][OH]2,oP40,62 Pnma 0.98552,0.84007,0.44138,90,90,90 - gray green 4.78 X 39008
B-Cr-Os Cr0.67 Os0.33 B FeB-b,oP8,62 Pnma 0.5713,0.2944,0.424,90,90,90 CrB(TlI)-FeB - 10.10 A 6887
B-Cr-P Cr3B0.2P 0.8 Ni3P,tI32,82 I-4 0.9134,0.9134,0.4545,90,90,90 - - 6.41 A 1626
B-Cr-P Cr4.5 BP2 W5Si3,tI32,140 I4/mcm 0.8824,0.8824,0.4504,90,90,90 - - 5.81 A 6167
B-Cr-P Cr5B2P Cr5B3,tI32,140 I4/mcm 0.5593,0.5593,1.037,90,90,90 - - 6.40 A 6167
B-Cr-Pr PrCrB4 YCrB4,oP24,55 Pbam 0.6058,1.172,0.3563,90,90,90 - - 6.20 A 10614
B-Cr-Pr PrCr2B6 CeCr2B6,oI18,71 Immm 0.3136,0.6611,0.8325,90,90,90 - - 5.96 A 8991
B-Cr-Re Cr0.25 Re0.75 B MoB,tI16,141 I41/amd 0.2997,0.2997,1.6515,90,90,90 - - 14.64 X 4864
B-Cr-Re Cr0.4 Re2.6B Re3B,oS16,63 Cmcm 0.2887,0.9306,0.7242,90,90,90 - - 17.61 A 4864
B-Cr-Re Cr0.5 Re1.5B Mg2 Cu,oF48,70 Fddd 0.4473,0.7709,1.5651,90,90,90 - - 15.56 A 4864
B-Cr-Re Cr0.5 Re6.5B3 Th7Fe3,hP20,186 P63mc 0.7489,0.7489,0.486,90,90,120 - - 17.85 A 4864
B-Cr-Re Cr0.6 Re0.4B FeB-b,oP8,62 Pnma 0.5749,0.2973,0.4297,90,90,90 CrB(TlI)-FeB - 10.54 X 4864
B-Cr-Re Cr0.9 Re0.1B TlI,oS8,63 Cmcm 0.2992,0.7899,0.2948,90,90,90 CrB(TlI)-FeB - 7.27 A 4864
B-Cr-Rh Cr0.78 Rh6.22 B3 Th7Fe3,hP20,186 P63mc 0.74386,0.74386,0.47541,90,90,120 - - 10.40 X 57499
B-Cr-Ru CrRu6B3 Th7Fe3,hP20,186 P63mc 0.7411,0.7411,0.4693,90,90,120 - - 10.28 A 58945
B-Cr-Ru Cr0.5 Ru0.5B FeB-b,oP8,62 Pnma 0.5713,0.2953,0.4251,90,90,90 CrB(TlI)-FeB - 8.09 X 6887
B-Cr-Sc Sc0.05 Cr0.95 B2 AlB2 ,hP3,191 P6/mmm 0.29802,0.29802,0.3113,90,90,120 AlB2 family - 5.11 X 43512
B-Cr-Sc Sc0.80 Cr0.20 B2 AlB2 ,hP3,191 P6/mmm 0.31205,0.31205,0.3461,90,90,120 AlB2 family - 3.87 X 43512
B-Cr-Sc Sc2CrB6 Y2ReB6,oP36,55 Pbam 0.87909,1.10541,0.32996,90,90,90 - - 4.28 X 43512
B-Cr-Sc Sc4.3 Cr1.7 B0.4 m W4Co2C,cF112,227 Fd-3m 1.233,1.233,1.233,90,90,90 η-carbide - 4.05 A 10007
B-Cr-Si Cr5Si2.58 B0.42 rt W5Si3,tI32,140 I4/mcm 0.916,0.916,0.458,90,90,90 - - 5.82 A 790
B-Cr-Si Cr5Si3B CuHf5Sn3,hP18,193 P63/mcm 0.706,0.706,0.473,90,90,120 AlB2 family - 5.78 A 995
B-Cr-Sm SmCrB4 YCrB4,oP24,55 Pbam 0.5993,1.161,0.3511,90,90,90 - - 6.68 A 10614
B-Cr-Sm SmCr2B6 CeCr2B6,oI18,71 Immm 0.3102,0.6571,0.8306,90,90,90 - - 6.26 A 8991
B-Cr-Ta Ta0.42 Cr2.58 B4 Ta3B4,oI14,71 Immm 0.2964,0.3021,1.3028,90,90,90 - - 7.21 A 37707
B-Cr-Ta Ta0.5 Cr0.5B2 AlB2 ,hP3,191 P6/mmm 0.3025,0.3025,0.321,90,90,120 AlB2 family - 9.01 X 599
B-Cr-Ta Ta2CrB2 rt U3Si2,tP10,127 P4/mbm 0.5905,0.5905,0.3231,90,90,90 - - 12.84 A 7463
B-Cr-Tb TbCrB4 YCrB4,oP24,55 Pbam 0.5832,1.151,0.3463,90,90,90 - - 7.26 A 5557
B-Cr-Th ThCrB4 YCrB4,oP24,55 Pbam 0.6058,1.1712,0.364,90,90,90 - gray dark 8.42 X 31723
B-Cr-Th ThCr2B6 CeCr2B6,oI18,71 Immm 0.3158,0.6591,0.8364,90,90,90 - gray dark 7.65 X 31723
B-Cr-Ti Ti0.09 Cr2.91 B4 Ta3B4,oI14,71 Immm 0.2918,0.2956,1.2929,90,90,90 - - 5.92 A 37707
B-Cr-Ti Ti0.5 Cr0.5 B2 AlB2 ,hP3,191 P6/mmm 0.299,0.299,0.314,90,90,120 AlB2 family - 4.89 X 599
B-Cr-Tm TmCrB4 YCrB4,oP24,55 Pbam 0.5893,1.14,0.3712,90,90,90 - - 7.04 A 31667
B-Cr-U UCrB4 YCrB4,oP24,55 Pbam 0.5891,1.1413,0.3497,90,90,90 - - 9.42 A 12511
B-Cr-V V0.15 Cr0.85 B2 AlB2 ,hP3,191 P6/mmm 0.2975,0.2975,0.3058,90,90,120 AlB2 family - 5.20 X 20460
B-Cr-V V0.2 Cr1.8 B CuAl2,tI12,140 I4/mcm 0.5188,0.5188,0.4318,90,90,90 - - 6.55 A 4865
B-Cr-V V0.33 Cr2.67 B4 Ta3B4,oI14,71 Immm 0.2952,0.3002,1.3008,90,90,90 - - 5.73 A 37707
B-Cr-V V0.4 Cr0.6 B TlI,oS8,63 Cmcm 0.3,0.798,0.295,90,90,90 CrB(TlI)-FeB - 5.87 A 4865
B-Cr-V V1.6 Cr3.4 B3 Cr5B3,tI32,140 I4/mcm 0.5509,0.5509,1.019,90,90,90 - - 6.24 A 4865
B-Cr-V V2.25 Cr0.75 B2 U3Si2,tP10,127 P4/mbm 0.566,0.566,0.2999,90,90,90 - - 6.06 A 4865
B-Cr-W Cr0.14 W0.86 B rt MoB,tI16,141 I41/amd 0.3096,0.3096,1.676,90,90,90 - - 14.57 A 4267
B-Cr-W Cr0.6W0.4 B TlI,oS8,63 Cmcm 0.3065,0.8112,0.299,90,90,90 CrB(TlI)-FeB - 10.32 A 4267
B-Cr-W Cr0.94 W0.06 B2 AlB2 ,hP3,191 P6/mmm 0.2985,0.2985,0.3098,90,90,120 AlB2 family - 5.66 X 4267
B-Cr-W Cr1.5W0.5 B CuAl2,tI12,140 I4/mcm 0.5277,0.5277,0.442,90,90,90 - - 9.75 A 4267
B-Cr-W Cr1.8W3.2 B3 Cr5B3,tI32,140 I4/mcm 0.5699,0.5699,1.088,90,90,90 - - 13.43 A 4267
B-Cr-W Cr1.91 W0.09 B Mg2 Cu,oF48,70 Fddd 0.4287,0.7387,1.4957,90,90,90 - - 7.11 A 4267
B-Cr-W Cr2.4W0.6 B4 Ta3B4,oI14,71 Immm 0.2984,0.307,1.3193,90,90,90 - - 7.65 X 30290
B-Cr-Y YCrB4 YCrB4,oP24,55 Pbam 0.5972,1.146,0.3461,90,90,90 - - 5.16 X 5557
B-Cr-Yb YbCrB4 YCrB4,oP24,55 Pbam 0.5861,1.1359,0.3423,90,90,90 - - 7.82 A 31667
B-Cs-D Cs[BD4] NaCl,cF8,225 Fm-3m 0.74061,0.74061,0.74061,90,90,90 rocksalt family - 2.48 X 43158
B-Cs-D D6CsB6 ht H6CsB6,cF104,225 Fm-3m 1.14125,1.14125,1.14125,90,90,90 - - 1.88 X 56916
B-Cs-D D6CsB6 rt H6KB6,cF56,202 Fm-3 1.12589,1.12589,1.12589,90,90,90 - - 1.95 X 56916
B-Cs-F Cs[BF4] hp-ht *,cF*,225 Fm-3m 0.7859,0.7859,0.7859,90,90,90 - - - N 6102
B-Cs-F Cs[BF4] rt Ba[SO4],oP24,62 Pnma 0.966,0.58952,0.76372,90,90,90 - colorless 3.36 X 40913
B-Cs-H Cs[BH4] lt NaCl,cF8,225 Fm-3m 0.7419,0.7419,0.7419,90,90,90 rocksalt family - 2.40 X 624
B-Cs-H H14CsB9 H14CsB9,aP20,2 P-1 0.5686,0.878,0.98767,87.529,82.014,82.53 - colorless 1.68 X 6730
B-Cs-H H18CsB21 H18CsB21,mP88,14 P121/c1 0.72046,0.97307,2.2674,90,93.081,90 - colorless 1.58 X 59502
B-Cs-H H3CsB3 H3KB3,cF32,225 Fm-3m 0.9564,0.9564,0.9564,90,90,90 - - 2.56 X 20643
B-Cs-H H6CsB6 H6KB6,cF56,202 Fm-3 1.12812,1.12812,1.12812,90,90,90 - colorless 1.89 X 38220
B-Cs-H H8CsB3 H8CsB3,oS16,40 Ama2 0.88723,0.86692,0.74299,90,90,90 - colorless 2.02 X 22970
B-Cs-I CsB6I6 CsB6Cl6,hR156,148 R-3 1.04705,1.04705,5.0183,90,90,120 - - 4.01 X 43939
B-Cs-O CsBO2 KBO2,hR72,167 R-3c 1.3637,1.3637,0.8365,90,90,120 - colorless 3.90 X 29538
B-Cs-O CsB3O5 CsB3O5,oP36,19 P212121 0.6213,0.8521,0.917,90,90,90 - - 3.36 X 7901
B-Cs-O CsB5O8 ht1 KB5 O8-a,oP112,61 Pbca 0.8697,0.8431,2.141,90,90,90 - colorless 2.67 X 39186
B-Cs-O CsB5O8 ht2 KB5 O8-b,oP112,61 Pbca 0.78131,1.20652,1.49582,90,90,90 - - 2.97 X 48247
B-Cs-O CsB5O8 ht3 CsB5O8,mP56,14 P121/c1 0.7117,0.9634,1.14016,90,116.604,90 - colorless 2.99 X 39186
B-Cs-O CsB9O14 CsB9O14,oP96,17 P222 1 0.8732,0.8767,1.5736,90,90,90 - colorless 2.50 X 41992
B-Cs-O Cs3B13O21 Cs3B13O21,mS592,15 C12/c1 2.3064,1.3367,2.4464,90,90.281,90 - colorless 3.08 X 40796
B-Cs-O Cs3B7O12 Cs3B7O12,mS1748,15 C12/c1 5.9911,1.152,3.4525,90,101.052,90 - colorless 3.41 X 42295
B-Cs-O Cs3[BO3] Cs3[BO3],oP56,55 Pbam 1.09364,1.09779,1.03564,90,90,90 - colorless 4.89 X 57500
B-Cs-P Cs3BP2 K3BP 2,mS24,15 C12/c1 0.9834,0.9674,0.9859,90,109.77,90 - orange 3.55 X 24285
B-Cs-S CsBS2 CsBS2,tI80,142 I41/acd 0.727,0.727,3.5737,90,90,90 - colorless 2.92 X 31037
B-Cs-S Cs3BS3 Rb3BS3,mP28,14 P121/c1 1.0397,0.666,1.3618,90,101.31,90 - colorless 3.63 X 41091
B-Cs-S Cs4B9S9 Rb4B9Se9,aP44,2 P-1 1.0369,1.033,1.0833,91.91,103.64,109.51 - white 2.89 X 42262
B-Cs-Se CsBSe 3 TlBS3,mP20,14 P121/c1 0.757,1.2791,0.6171,90,107.09,90 - red deep 4.43 X 39104
B-Cs-Se Cs3B3Se10 Tl3B3S10,aP32,2 P-1 0.7583,0.8464,1.5276,107.03,89.29,101.19 - yellow 4.41 X 39535
B-Cs-Se Cs4B9Se9 Rb4B9Se9,aP44,2 P-1 1.0747,1.0711,1.1144,91.61,103.59,109.59 - colorless 3.81 X 32741
284 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Cu-H H5CuB5 H5CuB5,oP96,61 Pbca 1.011,1.45,1.136,90,90,90 - colorless 1.96 X 1686


B-Cu-Ir CuIrB CuIrB,oF48,43 Fdd2 0.8728,0.9963,0.6483,90,90,90 - gray 12.56 X 28771
B-Cu-Ir CuIr2B1.5 CuIr2B1.5 ,oS20,63 Cmcm 0.28321,2.5406,0.28106,90,90,90 - gray 15.25 X 38226
B-Cu-Mg Mg0.97 Cu0.03 B1.94 AlB2,hP3,191 P6/mmm 0.3079,0.3079,0.352,90,90,120 AlB2 family - 2.67 X 54885
B-Cu-O CuBO2 tf CuFeO2,hR12,166 R-3m 0.284,0.284,1.652,90,90,120 - - 4.59 A 48064
B-Cu-O CuB2O4 rt CuB2O4,tI84,122 I-42d 1.1506,1.1506,0.5644,90,90,90 santarosaite blue 3.98 X 14449
B-Cu-O CuB4O7 hp ZnB4O7,oS48,63 Cmcm 1.082,0.6463,0.512,90,90,90 - blue 4.06 X 51397
B-Cu-O Cu2B4O7 rt *,t*78,* - 1.15,1.15,0.562,90,90,90 - blue 3.78 N 5963
B-Cu-O Cu3B2O6 Cu3B2O6,aP110,2 P-1 0.3353,1.83901,1.84094,96.637,90.312,90.824 - - 4.54 X 14948
B-Cu-O Cu3[BO3]2 mon Cu3B2O6,mP136,14 P121/c1 1.782,0.85232,0.91706,90,95.913,90 - green 4.43 X 51707
B-Cu-S CuBS2 CuFeS2,tI16,122 I-42d 0.5044,0.5044,0.8947,90,90,90 adamantane structure gray light 4.04 X 49171
B-Cu-S Cu5BS4 *,cF60,225 Fm-3m 0.964,0.964,0.964,90,90,90 - - - N 3495
B-Cu-Sc Cu0.77 Sc2B45 Cu0.77 Sc2B45,tP208,76 P41 1.02674,1.02674,1.4261,90,90,90 - black 2.76 X 57323
B-D-K K[BD4] lt Na[BH4],tP12,137 P42 /nmc 0.46836,0.46836,0.65707,90,90,90 - - 1.34 X 43158
B-D-K K[BD4] rt NaCl,cF8,225 Fm-3m 0.67074,0.67074,0.67074,90,90,90 rocksalt family - 1.28 X 43158
B-D-Li Li[BD4] ht Li[BH4],hP12,186 P63 mc 0.42667,0.42667,0.69223,90,90,120 - - 0.79 X 48931
B-D-Li Li[BD4] rt Li[BH4],oP24,62 Pnma 0.71914,0.44256,0.68641,90,90,90 - - 0.78 X 48931
B-D-Mg Mg[BD4]2 ht Mg[BH4]2 ,oF192,70 Fddd 1.08595,1.84919,3.70489,90,90,90 - - 0.89 X 56773
B-D-Mg Mg[BD4]2 rt Mg[BH4]2 ,hP90,169 P61 1.03182,1.03182,3.69983,90,90,120 - - 0.91 X 47818
B-D-N D3B[ND3] hp [NH3BH3],oS8,36 Cmc21 0.5993,0.64328,0.59658,90,90,90 - - 1.07 X 53953
B-D-N D3B[ND3] lt [NH3BH3],oP4,31 Pmn21 0.5445,0.48421,0.50075,90,90,90 - - 0.93 X 50262
B-D-N D3B[ND3] rt [NH3BH3],tI4,107 I4mm 0.52281,0.52281,0.50218,90,90,90 - - 0.89 X 49992
B-D-Na Na[BD4] lt Na[BH4],tP12,137 P42 /nmc 0.4332,0.4332,0.5869,90,90,90 - - 1.26 X 43657
B-D-Na Na[BD4] rt NaCl,cF8,225 Fm-3m 0.6148,0.6148,0.6148,90,90,90 - - 1.20 X 43657
B-D-O D3[BO3] H3[BO3],aP16,2 P-1 0.6578,0.7039,0.7053,119.83,92.58,101.17 - - 1.57 X 2887
B-D-Rb Rb[BD4] NaCl,cF8,225 Fm-3m 0.70156,0.70156,0.70156,90,90,90 rocksalt family - 2.01 X 43158
B-D-Y Y[BD4]3 ht Y[BH4]3,cF32,226 Fm-3c 1.10086,1.10086,1.10086,90,90,90 - - 1.45 X 54555
B-D-Y Y[BD4]3 rt Y[BH4]3,cP32,205 Pa-3 1.08522,1.08522,1.08522,90,90,90 - - 1.51 X 54555
B-Dy-Fe DyFeB4 YCrB4,oP24,55 Pbam 0.5885,1.138,0.3403,90,90,90 - - 7.62 A 16595
B-Dy-Fe DyFe1.4 B0.6 rt MgCu2,cF24,227 Fd-3m 0.7383,0.7383,0.7383,90,90,90 Friauf-Laves phase - 8.16 X 22472
B-Dy-Fe DyFe2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3537,0.3537,0.9441,90,90,90 - - 8.32 X 11486
B-Dy-Fe Dy2Fe14B Nd2Fe14B,tP68,136 P42 /mnm 0.876,0.876,1.2013,90,90,90 - - 8.05 X 18006
B-Dy-Fe Dy3FeB7 Er3CrB7,oS44,63 Cmcm 0.3375,1.554,0.9403,90,90,90 - - 8.34 A 19085
B-Dy-Fe Dy5Fe2B6 Pr5Co2B6,hR39,166 R-3m 0.5427,0.5427,2.313,90,90,120 - - 8.35 A 19086
B-Dy-Ge Dy5Ge3B CuHf5Sn3,hP18,193 P63 /mcm 0.842,0.842,0.632,90,90,120 AlB2 family - 8.91 A 8292
B-Dy-H Dy[BH4]3 *,cP128,205 Pa-3 1.0885,1.0885,1.0885,90,90,90 - - 2.13 N 51239
B-Dy-Ir DyIr2B2 CaRh2B2,oF40,70 Fddd 0.5749,0.9242,1.0838,90,90,90 - - 13.12 A 24867
B-Dy-Ir DyIr3B2 ErIr3B2,mS12,12 C12/m1 0.5437,0.9393,0.3106,90,91.1,90 - - 15.93 A 14265
B-Dy-Mn DyMnB4 YCrB4,oP24,55 Pbam 0.5897,1.139,0.3439,90,90,90 - - 7.50 A 5216
B-Dy-Mn Dy3MnB7 Er3CrB7,oS44,63 Cmcm 0.3434,1.5745,0.9329,90,90,90 - - 8.14 X 24692
B-Dy-Mo DyMoB3 ErMoB3,mP10,11 P121/m1 0.5385,0.3186,0.6724,90,101.66,90 - - 8.55 A 21849
B-Dy-Mo DyMoB4 YCrB4,oP24,55 Pbam 0.6033,1.164,0.3596,90,90,90 - - 7.94 A 6640
B-Dy-Mo DyMo3B7 YMo3B7,oP44,62 Pnma 1.1012,0.3099,1.2865,90,90,90 - - 7.96 A 30110
B-Dy-Mo Dy3MoB7 Er3CrB7,oS44,63 Cmcm 0.348,1.5942,0.9493,90,90,90 - - 8.31 A 21849
B-Dy-Ni DyNiB4 ErNiB4,tI48,139 I4/mmm 0.7536,0.7536,0.8522,90,90,90 - - 7.26 A 17494
B-Dy-Ni DyNi12B6 orth CeNi12B6,oS76,36 Cmc21 0.9534,0.7367,1.0983,90,90,90 - - 8.02 A 20086
B-Dy-Ni DyNi12B6 rhom SrNi12B6,hR57,166 R-3m 0.952,0.952,0.741,90,90,120 - - 7.98 A 14139
B-Dy-Ni DyNi2B2 HoNi2B2,mS20,15 C12/c1 0.8382,0.5222,0.689,90,127.11,90 AlB2 family - 8.33 A 24693
B-Dy-Ni DyNi4B CeCo 4B,hP12,191 P6/mmm 0.4977,0.4977,0.694,90,90,120 - - 9.10 A 15185
B-Dy-Ni Dy2NiB10 Th2NiB10,oP26,55 Pbam 0.5549,1.1094,0.4144,90,90,90 - - 6.40 A 37695
B-Dy-Ni Dy2Ni10B5 Ho2Ni10B5 ,oP136,61 Pbca 0.901,0.947,1.7602,90,90,90 - - 8.55 A 24694
B-Dy-Ni Dy2Ni15B6 Ho2Ni15B6 ,mP138,14 P121/c1 1.4201,1.0649,0.9578,90,94.57,90 - - 8.77 A 24729
B-Dy-Ni Dy2Ni15B9 Ho2Ni15B9 ,oS208,64 Cmce 1.5895,1.1573,1.1229,90,90,90 - - 8.38 A 24710
B-Dy-Ni Dy2Ni3B6 Lu2Ni3B6,oS22,65 Cmmm 0.7732,0.8632,0.3476,90,90,90 - - 8.10 A 22279
B-Dy-Ni Dy3Ni13B2 Nd3Ni13B2 ,hP18,191 P6/mmm 0.4949,0.4949,1.0909,90,90,120 - - 9.13 X 16066
B-Dy-Ni Dy3Ni19B10 Ho3Ni19B10 ,mS64,12 C12/m1 1.3172,0.8734,0.5785,90,91.31,90 - - 8.54 A 24670
B-Dy-Ni Dy3Ni7B2 Dy3Ni7B2,hP24,194 P63 /mmc 0.5078,0.5078,1.4331,90,90,120 Laves-CaCu5 - 9.55 X 13206
B-Dy-Ni Dy4NiB13 Er4NiB13,tP36,128 P4/mnc 0.721,0.721,0.7516,90,90,90 - - 7.22 A 16590
B-Dy-O DyB3O6 DyB3O6,oP160,62 Pnma 1.593,0.7402,1.2264,90,90,90 - colorless 5.35 X 44103
B-Dy-O DyB5O9 GdB5O9,tI240,142 I41/acd 0.82033,0.82033,3.35165,90,90,90 - - 4.25 A 39962
B-Dy-O Dy[BO3] hp-ht1 Dy[BO3],aP60,2 P-1 0.724,0.9011,0.9872,81.4,85.67,77.02 - colorless 7.11 X 40503
B-Dy-O Dy[BO3] hp-ht2 Eu[BO3],aP20,2 P-1 0.61463,0.63856,0.63894,92.52,107.65,108.29 - colorless 6.56 X 42570
B-Dy-O Dy[BO3] ht2 Y[BO3],hP18,194 P63 /mmc 0.3793,0.3793,0.8847,90,90,120 - - 6.67 X 1908
B-Dy-O Dy2B4O9 Dy2B4O9,aP30,2 P-1 0.6162,0.6428,0.7485,102.54,97.08,102.45 - colorless 6.12 X 41862
B-Dy-O Dy4B6O15 hp Ho4B6O15 ,mS100,15 C12/c1 1.1694,0.4378,1.893,90,96.66,90 - colorless 6.59 X 40121
B-Dy-Os DyOsB2 LuRuB2,oP16,62 Pnma 0.5869,0.5297,0.6369,90,90,90 - - 12.56 A 13562
B-Dy-Os DyOsB4 YCrB4,oP24,55 Pbam 0.5954,1.1527,0.3553,90,90,90 - - 10.79 A 12511
B-Dy-Os Dy2OsB6 Y2ReB6,oP36,55 Pbam 0.91542,1.15211,0.36435,90,90,90 - - 10.03 A 17266
B-Dy-Pd DyPd3B CaTiO3,cP5,221 Pm-3m 0.4132,0.4132,0.4132,90,90,90 perovskite family - 11.59 X 15209
B-Dy-Re DyReB4 YCrB4,oP24,55 Pbam 0.5977,1.155,0.3572,90,90,90 - - 10.56 A 6640
B-Dy-Re DyRe11B *,c**,* - 1.062,1.062,1.062,90,90,90 - - - N 14666
B-Dy-Re DyRe4B4 *,t**,* - 0.7408,0.7408,1.051,90,90,90 - - - N 14666
B-Dy-Re Dy2ReB6 Y2ReB6,oP36,55 Pbam 0.9157,1.154,0.3672,90,90,90 - - 9.86 A 7007
B-Dy-Re Dy3ReB7 Er3CrB7,oS44,63 Cmcm 0.3557,1.5789,0.9359,90,90,90 - - 9.47 A 19085
B-Dy-Rh DyRhB4 YCrB4,oP24,55 Pbam 0.59554,1.15525,0.35492,90,90,90 - - 8.40 A 50916
B-Dy-Rh DyRh3B CaTiO3,cP5,221 Pm-3m 0.4168,0.4168,0.4168,90,90,90 perovskite family - 11.05 X 17128
B-Dy-Rh DyRh3B2 ErIr3B2,mS12,12 C12/m1 0.5379,0.9331,0.3093,90,90.9,90 - - 10.54 A 14265
B-Dy-Rh DyRh4B4 CeCo 4B4,tP18,137 P42 /nmc 0.5302,0.5302,0.7395,90,90,90 - - 9.86 A 13750
Handbook of Inorganic Substances – Edition 2015 : Data 285

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Dy-Rh Dy0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5588,0.5588,0.848,90,90,120 - - 8.94 A 18557


B-Dy-Ru DyRuB2 LuRuB2,oP16,62 Pnma 0.5886,0.53,0.6352,90,90,90 - - 9.56 A 13562
B-Dy-Ru DyRuB4 YCrB4,oP24,55 Pbam 0.5948,1.1513,0.3541,90,90,90 - - 8.40 A 12511
B-Dy-Ru DyRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5485,0.5485,0.3011,90,90,120 - - 10.32 X 13749
B-Dy-Ru DyRu4B4 LuRu4B4,tI72,142 I41/acd 0.7439,0.7439,1.5008,90,90,90 - - 9.76 A 17390
B-Dy-Ru Dy2 RuB6 Y2ReB6,oP36,55 Pbam 0.91433,1.15067,0.36489,90,90,90 - - 8.49 A 17266
B-Dy-S Dy3 B1.67 S7 Cu2U3S7,hP24,173 P63 0.94044,0.94044,0.58855,90,90,120 - brown red 5.38 X 56910
B-Dy-Si DySi0.15 B1.85 AlB2 ,hP3,191 P6/mmm 0.33171,0.33171,0.38824,90,90,120 AlB2 family - 8.38 X 46652
B-Dy-Si Dy0.7 Si3B12.33 Dy0.7 Si3B12.33 ,hR153,166 R-3m 1.00782,1.00782,1.64651,90,90,120 - black 3.42 X 42453
B-Dy-Si Dy5 Si2B8 Y5Si1.9 B8,tP30,127 P4/mbm 0.72209,0.72209,0.80545,90,90,90 - - 7.55 X 45149
B-Dy-Si Dy5 Si3B CuHf5Sn3,hP18,193 P63/mcm 0.83675,0.83675,0.62594,90,90,120 AlB2 family - 7.94 X 47006
B-Dy-V DyVB4 YCrB4,oP24,55 Pbam 0.5966,1.158,0.3475,90,90,90 - - 7.10 A 5216
B-Dy-W DyWB4 YCrB4,oP24,55 Pbam 0.6033,1.165,0.3598,90,90,90 - - 10.23 A 6640
B-Dy-W Dy3 WB7 Er3CrB7,oS44,63 Cmcm 0.3462,1.5955,0.9472,90,90,90 - - 9.48 A 25997
B-Er-Fe ErFeB4 YCrB4,oP24,55 Pbam 0.5861,1.134,0.3377,90,90,90 - - 7.88 A 16595
B-Er-Fe ErFe 2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3515,0.3515,0.9387,90,90,90 - - 8.61 X 11486
B-Er-Fe ErFe 4B CeCo 4B,hP12,191 P6/mmm 0.5047,0.5047,0.6998,90,90,120 - - 8.64 X 21409
B-Er-Fe ErFe 4B4 *,tP666,86 P42/n 0.6989,0.6989,13.71,90,90,90 - - - N 20418
B-Er-Fe Er2Fe 14B Nd2Fe14B,tP68,136 P42/mnm 0.87345,0.87345,1.19549,90,90,90 - - 8.21 X 19043
B-Er-Fe Er3FeB7 Er3CrB7,oS44,63 Cmcm 0.3363,1.5341,0.935,90,90,90 - - 8.72 A 19085
B-Er-Ir ErIr3B2 ErIr3 B2,mS12,12 C12/m1 0.5409,0.9379,0.3101,90,91.2,90 - - 16.17 X 14265
B-Er-Ir ErIr4B4 m CeCo 4B4,tP18,137 P42/nmc 0.5408,0.5408,0.7278,90,90,90 - - 15.28 A 12773
B-Er-Mn ErMnB4 YCrB4,oP24,55 Pbam 0.5868,1.14,0.3424,90,90,90 - - 7.70 A 5216
B-Er-Mn Er3MnB7 Er3CrB7,oS44,63 Cmcm 0.3417,1.557,0.9262,90,90,90 - - 8.52 A 24692
B-Er-Mo ErMoB3 ErMoB3,mP10,11 P121/m1 0.5396,0.31513,0.679,90,101.6,90 - - 8.68 X 22910
B-Er-Mo ErMoB4 YCrB4,oP24,55 Pbam 0.601,1.159,0.3579,90,90,90 - - 8.16 A 6640
B-Er-Mo ErMo3B7 YMo 3B7,oP44,62 Pnma 1.1009,0.3093,1.2818,90,90,90 - - 8.08 A 30110
B-Er-Ni ErNiB4 ht ErNiB4,tI48,139 I4/mmm 0.7505,0.7505,0.8496,90,90,90 - - 7.47 X 17494
B-Er-Ni ErNiB4 rt YCrB4,oP24,55 Pbam 0.5787,1.1543,0.3436,90,90,90 - - 7.79 A 43127
B-Er-Ni ErNi0.07 B3.93 ErNi0.07 B3.93,tP22,127 P4/mbm 0.70984,0.70984,0.38938,90,90,90 - - 7.24 X 43163
B-Er-Ni ErNi2B2 HoNi2B2,mS20,15 C12/c1 0.8345,0.5181,0.6887,90,126.6,90 AlB2 family - 8.51 A 24693
B-Er-Ni ErNi4B CeCo 4B,hP12,191 P6/mmm 0.49614,0.49614,0.6936,90,90,120 - - 9.27 X 48638
B-Er-Ni ErNi6.5B3 *,c**,* - 0.7735,0.7735,0.7735,90,90,90 - - - N 43127
B-Er-Ni ErNi7B3 ErNi7B3,tI88,141 I41/amd 0.76577,0.76577,1.55798,90,90,90 - gray 8.88 X 43504
B-Er-Ni ErNi7.9B2 ht ErNi7.9 B2,mS136,15 C12/c1 1.6626,0.9525,1.0686,90,117.76,90 - - 8.68 X 43678
B-Er-Ni Er0.917 Ni4.09 B Er0.917 Ni4.09 B,hP116,191 P6/mmm 1.48399,1.48399,0.69194,90,90,120 - gray 9.16 X 43504
B-Er-Ni Er1.82 Ni21B6 Cr21 W2C6,cF116,225 Fm-3m 1.0652,1.0652,1.0652,90,90,90 - - 8.80 X 53367
B-Er-Ni Er2Ni10B5 Ho2Ni10B5,oP136,61 Pbca 0.8974,0.944,1.7553,90,90,90 - - 8.72 A 43127
B-Er-Ni Er2Ni15B9 Ho2Ni15B9,oS208,64 Cmce 1.5872,1.1559,1.12361,90,90,90 - - 8.46 A 43127
B-Er-Ni Er2Ni3B6 Lu2Ni3B6,oS22,65 Cmmm 0.7701,0.8639,0.3455,90,90,90 - - 8.32 A 43127
B-Er-Ni Er3Ni13B2 Nd3Ni13B2,hP18,191 P6/mmm 0.4928,0.4928,1.0895,90,90,120 - - 9.32 A 43127
B-Er-Ni Er3Ni19B10 Ho3Ni19B10,mS64,12 C12/m1 1.3098,0.8673,0.57613,90,91.053,90 - - 8.76 A 43127
B-Er-Ni Er3Ni7B2 Dy3Ni7B2,hP24,194 P63/mmc 0.5043,0.5043,1.429,90,90,120 Laves-CaCu5 - 9.86 X 16239
B-Er-Ni Er4NiB13 Er4NiB13,tP36,128 P4/mnc 0.7186,0.7186,0.7446,90,90,90 - - 7.50 X 16590
B-Er-O ErBO3 hp-ht SrSiO3,mS60,15 C12/c1 1.1284,0.65264,0.95399,90,112.81,90 - pink 6.96 X 56839
B-Er-O ErB3O6 DyB3O6,oP160,62 Pnma 1.5876,0.738,1.2189,90,90,90 - colorless 5.50 X 44103
B-Er-O ErB5O9 GdB5O9,tI240,142 I41/acd 0.81546,0.81546,3.34176,90,90,90 - - 4.37 A 39962
B-Er-O Er[BO3] hp-ht Dy[BO3],aP60,2 P-1 0.7181,0.8971,0.9802,81.32,85.54,77.11 - pink light 7.41 X 40503
B-Er-O Er[BO3] rt Y[BO3],hP18,194 P63/mmc 0.3767,0.3767,0.8807,90,90,120 - - 6.94 X 1908
B-Er-O Er3B5O12 Er3B5O12,oP80,53 Pmna 1.2861,0.4622,1.2531,90,90,90 - pink 6.67 X 44466
B-Er-Os ErOsB2 LuRuB2,oP16,62 Pnma 0.5834,0.5274,0.6341,90,90,90 - - 12.91 A 13562
B-Er-Os ErOsB4 YCrB4,oP24,55 Pbam 0.5928,1.1482,0.3539,90,90,90 - - 11.05 A 12511
B-Er-Os Er2OsB6 Y2ReB6,oP36,55 Pbam 0.90973,1.14644,0.36169,90,90,90 - - 10.38 A 17266
B-Er-Pd ErPd3B0.45 CaTiO3,cP5,221 Pm-3m 0.4092,0.4092,0.4092,90,90,90 perovskite family - 11.91 X 20227
B-Er-Pt ErPt3B0.4 CaTiO3,cP5,221 Pm-3m 0.4103,0.4103,0.4103,90,90,90 perovskite family - 18.20 X 20227
B-Er-Re ErReB4 YCrB4,oP24,55 Pbam 0.5952,1.15,0.356,90,90,90 - - 10.81 A 6640
B-Er-Re Er2ReB6 Y2ReB6,oP36,55 Pbam 0.9128,1.149,0.3634,90,90,90 - - 10.21 A 7007
B-Er-Re Er3ReB7 Er3CrB7,oS44,63 Cmcm 0.3501,1.5691,0.9346,90,90,90 - - 9.88 A 19085
B-Er-Rh ErRhB4 YCrB4,oP24,55 Pbam 0.59356,1.15061,0.35286,90,90,90 - - 8.64 X 50916
B-Er-Rh ErRh3B CaTiO3,cP5,221 Pm-3m 0.4154,0.4154,0.4154,90,90,90 perovskite family black 11.28 X 20227
B-Er-Rh ErRh3B2 ErIr3 B2,mS12,12 C12/m1 0.5362,0.9288,0.3099,90,90.9,90 - gray silver 10.71 X 28931
B-Er-Rh ErRh4B4 m CeCo 4B4,tP18,137 P42/nmc 0.5292,0.5292,0.7379,90,90,90 - gray silver 10.00 X 16825
B-Er-Rh ErRh4B4 orth LuRh4B4,oS108,68 Ccce 0.7444,2.23,0.7465,90,90,90 - - 10.00 A 14940
B-Er-Rh ErRh4B4 tet2 LuRu4B4,tI72,142 I41/acd 0.7461,0.7461,1.4804,90,90,90 - - 10.03 X 18793
B-Er-Rh Er0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5581,0.5581,0.8488,90,90,120 - - 9.01 A 18557
B-Er-Rh Er2RhB6 Y2ReB6,oP36,55 Pbam 0.9104,1.14591,0.36208,90,90,90 - - 8.83 A 44613
B-Er-Ru ErRuB2 LuRuB2,oP16,62 Pnma 0.5848,0.5267,0.6309,90,90,90 - - 9.91 A 19462
B-Er-Ru ErRuB4 YCrB4,oP24,55 Pbam 0.593,1.1481,0.3536,90,90,90 - - 8.60 A 12511
B-Er-Ru ErRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5467,0.5467,0.3017,90,90,120 - - 10.46 X 13749
B-Er-Ru ErRu4B4 LuRu4B4,tI72,142 I41/acd 0.7438,0.7438,1.4972,90,90,90 - - 9.86 A 11021
B-Er-Ru Er2RuB6 Y2ReB6,oP36,55 Pbam 0.90822,1.14439,0.36266,90,90,90 - - 8.82 A 17266
B-Er-S Er3B1.67 S7 Cu2U3S7,hP24,173 P63 0.93279,0.93279,0.58793,90,90,120 - orange 5.58 X 56910
B-Er-Si ErSi0.6 B1.4 AlB2 ,hP3,191 P6/mmm 0.3392,0.3392,0.3947,90,90,120 AlB2 family - 8.41 X 46652
B-Er-Si ErSi1.9 B0.1 AlB2 ,hP3,191 P6/mmm 0.3787,0.3787,0.3992,90,90,120 AlB2 family - 7.43 X 37912
B-Er-Si Er2Si4.25 B0.75 Er2Si3(Si0.63 B0.37 )2,oS28,36 Cmc21 0.40128,2.88674,0.38413,90,90,90 - gray 6.90 X 41664
B-Er-Si Er2.1 Si9B36 Tb1.8 Si8B36C2,hR147,166 R-3m 1.0046,1.0046,1.6392,90,90,120 - - 3.45 A 41869
B-Er-Si Er5Si3B0.75 CuHf5Sn3,hP18,193 P63/mcm 0.8279,0.8279,0.6198,90,90,120 AlB2 family - 8.38 A 46652
B-Er-V ErVB4 YCrB4,oP24,55 Pbam 0.5979,1.1573,0.3434,90,90,90 - - 7.31 X 41042
286 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Er-W ErWB4 YCrB4,oP24,55 Pbam 0.6014,1.161,0.3582,90,90,90 - - 10.47 A 6640


B-Er-W Er0.85 W0.15 B2 AlB2,hP3,191 P6/mmm 0.323,0.323,0.3711,90,90,120 AlB2 family - 9.48 X 24107
B-Er-W Er3WB7 Er3CrB7,oS44,63 Cmcm 0.3434,1.5799,0.9412,90,90,90 - - 9.90 A 25997
B-Eu-Fe Eu5Fe2B6 Pr5Co2B6,hR39,166 R-3m 0.5435,0.5435,2.336,90,90,120 - - 7.81 A 19086
B-Eu-Ir EuIr2B2 CaRh2B2,oF40,70 Fddd 0.6014,0.9343,1.0672,90,90,90 - - 12.36 X 24867
B-Eu-Ir EuIr4B4 NdCo4B4,tP18,86 P42 /n 0.76219,0.76219,0.39771,90,90,90 - - 13.86 X 15131
B-Eu-La La0.5 Eu0.5 B6 CaB6,cP7,221 Pm-3m 0.4166,0.4166,0.4166,90,90,90 - - 4.83 A 11613
B-Eu-N Eu3B2N4 Eu3B2N4,cP28,221 Pm-3m 0.7624,0.7624,0.7624,90,90,90 - red dark 6.00 X 39633
B-Eu-Ni EuNi12B6 SrNi12B6,hR57,166 R-3m 0.9551,0.9551,0.7408,90,90,120 - - 7.84 X 14139
B-Eu-Ni EuNi4B CeCo 4B,hP12,191 P6/mmm 0.4989,0.4989,0.6947,90,90,120 - - 8.82 A 15185
B-Eu-Ni Eu1.5 Ni3.5B Eu(Eu0.5 Ni0.5)Ni3B,hP12,191 P6/mmm 0.504,0.504,0.6925,90,90,120 - - 9.68 X 16239
B-Eu-Ni Eu3Ni13B2 Nd3Ni13B2 ,hP18,191 P6/mmm 0.4981,0.4981,1.0884,90,90,120 - - 8.81 A 17993
B-Eu-O EuBO3 ht YbBO3,hP30,193 P63 /mcm 0.6671,0.6671,0.8945,90,90,120 - - 6.09 A 24827
B-Eu-O EuB2O4 CaB2O4,oP28,60 Pbcn 1.2063,0.4343,0.6593,90,90,90 - yellow 4.57 X 12096
B-Eu-O EuB3O6 LaB3O6,mS40,15 C12/c1 0.97259,0.80331,0.6283,90,126.44,90 - colorless 4.72 X 42619
B-Eu-O EuB4O7 SrB4O7,oP24,31 Pmn21 1.0731,0.4435,0.424,90,90,90 - gray faint 5.06 X 12992
B-Eu-O EuB5O9 GdB5O9,tI240,142 I41/acd 0.82556,0.82556,3.36625,90,90,90 - - 4.05 A 41375
B-Eu-O Eu[BO3] ht Y[BO3],hP18,194 P63 /mmc 0.3842,0.3842,0.8937,90,90,120 - - 6.13 X 1908
B-Eu-O Eu[BO3] rt Eu[BO3],aP20,2 P-1 0.622,0.6468,0.6477,93.07,107.78,108. - - 6.01 X 35878
B-Eu-O Eu2B2O5 Sr2B2O5,mP36,14 P121/c1 0.774,0.536,1.191,90,92.7,90 - yellow 5.46 A 12471
B-Eu-O Eu2B4O9 Gd2B4O9,mS300,15 C12/c1 2.5479,0.4433,2.4938,90,99.82,90 - colorless 5.88 A 41334
B-Eu-O Eu3[BO3]2 Ca3[BO3]2 ,hR66,167 R-3c 0.9069,0.9069,1.2542,90,90,120 - black 6.40 X 14087
B-Eu-Os EuOs4B4 NdCo4B4,tP18,86 P42 /n 0.75262,0.75262,0.40159,90,90,90 - - 13.96 A 15131
B-Eu-Os Eu2Os3B5 Ca2Os3B5,mS20,5 C121 1.07026,0.4071,0.8001,90,124.657,90 - black 10.75 X 19668
B-Eu-Pd EuPd3B CaTiO3,cP5,221 Pm-3m 0.4195,0.4195,0.4195,90,90,90 perovskite family - 10.84 X 15209
B-Eu-Pd Eu0.07Pd0.80 B0.13 Cu,cF4,225 Fm-3m 0.40258,0.40258,0.40258,90,90,90 close-packed structure - 9.89 X 54232
B-Eu-Pd Eu2Pd14.9 B4.9 Nd2Pd14.9 B4.9,tI96,141 I41/amd 0.85653,0.85653,1.66124,90,90,90 - - 10.59 X 54232
B-Eu-Pd Eu2Pd6B0.94 K2PtCl6,cF36,225 Fm-3m 0.8351,0.8351,0.8351,90,90,90 fluorite family - 10.86 X 55301
B-Eu-Pd Eu3Pd23.3 B7.93 La3Pd23.25 B7.93 ,mP142,14 P121/c1 1.17032,1.05604,1.60013,90,102.2,90 - - 10.38 X 54232
B-Eu-Rh EuRh3B CaTiO3,cP5,221 Pm-3m 0.4184,0.4184,0.4184,90,90,90 perovskite family - 10.69 X 17128
B-Eu-Rh EuRh3B2 CeCo 3B2,hP6,191 P6/mmm 0.5601,0.5601,0.2906,90,90,120 - - 10.14 X 13749
B-Eu-Rh Eu2Rh5B4 Ca2Rh5B4,oF44,69 Fmmm 0.5492,0.9914,1.1237,90,90,90 - gray 9.35 X 23557
B-Eu-Rh Eu3Rh8B6 Ca3Rh8B6,oF68,69 Fmmm 0.5537,0.9847,1.7099,90,90,90 - gray 9.58 X 23557
B-Eu-Ru EuRuB4 YCrB4,oP24,55 Pbam 0.5997,1.1607,0.35806,90,90,90 - - 7.90 X 55609
B-Eu-Ru EuRu4B4 LuRu4B4,tI72,142 I41/acd 0.7481,0.7481,1.5023,90,90,90 - - 9.47 A 55609
B-Eu-S EuB2S4 SrB2S4,mP28,14 P121/c1 0.64331,1.4099,0.60731,90,110.55,90 - yellow 3.89 X 44011
B-Eu-Tm Eu0.55 Tm0.45 B6 CaB6,cP7,221 Pm-3m 0.414,0.414,0.414,90,90,90 - - 5.25 A 21731
B-Eu-Yb Eu0.3 Yb0.7 B6 CaB6,cP7,221 Pm-3m 0.4157,0.4157,0.4157,90,90,90 - - 5.35 A 24036
B-F-H H13B10F H13B10F,mP48,13 P12/c1 1.2639,0.56456,1.48676,90,125.998,90 - - 1.09 X 50475
B-F-In In[BF4] Ba[SO4],oP24,62 Pnma 0.9137,0.5727,0.7349,90,90,90 - colorless 3.48 X 33818
B-F-K KB6F6 KB6F6,mS104,15 C12/c1 0.82072,1.42818,1.13441,90,92.832,90 - colorless 2.18 X 54736
B-F-K K[BF4] ht Na[ClO4],cF264,225 Fm-3m 0.735,0.735,0.735,90,90,90 - - 2.11 X 7882
B-F-K K[BF4] rt Ba[SO4],oP24,62 Pnma 0.86588,0.548,0.70299,90,90,90 avogadrite - 2.51 X 4401
B-F-La La[BF4]3 La[BF4]3,hP100,165 P-3c1 1.09941,1.09941,1.12215,90,90,120 - colorless 3.39 X 53461
B-F-Li LiBF4 Al[AsO4],hP18,152 P3121 0.4892,0.4892,1.1002,90,90,120 - - 2.05 X 46909
B-F-Mn Mn[BF4]2 Zr[SO4]2,oP44,62 Pnma 0.86042,0.54496,1.08673,90,90,90 - colorless 2.98 X 21172
B-F-N [NF4][BF4 ] orth [NF4][BF4 ],oP40,57 Pbcm 0.51733,0.9902,0.97533,90,90,90 - - 2.35 X 46495
B-F-N [NF4][BF4 ] tet [NF4][BF4 ],tP40,113 P-42 1m 0.992,0.992,0.523,90,90,90 - - 2.28 X 21171
B-F-Na Na[BF4] ht *,hR*,* - 1.46199,1.46199,1.73924,90,90,120 - - - N 13834
B-F-Na Na[BF4] rt Ca[SO4],oS24,63 Cmcm 0.68368,0.62619,0.67916,90,90,90 ferruccite - 2.51 X 3822
B-F-P B4PF9 B4PF9,oP56,62 Pnma 1.3893,1.0578,0.6075,90,90,90 - colorless 1.82 X 4648
B-F-Rb Rb[BF4] rt Ba[SO4],oP24,62 Pnma 0.9108,0.5636,0.7296,90,90,90 - - 3.06 X 4586
B-F-S [BF4]SF3 [BF4]SF3,oP36,62 Pnma 0.9599,0.5755,0.8974,90,90,90 - - 2.36 X 6663
B-F-Sn Sn2[BF4]F3 Sn2[BF4]F3,mP40,14 P121/c1 0.5395,0.8978,1.48812,90,111.183,90 - - 3.77 X 14680
B-F-Sn Sn3[BF4]F5 Sn3[BF4]F5,mP52,14 P121/c1 1.0772,0.7638,1.0328,90,98.24,90 - - 4.25 X 14680
B-F-Sn Sn4[BF4]F7 *,o**,* - 0.77,1.36,2.48,90,90,90 - - - N 14680
B-F-Sn Sn5[BF4]F9 Sn5[BF4]F9,mP76,14 P121/c1 1.3635,0.766,1.4112,90,119.71,90 - - 4.42 X 16845
B-F-Sr Sr[BF4]2 Ca[BF4 ]2,oP88,61 Pbca 0.9259,1.389,0.9602,90,90,90 - colorless 2.81 X 53648
B-F-Tl Tl[BF4] ht *,cF*,* - 0.7566,0.7566,0.7566,90,90,90 - - - N 7595
B-F-Tl Tl[BF4] rt Ba[SO4],oP24,62 Pnma 0.9207,0.57217,0.73649,90,90,90 - colorless 4.99 X 26919
B-Fe-Ga Fe0.752 Ga0.188 B0.06 W,cI2,229 Im-3m 0.2891,0.2891,0.2891,90,90,90 b.c.c. family - 7.66 X 52577
B-Fe-Gd GdFeB4 YCrB4,oP24,55 Pbam 0.5918,1.1456,0.3457,90,90,90 - - 7.26 A 12511
B-Fe-Gd GdFe2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3558,0.3558,0.9507,90,90,90 - - 8.02 X 11486
B-Fe-Gd Gd2Fe14B Nd2Fe14B,tP68,136 P42 /mnm 0.8793,0.8793,1.2053,90,90,90 - - 7.89 X 23628
B-Fe-Gd Gd2Fe7B7 Gd2Fe7B7,oP128,56 Pccn 0.7051,0.7051,2.7327,90,90,90 - - 7.64 X 19141
B-Fe-Gd Gd3Fe62B14 *,cI*,* - 1.2192,1.2192,1.2192,90,90,90 - - - N 33294
B-Fe-Gd Gd5Fe2B6 Pr5Co2B6,hR39,166 R-3m 0.5424,0.5424,2.344,90,90,120 - - 8.03 A 33135
B-Fe-Ho HoFeB4 YCrB4,oP24,55 Pbam 0.5871,1.136,0.3391,90,90,90 - - 7.75 A 11028
B-Fe-Ho HoFe2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3527,0.3527,0.9425,90,90,90 - - 8.45 X 11486
B-Fe-Ho Ho2Fe14B lt Ho2Fe14B,mS136,8 C1m1 1.2403,1.2403,1.2016,90,90.,90 - - 8.07 X 23565
B-Fe-Ho Ho2Fe14B rt Nd2Fe14B,tP68,136 P42 /mnm 0.87485,0.87485,1.19863,90,90,90 - - 8.13 X 23565
B-Fe-Ho Ho3FeB7 Er3CrB7,oS44,63 Cmcm 0.3369,1.5504,0.9358,90,90,90 - - 8.51 A 19085
B-Fe-Ho Ho5Fe17B17 Ho5Fe17B17 ,tP312,116 P-4c2 0.6983,0.6983,6.67,90,90,90 - - 8.00 X 27340
B-Fe-Ir Fe11Ir12B6 Cr23C6,cF116,225 Fm-3m 1.113,1.113,1.113,90,90,90 - - 14.38 X 7660
B-Fe-Ir Fe13.8 Ir9.20 B6 Mg3Ni20B6,cF116,225 Fm-3m 1.1102,1.1102,1.1102,90,90,90 - - 12.64 X 54251
B-Fe-Ir Fe2.28 Ir0.72 B Fe3C-b,oP16,62 Pnma 0.543,0.6958,0.4654,90,90,90 - - 10.45 X 54251
B-Fe-La LaFe12B6 SrNi12B6,hR57,166 R-3m 0.9615,0.9615,0.772,90,90,120 - - 7.04 A 26066
B-Fe-La LaFe4B4 *,tP594,86 P42 /n 0.7221,0.7221,12.781,90,90,90 - - - N 20418
Handbook of Inorganic Substances – Edition 2015 : Data 287

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Fe-La La2Fe 14B Nd2Fe14B,tP68,136 P42/mnm 0.883,0.883,1.237,90,90,90 - - 7.37 A 30397


B-Fe-Lu LuFeB4 YCrB4,oP24,55 Pbam 0.5848,1.1316,0.3353,90,90,90 - - 8.20 A 20742
B-Fe-Lu LuFe 2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3499,0.3499,0.9288,90,90,90 - - 9.00 X 11486
B-Fe-Lu LuFe 4B CeCo 4B,hP12,191 P6/mmm 0.5007,0.5007,0.69666,90,90,120 - - 8.98 X 16083
B-Fe-Lu LuFe 4B4 *,tP666,86 P42/n 0.695,0.695,13.776,90,90,90 - - - N 20418
B-Fe-Lu Lu2FeB6 Y2ReB6,oP36,55 Pbam 0.8969,1.134,0.349,90,90,90 - - 8.81 X 20742
B-Fe-Lu Lu2Fe 14B Nd2Fe14B,tP68,136 P42/mnm 0.8697,0.8697,1.185,90,90,90 - - 8.47 X 19189
B-Fe-Mn MnFeB CuAl2,tI12,140 I4/mcm 0.5132,0.5132,0.4205,90,90,90 - - 7.29 A 9194
B-Fe-Mn Mn0.5 Fe0.5 B FeB-b,oP8,62 Pnma 0.5535,0.2962,0.411,90,90,90 CrB(TlI)-FeB - 6.53 A 14483
B-Fe-Mo MoFe2B4 MoFe2B4,oI14,71 Immm 0.29919,0.30999,1.27798,90,90,90 - - 7.03 X 37905
B-Fe-Mo Mo0.2 Fe2.8 B Ti3P,tP32,86 P42/n 0.86316,0.86316,0.43129,90,90,90 - - 7.71 A 37905
B-Fe-Mo Mo0.87 Fe0.13 B TlI,oS8,63 Cmcm 0.31526,0.84186,0.30662,90,90,90 CrB(TlI)-FeB - 8.29 A 37905
B-Fe-Mo Mo2 FeB2 Mo2 FeB2,tP10,127 P4/mbm 0.5807,0.5807,0.3142,90,90,90 - - 8.44 X 3249
B-Fe-Mo Mo2 FeB4 Ta3B4,oI14,71 Immm 0.311,0.319,1.427,90,90,90 - - 6.83 A 3195
B-Fe-Nb NbFeB ZrNiAl,hP9,189 P-62m 0.6015,0.6015,0.3222,90,90,120 Fe2P family - 7.87 X 3520
B-Fe-Nb Nb1.7 Fe22B5.3 ht Cr23 C6,cF116,225 Fm-3m 1.0819,1.0819,1.0819,90,90,90 - - 7.57 X 25687
B-Fe-Nb Nb2 FeB2 Mo2 FeB2,tP10,127 P4/mbm 0.5895,0.5895,0.3275,90,90,90 - - 7.68 A 4069
B-Fe-Nd NdFe 12B6 SrNi12B6,hR57,166 R-3m 0.95859,0.95859,0.75505,90,90,120 - - 7.29 X 51106
B-Fe-Nd Nd2 Fe14B rt Nd2Fe14B,tP68,136 P42/mnm 0.8804,0.8804,1.2205,90,90,90 - - 7.59 X 16829
B-Fe-Nd Nd2 Fe21B6 Cr21 W2C6,cF116,225 Fm-3m 1.0803,1.0803,1.0803,90,90,90 - - 8.04 A 23983
B-Fe-Nd Nd2 Fe23B3 m Nd2Fe23B3,cI224,220 I-43d 1.41612,1.41612,1.41612,90,90,90 - - 7.51 X 27597
B-Fe-Nd Nd4.5 Fe82.5 B12.5 m *,cI*,* - 1.2377,1.2377,1.2377,90,90,90 - - - N 21273
B-Fe-Nd Nd5 Fe18B18 Nd5Fe18B18,oP164,56 Pccn 0.713,0.713,3.512,90,90,90 - - 7.15 X 21853
B-Fe-Nd Nd5 Fe2B6 Pr5Co2B6,hR39,166 R-3m 0.5464,0.5464,2.4272,90,90,120 - - 7.13 X 20757
B-Fe-Ni FeNiB CuAl2,tI12,140 I4/mcm 0.517,0.517,0.43,90,90,90 - - 7.24 A 16742
B-Fe-Ni Fe0.4 Ni0.4 B0.2 m Cu,cF4,225 Fm-3m 0.353,0.353,0.353,90,90,90 close-packed structure - 7.25 X 53854
B-Fe-Ni Fe1.5 Ni1.5 B orth Fe3C-b,oP16,62 Pnma 0.534,0.6637,0.4437,90,90,90 - - 7.71 A 3492
B-Fe-Ni Fe1.5 Ni1.5 B tet Ni3P,tI32,82 I-4 0.87,0.87,0.431,90,90,90 - - 7.44 A 16742
B-Fe-Ni Fe11.5 Ni11.5 B6 m Cr23 C6,cF116,225 Fm-3m 1.069,1.069,1.069,90,90,90 - - 7.52 A 16742
B-Fe-Ni Fe3Ni20B6 Cr23 C6,cF116,225 Fm-3m 1.0501,1.0501,1.0501,90,90,90 - - 8.07 A 4918
B-Fe-O FeB2O4 ht NiB2O4,mS28,15 C12/c1 0.95,0.5629,0.4437,90,108.5,90 - brown 4.18 X 53607
B-Fe-O FeB2O4 rt CaGa2O4,mP56,14 P121/c1 0.7152,0.7458,0.8617,90,94.78,90 - colorless 4.10 X 50921
B-Fe-O FeB4O7 ZnB4O7,oS48,63 Cmcm 1.0883,0.6524,0.5195,90,90,90 - - 3.80 X 53446
B-Fe-O Fe[BO3] rt Ca[CO3],hR30,167 R-3c 0.4626,0.4626,1.4493,90,90,120 - green 4.25 X 9387
B-Fe-O Fe2B2O5 Co2B2O5,aP18,2 P-1 0.32388,0.61684,0.93866,104.613,90.799,91.731 - green moss 3.91 X 52885
B-Fe-O Fe2[BO3]O ht Mg(Mg0.5 Ti0.5 )[BO3 ]O,oP28,62 Pnma 0.92495,0.31779,0.93945,90,90,90 - - 4.49 X 34993
B-Fe-O Fe2[BO3]O rt (Mg0.76 Mn0.24)Mn[BO3]O,mP28,14 P121/c1 0.3175,0.93878,0.92469,90,89.736,90 - - 4.49 X 36038
B-Fe-O Fe3BO6 Mg3 [SiO4][OH]2,oP40,62 Pnma 1.0048,0.8531,0.4466,90,90,90 - black 4.76 X 8749
B-Fe-O Fe3[BO3]O2 lt Fe3[BO3]O2,oP72,62 Pnma 1.2272,0.6131,0.9427,90,90,90 - black 4.84 X 46537
B-Fe-O Fe3[BO3]O2 rt Fe3[BO3]O2,oP36,55 Pbam 0.9463,1.2305,0.30727,90,90,90 vonsenite black 4.80 X 15923
B-Fe-P Fe2B0.15P 0.85 Fe2P,hP9,189 P-62m 0.59356,0.59356,0.33251,90,90,120 Fe2P family - 6.86 A 13487
B-Fe-P Fe3B0.19P 0.81 Ni3P,tI32,82 I-4 0.9022,0.9022,0.4431,90,90,90 - - 7.17 A 1626
B-Fe-P Fe3B0.63P 0.37 Ti3P,tP32,86 P42/n 0.8812,0.8812,0.4375,90,90,90 - - 7.27 X 1626
B-Fe-P Fe5B2P Mo5 SiB2,tI32,140 I4/mcm 0.5482,0.5482,1.0332,90,90,90 - - 7.10 X 1626
B-Fe-Pr PrFe 4B4 NdCo 4B4,tP18,86 P42/n 0.715,0.715,0.389,90,90,90 - - 6.81 A 19066
B-Fe-Pr Pr2Fe 14B Nd2Fe14B,tP68,136 P42/mnm 0.8796,0.8796,1.2228,90,90,90 - - 7.54 X 18006
B-Fe-Pr Pr5Fe 2B6 Pr5Co2B6,hR39,166 R-3m 0.5454,0.5454,2.404,90,90,120 - - 7.09 A 33135
B-Fe-Re Re0.3 Fe0.7B FeB-b,oP8,62 Pnma 0.557,0.296,0.407,90,90,90 CrB(TlI)-FeB - 10.47 A 3205
B-Fe-Re Re0.6 Fe2.4B Ti3P,tP32,86 P42/n 0.8683,0.8683,0.4329,90,90,90 - - 10.44 A 3205
B-Fe-Re Re1.34 Fe0.66 B CuAl2,tI12,140 I4/mcm 0.535,0.535,0.447,90,90,90 - - 15.43 A 3205
B-Fe-Re Re11.5 Fe11.5 B6 Cr23 C6,cF116,225 Fm-3m 1.11,1.11,1.11,90,90,90 - - 13.83 A 3189
B-Fe-Rh Fe1.3 Rh5.7B3 Th7Fe3,hP20,186 P63mc 0.73519,0.73519,0.46528,90,90,120 - gray silver 10.55 X 48558
B-Fe-Rh Fe2.25 Rh0.75 B Fe3C-b,oP16,62 Pnma 0.5456,0.69552,0.46169,90,90,90 - - 8.10 X 54251
B-Fe-Ru Fe0.67 Ru0.67 B0.66 CsCl,cP2,221 Pm-3m 0.2899,0.2899,0.2899,90,90,90 b.c.c. family - 7.65 X 16460
B-Fe-Ru Fe0.8 Ru6.2B3 Th7Fe3,hP20,186 P63mc 0.74269,0.74269,0.46867,90,90,120 - gray silver 10.44 X 48558
B-Fe-Sc ScFeB4 YCrB4,oP24,55 Pbam 0.5884,1.1318,0.3342,90,90,90 - - 4.30 A 21196
B-Fe-Si Fe0.75 Si0.15B0.10 W,cI2,229 Im-3m 0.2849,0.2849,0.2849,90,90,90 b.c.c. family - 6.78 X 54536
B-Fe-Si Fe2.7 Si0.3 B Fe3C-b,oP16,62 Pnma 0.541,0.66,0.446,90,90,90 - - 7.09 A 5284
B-Fe-Si Fe4.7 Si2B Nb5Sn2Si,tI32,140 I4/mcm 0.8814,0.8814,0.433,90,90,90 - - 6.51 A 5284
B-Fe-Si Fe5SiB2 Mo5 SiB2,tI32,140 I4/mcm 0.5527,0.5527,1.026,90,90,90 - - 6.97 A 5284
B-Fe-Sm SmFeB4 YCrB4,oP24,55 Pbam 0.5958,1.153,0.3465,90,90,90 - - 6.96 X 13019
B-Fe-Sm Sm17 Fe60B60 Sm17 Fe60B60,tP274,86 P42/n 0.7098,0.7098,5.869,90,90,90 - - 7.36 X 18560
B-Fe-Sm Sm2 Fe14B Nd2Fe14B,tP68,136 P42/mnm 0.8786,0.8786,1.2159,90,90,90 - - 7.74 A 18552
B-Fe-Sm Sm2 Fe17B0.2 rt Pr2Mn17C1.77 ,hR66,166 R-3m 0.8563,0.8563,1.2466,90,90,120 CaCu5-Zr4Al3 - 7.88 A 44850
B-Fe-Sm Sm5 Fe2B6 Pr5Co2B6,hR39,166 R-3m 0.5437,0.5437,2.376,90,90,120 - - 7.60 A 33135
B-Fe-Ta TaFeB ZrNiAl,hP9,189 P-62m 0.5984,0.5984,0.3195,90,90,120 Fe2P family - 12.45 A 6287
B-Fe-Ta Ta2FeB2 Mo2 FeB2,tP10,127 P4/mbm 0.5864,0.5864,0.3274,90,90,90 - - 12.96 A 6287
B-Fe-Tb TbFeB4 YCrB4,oP24,55 Pbam 0.59,1.141,0.3418,90,90,90 - - 7.45 A 11028
B-Fe-Tb TbFe 2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3544,0.3544,0.9473,90,90,90 - - 8.16 X 11486
B-Fe-Tb TbFe 4B4 *,tP594,86 P42/n 0.7049,0.7049,10.581,90,90,90 - - - N 18560
B-Fe-Tb Tb2Fe 14B Nd2Fe14B,tP68,136 P42/mnm 0.8767,0.8767,1.2043,90,90,90 - - 7.97 X 27490
B-Fe-Tb Tb3FeB7 Er3CrB7,oS44,63 Cmcm 0.3374,1.564,0.9413,90,90,90 - - 8.13 A 19085
B-Fe-Tb Tb5Fe 2B6 Pr5Co2B6,hR39,166 R-3m 0.541,0.541,2.307,90,90,120 - - 8.27 A 33135
B-Fe-Th Th2FeB10 Th2NiB10,oP26,55 Pbam 0.5627,1.1261,0.4183,90,90,90 - - 7.87 X 31227
B-Fe-Th Th2Fe 14B Nd2Fe14B,tP68,136 P42/mnm 0.881,0.881,1.219,90,90,90 - - 8.82 A 33297
B-Fe-Tm TmFeB4 YCrB4,oP24,55 Pbam 0.585,1.132,0.3365,90,90,90 - - 7.99 A 11028
B-Fe-Tm TmFe 2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3507,0.3507,0.9342,90,90,90 - - 8.74 X 11486
B-Fe-Tm TmFe 4B CeCo 4B,hP12,191 P6/mmm 0.4973,0.4973,0.697,90,90,120 - - 8.97 X 16083
288 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Fe-Tm Tm2Fe14B Nd2Fe14B,tP68,136 P42 /mnm 0.87203,0.87203,1.19414,90,90,90 - - 8.27 X 18565


B-Fe-U UFeB4 YCrB4,oP24,55 Pbam 0.5887,1.1412,0.34355,90,90,90 - - 9.70 A 48371
B-Fe-U UFe2B6 CeCr2B6,oI18,71 Immm 0.31372,0.61813,0.8225,90,90,90 - - 8.63 X 54521
B-Fe-U UFe3B2 CeCo 3B2,hP6,191 P6/mmm 0.5052,0.5052,0.3002,90,90,120 - - 10.69 X 58737
B-Fe-U UFe4B CeCo 4B,hP12,191 P6/mmm 0.4932,0.4932,0.7037,90,90,120 - - 10.58 A 48371
B-Fe-U U2Fe21B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0766,1.0766,1.0766,90,90,90 - - 9.12 A 48371
B-Fe-V V0.1 Fe0.9 B FeB-b,oP8,62 Pnma 0.5523,0.2963,0.4048,90,90,90 CrB(TlI)-FeB - 6.63 A 7409
B-Fe-V V0.14 Fe1.86 B CuAl2,tI12,140 I4/mcm 0.5118,0.5118,0.4251,90,90,90 - - 7.27 A 7409
B-Fe-V V0.9 Fe2.1 B4 Ta3B4,oI14,71 Immm 0.2965,0.3021,1.28,90,90,90 - - 5.98 A 7409
B-Fe-V V2.76 Fe0.24 B2 U3Si2,tP10,127 P4/mbm 0.572,0.572,0.3104,90,90,90 - - 5.74 A 7409
B-Fe-W WFeB TiNiSi,oP12,62 Pnma 0.58159,0.31617,0.68015,90,90,90 AlB2 family - 13.30 A 44594
B-Fe-W W0.14 Fe1.86 B CuAl2,tI12,140 I4/mcm 0.5125,0.5125,0.4234,90,90,90 - - 8.39 A 4665
B-Fe-W W0.2 Fe2.8 B ht Ti3P,tP32,86 P42 /n 0.86353,0.86353,0.4316,90,90,90 - - 8.42 A 37905
B-Fe-W W0.7 Fe0.15 B ht TlI,oS8,63 Cmcm 0.3155,0.8345,0.3054,90,90,90 CrB(TlI)-FeB - 12.22 A 3195
B-Fe-W W0.9 Fe22.1 B5.85 m Cr23C6,cF116,225 Fm-3m 1.06628,1.06628,1.06628,90,90,90 - - 8.02 A 44594
B-Fe-W W2FeB2 ht Mo2FeB2,tP10,127 P4/mbm 0.569,0.569,0.3162,90,90,90 - - 14.44 X 4175
B-Fe-W W2FeB2 rt W2CoB2,oI10,71 Immm 0.31493,0.46138,0.71214,90,90,90 - - 14.29 A 37905
B-Fe-W W2FeB4 Ta3B4,oI14,71 Immm 0.311,0.3176,1.441,90,90,90 - - 10.89 A 3195
B-Fe-Y YFeB4 YCrB4,oP24,55 Pbam 0.5906,1.14,0.3407,90,90,90 - - 5.44 A 11028
B-Fe-Y YFe2B2 CeAl2Ga2,tI10,139 I4/mmm 0.3546,0.3546,0.9555,90,90,90 - - 6.14 X 11486
B-Fe-Y YFe4B4 *,tP*,130 P4/ncc 0.705,0.705,2.7,90,90,90 - - - N 13744
B-Fe-Y Y2Fe14B Nd2Fe14B,tP68,136 P42 /mnm 0.8774,0.8774,1.2042,90,90,90 - - 6.95 X 20747
B-Fe-Y Y2Fe17B1.5 ht Tb2Mn17C2.5 ,hP44,194 P63 /mmc 0.8462,0.8462,0.8287,90,90,120 CaCu5-Zr4Al3 - 7.39 A 27500
B-Fe-Y Y3FeB7 Er3CrB7,oS44,63 Cmcm 0.3423,1.5658,0.9295,90,90,90 - - 5.31 X 19085
B-Fe-Y Y3Fe62B14 m Y3Fe62B14 ,cI158,229 Im-3m 1.236,1.236,1.236,90,90,90 - - 6.83 X 20570
B-Fe-Y Y5Fe2B6 Pr5Co2B6,hR39,166 R-3m 0.5426,0.5426,2.328,90,90,120 - - 5.21 A 19086
B-Fe-Yb YbFeB4 YCrB4,oP24,55 Pbam 0.58437,1.1304,0.3352,90,90,90 - - 8.16 X 44765
B-Fe-Yb Yb5Fe2B6 Pr5Co2B6,hR39,166 R-3m 0.5427,0.5427,2.2205,90,90,120 - - 9.16 A 44765
B-Ga-H GaBH6 GaBH6,mS96,15 C12/c1 1.36635,0.8932,1.0036,90,125.654,90 - colorless 1.73 X 38677
B-Ga-Ir Ir4Ga8B Ir4Ga8B,tI104,142 I41/acd 0.85369,0.85369,2.10569,90,90,90 - gray silver 11.58 X 31069
B-Ga-Ir Ir9Ga2.7 B5 Zn3Pt9B4,hP17,189 P-62m 0.90465,0.90465,0.28703,90,90,120 - gray 16.10 X 29608
B-Ga-Mg Mg0.95 Ga0.05 B2 AlB2,hP3,191 P6/mmm 0.3078,0.3078,0.3511,90,90,120 AlB2 family - 2.78 X 52357
B-Ga-Mo Mo0.9Ga0.1 B TlI,oS8,63 Cmcm 0.316,0.861,0.308,90,90,90 CrB(TlI)-FeB - 8.25 A 2745
B-Ga-Ni Ni10.6 Ga0.4 B6 Ni10(Ni0.6Ga0.4 )B6,oP68,62 Pnma 1.2305,0.29488,1.6914,90,90,90 - black 7.74 X 54934
B-Ga-Ni Ni12GaB8 Ni12AlB8,oS252,64 Cmce 1.0569,1.4527,1.4557,90,90,90 - - 7.67 A 54934
B-Ga-Ni Ni20Ga3B6 Mg3Ni20B6,cF116,225 Fm-3m 1.04911,1.04911,1.04911,90,90,90 - - 8.33 X 54961
B-Ga-Ni Ni27Ga3B14 Ni27Ga3B14 ,mP88,11 P121/m1 0.86859,1.07477,0.88425,90,90.707,90 - gray dark 7.83 X 56331
B-Ga-Ni Ni3.04 Ga0.96 B0.02 Cu3Au,cP4,221 Pm-3m 0.35819,0.35819,0.35819,90,90,90 close-packed structure - 8.87 F 19924
B-Ga-O Ga[BO3] rt Ca[CO3],hR30,167 R-3c 0.45676,0.45676,1.4173,90,90,120 - - 5.00 A 13405
B-Ga-O Ga4B0.5 [BO3]1.5 O4.5 Ga4B0.5 [BO3]1.5 O4.5 ,mS72,12 C12/m1 1.53582,0.5719,1.08154,90,134.294,90 - - 4.34 X 53835
B-Ga-Pt Pt9Ga3B4 Pt9Ga3B4,hP32,190 P-62c 0.87503,0.87503,0.63742,90,90,120 - - 15.78 X 29608
B-Ga-Ta Ta5Ga3B CuHf5Sn3,hP18,193 P63 /mcm 0.7723,0.7723,0.53,90,90,120 AlB2 family - 13.64 A 2748
B-Gd-Ge Gd5Ge3B CuHf5Sn3,hP18,193 P63 /mcm 0.857,0.857,0.643,90,90,120 AlB2 family - 8.24 A 8292
B-Gd-H Gd[BH4]3 *,cP128,205 Pa-3 1.0983,1.0983,1.0983,90,90,90 - - 2.02 N 51239
B-Gd-I Gd4B4I5 La4B4I5,mS28,12 C12/m1 1.8488,0.4257,0.974,90,106.4,90 - green blue 5.90 X 33371
B-Gd-I Gd7BI12 Sc7NCl12,hR60,148 R-3 1.5364,1.5364,1.0377,90,90,120 - - 6.19 A 35713
B-Gd-Ir GdIr2B2 CaRh2B2,oF40,70 Fddd 0.583,0.9275,1.0772,90,90,90 - - 12.85 X 24867
B-Gd-Ir GdIr3B2 ErIr3B2,mS12,12 C12/m1 0.5466,0.9473,0.3092,90,91.,90 - - 15.68 A 14265
B-Gd-Ir GdIr4B4 NdCo4B4,tP18,86 P42 /n 0.7571,0.7571,0.3979,90,90,90 - - 14.12 A 12590
B-Gd-La La0.5 Gd0.5 B6 CaB6,cP7,221 Pm-3m 0.4132,0.4132,0.4132,90,90,90 - - 5.01 A 13247
B-Gd-Mn GdMnB4 YCrB4,oP24,55 Pbam 0.5944,1.151,0.3464,90,90,90 - - 7.16 X 5216
B-Gd-Mn Gd3MnB7 Er3CrB7,oS44,63 Cmcm 0.3488,1.5875,0.9399,90,90,90 - - 7.69 A 19085
B-Gd-Mo GdMoB4 YCrB4,oP24,55 Pbam 0.6059,1.17,0.3619,90,90,90 - - 7.67 A 6640
B-Gd-N GdBN2 PrBN2,hR72,161 R3c 1.1932,1.1932,0.6736,90,90,120 - - 7.06 A 26432
B-Gd-Nb Gd0.7 Nb0.3 B2 ht AlB2,hP3,191 P6/mmm 0.3176,0.3176,0.3727,90,90,120 AlB2 family - 8.14 X 17529
B-Gd-Ni GdNiB4 ErNiB4,tI48,139 I4/mmm 0.758,0.758,0.8561,90,90,90 - - 7.00 A 17494
B-Gd-Ni GdNi12B6 CeNi12B6,oS76,36 Cmc21 0.9537,0.7376,1.1006,90,90,90 - - 7.95 A 20086
B-Gd-Ni GdNi12B6 SrNi12B6,hR57,166 R-3m 0.9523,0.9523,0.7419,90,90,120 - - 7.92 A 14139
B-Gd-Ni GdNi2B2 HoNi2B2,mS20,15 C12/c1 0.842,0.5278,0.6886,90,126.8,90 AlB2 family - 8.03 A 24693
B-Gd-Ni GdNi4B CeCo 4B,hP12,191 P6/mmm 0.50116,0.50116,0.69599,90,90,120 - - 8.84 X 48638
B-Gd-Ni Gd2NiB10 Th2NiB10,oP26,55 Pbam 0.5576,1.1119,0.4149,90,90,90 - - 6.21 A 37695
B-Gd-Ni Gd2Ni10B5 Ho2Ni10B5 ,oP136,61 Pbca 0.9118,0.9492,1.7638,90,90,90 - - 8.32 A 24694
B-Gd-Ni Gd3Ni13B2 Nd3Ni13B2 ,hP18,191 P6/mmm 0.4976,0.4976,1.0878,90,90,120 - - 8.94 A 14138
B-Gd-Ni Gd3Ni19B10 Ho3Ni19B10 ,mS64,12 C12/m1 1.3215,0.8747,0.5846,90,91.5,90 - - 8.33 A 24670
B-Gd-Ni Gd3Ni7B2 Dy3Ni7B2,hP24,194 P63 /mmc 0.5118,0.5118,1.426,90,90,120 Laves-CaCu5 - 9.28 A 16239
B-Gd-Ni Gd4NiB13 Er4NiB13,tP36,128 P4/mnc 0.7257,0.7257,0.7578,90,90,90 - - 6.89 A 16590
B-Gd-O GdBO3 rt GdBO3,hR90,155 R32 0.66357,0.66357,2.6706,90,90,120 - - 6.34 X 35629
B-Gd-O GdB3O6 hp DyB3O6,oP160,62 Pnma 1.6028,0.7427,1.23217,90,90,90 - - 5.17 X 49765
B-Gd-O GdB3O6 LaB3O6,mS40,15 C12/c1 0.97545,0.802,0.628,90,127.01,90 - - 4.84 X 9341
B-Gd-O GdB5O9 GdB5O9,tI240,142 I41/acd 0.82381,0.82381,3.36377,90,90,90 - - 4.14 X 39962
B-Gd-O Gd[BO3] hex1 Gd[BO3],hP10,194 P63 /mmc 0.41154,0.41154,0.8592,90,90,120 - - 5.69 X 35629
B-Gd-O Gd[BO3] hex2 Y[BO3],hP18,194 P63 /mmc 0.3839,0.3839,0.8906,90,90,120 - - 6.31 X 1908
B-Gd-O Gd[BO3] ht1 *,hP*,182 P6322 0.712,0.712,0.855,90,90,120 - - - N 37692
B-Gd-O Gd2B4O9 hp mon Gd2B4O9,mS300,15 C12/c1 2.539,0.4433,2.4908,90,99.88,90 - colorless 6.03 X 41334
B-Gd-O Gd2B4O9 hp tricl Dy2B4O9,aP30,2 P-1 0.61973,0.64757,0.75249,102.386,96.983,102.544 - colorless 5.88 X 44194
B-Gd-O Gd3BO6 *,mS*,* - 1.421,0.37,1.66192,90,106.625,90 - - - N 37692
B-Gd-Os GdOsB2 LuRuB2,oP16,62 Pnma 0.59066,0.533,0.64135,90,90,90 - - 12.14 A 18331
B-Gd-Os GdOsB4 YCrB4,oP24,55 Pbam 0.5988,1.1587,0.3572,90,90,90 - - 10.47 A 12511
Handbook of Inorganic Substances – Edition 2015 : Data 289

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Gd-Os GdOs2B2 CeRu2B2,oF40,22 F222 0.66175,0.89917,0.98608,90,90,90 - - 12.66 A 20360


B-Gd-Os Gd2 OsB6 Y2ReB6,oP36,55 Pbam 0.92475,1.15912,0.36814,90,90,90 - - 9.59 A 17266
B-Gd-Pd GdPd3B CaTiO3,cP5,221 Pm-3m 0.4144,0.4144,0.4144,90,90,90 perovskite family - 11.37 X 14518
B-Gd-Pd Gd2 Pd15B5 Nd2Pd14.9 B4.9,tI96,141 I41/amd 0.8497,0.8497,1.6614,90,90,90 - - 10.88 A 52631
B-Gd-Re GdReB4 YCrB4,oP24,55 Pbam 0.6003,1.159,0.3592,90,90,90 - - 10.28 A 6640
B-Gd-Re GdRe4B4 *,t**,* - 0.753,0.753,1.72,90,90,90 - - - N 22919
B-Gd-Re Gd2 ReB6 Y2ReB6,oP36,55 Pbam 0.9187,1.161,0.3691,90,90,90 - - 9.54 A 7007
B-Gd-Re Gd2 Re3B6 Pr2Re3B6,mS44,15 C12/c1 0.6755,1.0504,0.7409,90,90.6,90 - - 11.85 A 22919
B-Gd-Re Gd3 ReB7 Er3CrB7,oS44,63 Cmcm 0.3576,1.6026,0.9462,90,90,90 - - 8.99 A 19085
B-Gd-Re Gd8 Re13B12 Pr8Re12.6 B12,hR99,166 R-3m 1.0626,1.0626,1.4392,90,90,120 - - 13.48 A 26001
B-Gd-Rh GdRh3B CaTiO3,cP5,221 Pm-3m 0.4182,0.4182,0.4182,90,90,90 perovskite family gray silver 10.82 X 17128
B-Gd-Rh GdRh3B2 rt CeCo 3B2,hP6,191 P6/mmm 0.54,0.54,0.311,90,90,120 - - 10.31 X 19480
B-Gd-Rh GdRh4B4 CeCo 4B4,tP18,137 P42/nmc 0.532,0.532,0.744,90,90,90 - - 9.65 A 17064
B-Gd-Rh Gd0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5605,0.5605,0.851,90,90,120 - - 8.80 A 18557
B-Gd-Ru GdRuB2 LuRuB2,oP16,62 Pnma 0.59405,0.53425,0.64023,90,90,90 - - 9.15 A 18331
B-Gd-Ru GdRuB4 YCrB4,oP24,55 Pbam 0.5973,1.1568,0.357,90,90,90 - - 8.12 A 12511
B-Gd-Ru GdRu2B2 CeRu2B2,oF40,22 F222 0.65291,0.89916,0.98033,90,90,90 - - 8.79 A 20360
B-Gd-Ru GdRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5508,0.5508,0.3018,90,90,120 - - 10.10 X 13749
B-Gd-Ru GdRu4B4 LuRu4B4,tI72,142 I41/acd 0.747,0.747,1.5009,90,90,90 - - 9.59 A 11021
B-Gd-Ru Gd2 RuB6 Y2ReB6,oP36,55 Pbam 0.92384,1.15843,0.36902,90,90,90 - - 8.08 A 17266
B-Gd-Si Gd0.7 Si3B12.33 Dy0.7 Si3B12.33 ,hR153,166 R-3m 1.007,1.007,1.6447,90,90,120 - - 3.39 A 41869
B-Gd-Si Gd5 Si2B8 Y5Si1.9 B8,tP30,127 P4/mbm 0.72665,0.72665,0.82229,90,90,90 - - 7.11 X 42551
B-Gd-Si Gd5 Si3B0.6 CuHf5Sn3,hP18,193 P63/mcm 0.85055,0.85055,0.64172,90,90,120 AlB2 family - 7.24 X 47006
B-Gd-V GdVB4 YCrB4,oP24,55 Pbam 0.6022,1.166,0.3504,90,90,90 - - 6.79 A 5216
B-Gd-W GdWB4 YCrB4,oP24,55 Pbam 0.6066,1.171,0.3618,90,90,90 - - 9.93 A 6640
B-Gd-W Gd3 WB7 Er3CrB7,oS44,63 Cmcm 0.3499,1.617,0.9554,90,90,90 - - 8.99 A 25997
B-Ge-La La5Ge 3B CuHf5Sn3,hP18,193 P63/mcm 0.895,0.895,0.689,90,90,120 AlB2 family - 6.41 A 8292
B-Ge-Mo Mo1.7 Ge0.3 B Mg2 Cu,oF48,70 Fddd 0.457,0.786,1.541,90,90,90 - - 9.39 X 9849
B-Ge-Nb Nb5 Ge2B Cr5B3,tI32,140 I4/mcm 0.634,0.634,1.141,90,90,90 - - 8.99 A 9813
B-Ge-Nb Nb5 Ge3B CuHf5Sn3,hP18,193 P63/mcm 0.7666,0.7666,0.5387,90,90,120 AlB2 family - 8.40 A 9813
B-Ge-Ni Ni21 Ge2B6 m Cr21 W2C6,cF116,225 Fm-3m 1.0489,1.0489,1.0489,90,90,90 - - 8.30 A 2316
B-Ge-Ni Ni3.04 Ge0.96 B0.04 Cu3Au,cP4,221 Pm-3m 0.3569,0.3569,0.3569,90,90,90 close-packed structure - 9.08 F 19924
B-Ge-Ni Ni8Ge2B3 Ni8Ge2B3,oP26,59 Pmmn 0.296,1.474,0.6112,90,90,90 - - 8.06 X 16954
B-Ge-Ta Ta5Ge 2B Cr5B3,tI32,140 I4/mcm 0.632,0.632,1.151,90,90,90 - - 15.33 X 9813
B-Ge-Ta Ta5Ge 3B0.7 CuHf5Sn3,hP18,193 P63/mcm 0.76276,0.76276,0.52781,90,90,120 AlB2 family bronze 14.11 X 32681
B-Ge-Tb Tb5Ge 3B CuHf5Sn3,hP18,193 P63/mcm 0.849,0.849,0.637,90,90,120 AlB2 family - 8.55 A 8292
B-Ge-Ti Ti6Ge 2B K2UF6,hP9,189 P-62m 0.6853,0.6853,0.3392,90,90,120 Fe2P family - 5.34 A 49291
B-Ge-V V5Ge 3B CuHf5Sn3,hP18,193 P63/mcm 0.7316,0.7316,0.4987,90,90,120 AlB2 family - 6.94 A 9398
B-H-Hf Hf[BH4]4 Hf[BH4]4,cP5,215 P-43m 0.5827,0.5827,0.5827,90,90,90 - - 2.00 X 16038
B-H-I H13B10I mon1 H13B10I,mP88,14 P121/c1 1.398,1.211,1.434,90,120.6,90 - colorless 1.58 X 3527
B-H-I H13B10I mon2 H13B10I,mP44,14 P121/c1 0.71901,1.45748,1.06893,90,117.434,90 - - 1.66 X 50475
B-H-I H8B5I H8B5I,mS48,15 C12/c1 1.124,1.003,1.314,90,110.08,90 - colorless 1.80 X 2498
B-H-K H3KB3 H3KB3,cF32,225 Fm-3m 0.8839,0.8839,0.8839,90,90,90 - - 1.43 X 20643
B-H-K H5KB5 H5KB5,mP48,14 P121/c1 0.68227,1.11784,1.41964,90,115.313,90 - - 1.33 X 45761
B-H-K H6KB6 H6KB6,cF56,202 Fm-3 1.0629,1.0629,1.0629,90,90,90 - colorless 1.22 X 42323
B-H-K K[BH4] hp Na[BH4],tP12,114 P-421c 0.44754,0.44754,0.6363,90,90,90 - - 1.41 X 50848
B-H-K K[BH4] lt *,tP4,137 P42/nmc 0.47004,0.47004,0.65979,90,90,90 - - - N 43158
B-H-K K[BH4] lt1 Cs[ClO4],cF40,225 Fm-3m 0.66897,0.66897,0.66897,90,90,90 - white 1.20 X 50848
B-H-Li H6LiB6 H6LiB6,cP56,205 Pa-3 0.95771,0.95771,0.95771,90,90,90 - white 1.18 X 50485
B-H-Li LiBH4 hp2 Cs[ClO4],cF40,225 Fm-3m 0.5109,0.5109,0.5109,90,90,90 - - 1.08 X 49787
B-H-Li Li[BH4] hp1 Li[BH4],oS24,40 Ama2 0.64494,0.5307,0.52919,90,90,90 - - 0.80 X 49787
B-H-Li Li[BH4] hp3 Li[BH4],oP24,62 Pnma 0.7141,0.4431,0.6748,90,90,90 - - 0.68 X 50844
B-H-Li Li[BH4] ht Li[BH4],hP12,186 P63mc 0.42754,0.42754,0.69438,90,90,120 - - 0.66 X 51853
B-H-Mg Mg[BH4]2 cub Mg[BH4]2,cI72,230 Ia-3d 1.58234,1.58234,1.58234,90,90,90 - - 0.54 X 59206
B-H-Mg Mg[BH4]2 ht Mg[BH4]2,oF192,70 Fddd 1.09123,1.86476,3.7072,90,90,90 - white 0.76 X 48085
B-H-Mg Mg[BH4]2 rt Mg[BH4]2,hP90,178 P6122 1.0354,1.0354,3.7055,90,90,120 - colorless 0.78 X 52037
B-H-Mg Mg[BH4]2 tet Mg[BH4]2,tP6,102 P42nm 0.54361,0.54361,0.61468,90,90,90 - - 0.99 X 55617
B-H-Mn Mn[BH4]2 Mn[BH4]2,hP27,151 P3112 1.0435,1.0435,1.0835,90,90,120 - - 1.24 X 52794
B-H-N HBN[N3] HBN[N3],aP60,2 P-1 0.8579,0.9182,1.2043,104.62,90.26,110.74 - - 1.58 X 35753
B-H-N H11B9N[N3] H11B9N[N3],mP52,14 P121/c1 0.8318,0.5951,1.9265,90,95.3,90 - - 1.15 X 25874
B-H-N H12B10[NH3]2[N2H4 ] H12B10[NH3]2[N2H4],mS56,15 C12/c1 1.1596,1.0135,0.9772,90,98.15,90 - - 1.09 X 14608
B-H-N H2BN *,tP48,92 P41212 0.5463,0.5463,1.6315,90,90,90 - - 1.10 N 28557
B-H-N H2B[BH4][NH3]2 H2B[BH4][NH3]2,tI32,140 I4/mcm 1.0721,1.0721,0.92406,90,90,90 - - 0.77 X 53939
B-H-N H4BN H4BN,oP24,57 Pbcm 0.4383,1.2193,1.118,90,90,90 - - 0.96 X 58261
B-H-N H4B5N2 H4B5N2,mS56,15 C12/c1 1.7227,0.6658,1.1411,90,130.718,90 - - 1.15 X 15227
B-H-N H5BN H5BN,mP8,7 P1c1 0.73061,0.44678,0.76146,90,121.299,90 - white 0.93 X 57888
B-H-N H5B3N3 H5B3N3,mS48,15 C12/c1 0.932,2.0255,0.5462,90,121.57,90 - - 1.20 X 29953
B-H-N H5[NH4]B5 H5KB5,mP48,14 P121/c1 0.6965,1.14119,1.44169,90,114.165,90 - - 0.98 X 58199
B-H-N H6BN lt *,oP4,31 Pmn21 0.5523,0.4743,0.5023,90,90,90 - - 0.78 N 53212
B-H-N H6BN rt *,tI4,107 I4mm 0.5243,0.5243,0.5031,90,90,90 - - 0.74 N 53212
B-H-N H6B5[NH3] H6B5[NH3],oP48,62 Pnma 1.8096,0.7373,0.7223,90,90,90 - colorless 1.06 X 14608
B-H-N H6[NH4]B6 H6KB6,cF56,202 Fm-3 1.08781,1.08781,1.08781,90,90,90 - colorless 0.92 X 42323
B-H-N H7BN2 H7BN2,oP24,60 Pbcn 1.301,0.512,0.953,90,90,90 - - 0.96 X 3646
B-H-N H7B3[NH3] lt H7B3[NH3],mP16,14 P121/c1 0.9967,0.48041,1.09045,90,120.695,90 - - 0.84 X 52405
B-H-N H7B3[NH3] rt *,tI*,107 I4mm 0.611,0.611,0.657,90,90,90 - - - N 1101
B-H-N H8B5N5 H8B5N5,oP80,33 Pna21 1.2426,0.5184,2.2386,90,90,90 - - 1.22 X 29953
B-H-N H8[NH4]B3 H8[NH4]B3,oS16,63 Cmcm 0.7153,0.82648,0.83895,90,90,90 - colorless 0.78 X 56327
B-H-N [NH3BH3] hp1 [NH3BH3],oS8,36 Cmc21 0.59958,0.64301,0.60293,90,90,90 - - 0.88 X 53212
290 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-H-N [NH3BH3] hp2 *,aP32,1 P1 0.96233,1.02834,1.03318,89.99,88.98,89.97 - - 0.80 N 53953


B-H-N [NH3BH3] hp3 [NH3BH3],mP8,4 P1211 0.3898,0.5375,0.7713,90,97.22,90 - - 1.28 X 58802
B-H-N [NH3BH3] lt [NH3BH3],oP4,31 Pmn21 0.5541,0.4705,0.50237,90,90,90 - colorless 0.78 X 48011
B-H-N [NH3BH3] rt [NH3BH3],tI4,107 I4mm 0.5263,0.5263,0.50504,90,90,90 - - 0.73 X 48011
B-H-N [NH4][BH4 ] hp [NH4][BH4 ],oP4,28 Pma2 0.8001,0.3842,0.3822,90,90,90 - - 0.93 X 59207
B-H-Na H5NaB5 H5NaB5,mP48,14 P121/c1 0.66734,1.30218,1.18863,90,120.318,90 - - 1.22 X 45761
B-H-Na H6NaB6 H6NaB6,mP28,14 P121/c1 0.70093,1.0654,0.95145,90,132.568,90 - white 1.19 X 52783
B-H-Na H8NaB3 H8NaB3,oP8,59 Pmmn 0.47507,0.79244,0.58046,90,90,90 - white 0.96 X 54388
B-H-Na Na[BH4] hp1 Na[BH4],tP12,114 P-42 1c 0.40951,0.40951,0.563,90,90,90 - - 1.33 A 49364
B-H-Na Na[BH4] hp2 Ba[SO4],oP24,62 Pnma 0.7297,0.41166,0.55692,90,90,90 - - 1.50 X 49364
B-H-Na Na[BH4] hp3 NaCl,cF8,225 Fm-3m 0.61308,0.61308,0.61308,90,90,90 rocksalt family - 1.09 X 50276
B-H-Na Na[BH4] lt Na[BH4],tP4,137 P42 /nmc 0.43706,0.43706,0.59509,90,90,90 - - 1.11 X 54835
B-H-Np Np[BH4]4 Np[BH4]4,tP10,137 P42 /nmc 0.8559,0.8559,0.6017,90,90,90 - green dark 2.23 X 13280
B-H-O B[OH]2 B[OH]2,mP24,14 P121/c1 0.70421,0.7666,0.766,90,119.651,90 - colorless 1.66 X 42118
B-H-O HBO2 cub HBO2,cP72,218 P-43n 0.88811,0.88811,0.88811,90,90,90 metaborite colorless 2.49 X 36838
B-H-O HBO2 mon HBO2,mP36,14 P121/c1 0.6773,0.8842,0.7127,90,93.21,90 clinometaborite colorless 2.05 X 55850
B-H-O HBO2 orth HBO2,oP36,62 Pnma 0.9703,0.613,0.8019,90,90,90 - colorless 1.83 X 2085
B-H-O HB6[OH]6 HB6[OH]6 ,mP48,14 P121/c1 0.8237,0.8293,1.17182,90,134.519,90 - - 1.95 X 42982
B-H-O H26B20O H26B20O,mS84,15 C12/c1 2.4838,0.6816,1.0132,90,98.43,90 - - 1.01 X 13295
B-H-O H3[BO3] tricl H3[BO3],aP16,2 P-1 0.63472,0.70187,0.7035,119.76,92.49,101.46 sassolite - 1.56 X 18900
B-H-O H3[BO3] trig H3[BO3],hP24,144 P31 0.70453,0.70453,0.95608,90,90,120 - colorless 1.50 X 41165
B-H-Rb H5RbB5 H5KB5,mP48,14 P121/c1 0.70423,1.13688,1.45039,90,114.806,90 - - 1.82 X 45761
B-H-Rb H6RbB6 H6KB6,cF56,202 Fm-3 1.08674,1.08674,1.08674,90,90,90 - colorless 1.62 X 42323
B-H-Rb H9RbB10 H9RbB10,oP88,33 Pna21 1.2344,0.726,1.9014,90,90,90 - colorless 1.58 X 4020
B-H-Rb H9Rb2B9 H9Rb2B9,tP30,129 P4/nmm 0.633,0.633,1.15,90,90,90 - - 2.00 X 4033
B-H-Rb RbB3H3 *,c**,* - 0.916,0.916,0.916,90,90,90 - - - N 18471
B-H-Rb Rb[BH4] lt NaCl,cF8,225 Fm-3m 0.7029,0.7029,0.7029,90,90,90 rocksalt family - 1.92 X 624
B-H-S HBS2 HBS2,mP36,14 P121/c1 1.3949,0.4133,1.7532,90,114.76,90 - - 1.65 X 7141
B-H-S H14B10S orth1 H14B10S-a,oP44,19 P212121 0.71271,1.1684,1.188,90,90,90 - colorless 1.04 X 58265
B-H-S H14B10S orth2 H14B10S-b,oP44,19 P212121 0.71496,1.07261,1.27584,90,90,90 - colorless 1.05 X 58265
B-H-S H7B5S H7B5S,mP48,14 P121/c1 0.74989,1.18047,1.40416,90,120.171,90 - colorless 1.15 X 58265
B-H-S H8B9S H8B9S,mP40,14 P121/c1 0.6601,0.9777,1.32662,90,113.957,90 - - 1.17 X 9010
B-H-Se H11B11Se H11B11Se,cP96,205 Pa-3 0.9847,0.9847,0.9847,90,90,90 - colorless 1.45 X 20146
B-H-Sr H12SrB12 H12SrB12,hP26,159 P31c 0.70529,0.70529,1.14414,90,90,120 - - 1.55 X 58496
B-H-Tl H6TlB6 H6KB6,cF56,202 Fm-3 1.07551,1.07551,1.07551,90,90,90 - colorless 2.94 X 43954
B-H-U U[BH4]4 orth U[BH4]4,oS20,63 Cmcm 0.8014,0.794,1.1673,90,90,90 - green 2.66 X 19837
B-H-U U[BH4]4 tet U[BH4]4,tP20,92 P41212 0.749,0.749,1.324,90,90,90 - green dark 2.66 X 6664
B-H-Y Y[BH4]3 ht ReO3,cP4,221 Pm-3m 0.54768,0.54768,0.54768,90,90,90 - - 1.35 X 54331
B-H-Y Y[BH4]3 rt Y[BH4]3,cP32,205 Pa-3 1.0852,1.0852,1.0852,90,90,90 - - 1.39 X 51239
B-H-Zr Zr[BH4]4 rt Hf[BH4]4,cP5,215 P-43m 0.58387,0.58387,0.58387,90,90,90 - - 1.26 X 58798
B-Hf-Ir HfIr3B0.45 CaTiO3,cP5,221 Pm-3m 0.4,0.4,0.4,90,90,90 perovskite family - 19.72 X 12459
B-Hf-Ir HfIr3B4 ZrIr3B3.75 ,hP16,176 P63 /m 0.7548,0.7548,0.3487,90,90,120 - - 15.41 A 12459
B-Hf-Ir Hf3Ir5B2 Ti3Co5B2,tP20,127 P4/mbm 0.9261,0.9261,0.3323,90,90,90 - - 17.69 X 12459
B-Hf-Mg Mg0.8 Hf0.2 B2 AlB2,hP3,191 P6/mmm 0.3088,0.3088,0.3728,90,90,120 AlB2 family - 4.14 X 56821
B-Hf-Mo Hf0.05 Mo0.95 B2 ht AlB2,hP3,191 P6/mmm 0.305,0.305,0.313,90,90,120 AlB2 family - 8.01 X 3633
B-Hf-Mo Hf0.95 Mo0.05 B2 AlB2,hP3,191 P6/mmm 0.3198,0.3198,0.3465,90,90,120 AlB2 family - 10.60 X 12762
B-Hf-Mo Hf9Mo4B Hf9Mo4B,hP28,194 P63 /mmc 0.8565,0.8565,0.8493,90,90,120 - - 12.32 X 7664
B-Hf-Nb Hf0.6 Nb0.4 B2 AlB2,hP3,191 P6/mmm 0.3119,0.3119,0.343,90,90,120 AlB2 family - 9.53 X 3633
B-Hf-Ni Hf3Ni20B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0622,1.0622,1.0622,90,90,90 - - 9.83 X 56075
B-Hf-O HfB2O5 HfB2O5,mP32,14 P121/c1 0.43843,0.69048,0.89727,90,90.76,90 - - 6.85 X 49102
B-Hf-Os Hf9Os4B Hf9Mo4B,hP28,194 P63 /mmc 0.8512,0.8512,0.851,90,90,120 - - 14.79 A 7661
B-Hf-Re Hf0.2 Re2.8 B Re3B,oS16,63 Cmcm 0.2893,0.932,0.7271,90,90,90 - - 19.24 A 5568
B-Hf-Re Hf0.5 Re6.5 B3 Th7Fe3,hP20,186 P63 mc 0.7503,0.7503,0.4798,90,90,120 - - 18.91 A 5568
B-Hf-Re Hf9Re4B Hf9Mo4B,hP28,194 P63 /mmc 0.8456,0.8456,0.8524,90,90,120 - - 14.86 A 7661
B-Hf-Rh HfRh3B0.78 CaTiO3,cP5,221 Pm-3m 0.403,0.403,0.403,90,90,90 perovskite family - 12.58 X 12459
B-Hf-Si Hf5Si3B0.2 CuHf5Sn3,hP18,193 P63 /mcm 0.78557,0.78557,0.55262,90,90,120 AlB2 family - 11.01 X 54537
B-Hf-Ta Hf0.5 Ta2.5 B2 rt U3Si2,tP10,127 P4/mbm 0.6179,0.6179,0.3305,90,90,90 - - 14.82 A 6288
B-Hf-Ta Hf0.56 Ta2.44 B4 Ta3B4,oI14,71 Immm 0.3131,0.3326,1.423,90,90,90 - - 13.10 A 6288
B-Hf-Ta Hf0.6 Ta0.4 B TlI,oS8,63 Cmcm 0.3197,0.8978,0.3311,90,90,90 CrB(TlI)-FeB - 13.30 A 6288
B-Hf-Ta Hf0.6 Ta0.4 B2 AlB2,hP3,191 P6/mmm 0.3114,0.3114,0.3383,90,90,120 AlB2 family - 11.75 X 3633
B-Hf-Ti Hf0.5 Ti0.5 B2 AlB2,hP3,191 P6/mmm 0.30955,0.30955,0.33731,90,90,120 AlB2 family - 8.00 X 55921
B-Hf-U U0.75 Hf0.25 B12 UB12,cF52,225 Fm-3m 0.7459,0.7459,0.7459,90,90,90 - - 5.65 A 3633
B-Hf-U U0.9 Hf0.1 B2 AlB2,hP3,191 P6/mmm 0.3139,0.3139,0.397,90,90,120 AlB2 family - 12.44 X 3633
B-Hf-V Hf0.8 V0.2 B2 AlB2,hP3,191 P6/mmm 0.31,0.31,0.338,90,90,120 AlB2 family - 10.31 X 3633
B-Hf-W Hf0.06 W1.94 B CuAl2,tI12,140 I4/mcm 0.5577,0.5577,0.4757,90,90,90 - - 16.98 A 5568
B-Hf-W Hf0.2 W0.8 B TlI,oS8,63 Cmcm 0.3158,0.845,0.3072,90,90,90 CrB(TlI)-FeB - 15.69 A 5568
B-Hf-W Hf0.94 W0.06 B2 AlB2,hP3,191 P6/mmm 0.3135,0.3135,0.346,90,90,120 AlB2 family - 11.30 X 13264
B-Hf-W Hf9W3B2 Hf9Mo4B,hP28,194 P63 /mmc 0.8592,0.8592,0.8491,90,90,120 - - 13.33 X 6170
B-Hf-Zr Hf0.5 Zr0.5 B2 AlB2,hP3,191 P6/mmm 0.31542,0.31542,0.34954,90,90,120 AlB2 family - 8.63 X 54489
B-Hg-O HgB4O7 ht-hp SrB4O7,oP24,31 Pmn21 1.0656,0.4381,0.41872,90,90,90 - yellow pale 6.05 X 45863
B-Hg-O HgB4O7 rt CdB4O7,oP96,61 Pbca 0.83994,0.88066,1.4137,90,90,90 - colorless 4.52 X 41221
B-Hg-O Hg3[BO3]2 Ca3[BO3]2 ,hR66,167 R-3c 0.88936,0.88936,1.3052,90,90,120 - colorless 8.02 X 42438
B-Ho-Ir HoIr3B2 ErIr3B2,mS12,12 C12/m1 0.542,0.9393,0.3107,90,91.2,90 - - 16.03 A 14265
B-Ho-La La0.5 Ho0.5 B6 CaB6,cP7,221 Pm-3m 0.4126,0.4126,0.4126,90,90,90 - - 5.12 A 10076
B-Ho-Mn HoMnB4 YCrB4,oP24,55 Pbam 0.5901,1.138,0.3428,90,90,90 - - 7.59 A 5216
B-Ho-Mn Ho3MnB7 Er3CrB7,oS44,63 Cmcm 0.3421,1.5688,0.9292,90,90,90 - - 8.33 A 24692
B-Ho-Mo HoMoB3 ErMoB3,mP10,11 P121/m1 0.5416,0.3144,0.6784,90,101.72,90 - - 8.61 A 21849
B-Ho-Mo HoMoB4 YCrB4,oP24,55 Pbam 0.6019,1.162,0.3589,90,90,90 - - 8.05 A 6640
Handbook of Inorganic Substances – Edition 2015 : Data 291

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Ho-Mo HoMo3B7 YMo 3B7,oP44,62 Pnma 1.1014,0.31,1.284,90,90,90 - - 8.01 X 30110


B-Ho-Mo Ho3 MoB7 Er3CrB7,oS44,63 Cmcm 0.3483,1.6026,0.9411,90,90,90 - - 8.43 A 21849
B-Ho-Ni HoNiB4 ErNiB4,tI48,139 I4/mmm 0.7505,0.7505,0.8506,90,90,90 - - 7.40 A 27328
B-Ho-Ni HoNi12B6 orth CeNi12B6,oS76,36 Cmc21 0.9519,0.7364,1.0959,90,90,90 - - 8.08 A 21894
B-Ho-Ni HoNi12B6 rhom SrNi12B6,hR57,166 R-3m 0.9488,0.9488,0.7366,90,90,120 - - 8.10 X 25477
B-Ho-Ni HoNi2B2 HoNi2B2,mS20,15 C12/c1 0.8411,0.5199,0.6911,90,126.93,90 AlB2 family - 8.36 X 25428
B-Ho-Ni HoNi4B CeCo 4B,hP12,191 P6/mmm 0.49696,0.49696,0.69419,90,90,120 - gray 9.18 X 38330
B-Ho-Ni HoNi6.5B3 *,c**,* - 0.7446,0.7446,0.7446,90,90,90 - - - N 27328
B-Ho-Ni Ho2 NiB10 Th2NiB10,oP26,55 Pbam 0.5545,1.1086,0.4139,90,90,90 - - 6.48 A 37695
B-Ho-Ni Ho2 Ni10B5 Ho2Ni10B5,oP136,61 Pbca 0.9001,0.9477,1.7588,90,90,90 - - 8.60 X 25407
B-Ho-Ni Ho2 Ni15B6 rt Ho2Ni15B6,mP138,14 P121/c1 1.4223,1.0672,0.9582,90,94.23,90 - - 8.76 X 22887
B-Ho-Ni Ho2 Ni15B9 Ho2Ni15B9,oS208,64 Cmce 1.6001,1.1656,1.1323,90,90,90 - - 8.23 X 22902
B-Ho-Ni Ho2 Ni21B6 Cr21 W2C6,cF116,225 Fm-3m 1.0641,1.0641,1.0641,90,90,90 - - 8.97 X 25477
B-Ho-Ni Ho2 Ni3B6 Lu2Ni3B6,oS22,65 Cmmm 0.76865,0.86679,0.34742,90,90,90 - - 8.19 X 38328
B-Ho-Ni Ho3 Ni13B2 Nd3Ni13B2,hP18,191 P6/mmm 0.4943,0.4943,1.09,90,90,120 - - 9.21 A 27328
B-Ho-Ni Ho3 Ni19B10 Ho3Ni19B10,mS64,12 C12/m1 1.3177,0.8719,0.578,90,91.33,90 - - 8.60 X 24089
B-Ho-Ni Ho3 Ni7B2 Dy3Ni7B2,hP24,194 P63/mmc 0.5063,0.5063,1.428,90,90,120 Laves-CaCu5 - 9.72 A 27328
B-Ho-Ni Ho4 NiB14 Ho4NiB14,tP38,128 P4/mnc 0.72097,0.72097,0.74587,90,90,90 - - 7.45 X 39599
B-Ho-O HoB3O6 DyB3O6,oP160,62 Pnma 1.5919,0.7395,1.2233,90,90,90 - colorless 5.41 X 44103
B-Ho-O HoB5O9 GdB5O9,tI240,142 I41/acd 0.81769,0.81769,3.34525,90,90,90 - - 4.31 A 39962
B-Ho-O Ho[BO3] Y[BO3],hP18,194 P63/mmc 0.3784,0.3784,0.8836,90,90,120 - white 6.78 X 1908
B-Ho-O Ho2 B4O9 Gd2B4O9,mS300,15 C12/c1 2.509,0.43941,2.4742,90,99.83,90 - yellow pale 6.39 X 44196
B-Ho-O Ho31 B6[BO3]3O51 Ho31 B6[BO3]3O51,hR600,148 R-3 2.6579,2.6579,1.1469,90,90,120 - - 8.76 X 55371
B-Ho-O Ho4 B6O15 Ho4B6O15,mS100,15 C12/c1 1.1641,0.4367,1.8825,90,96.71,90 - - 6.74 X 42503
B-Ho-O Ho8.66 B2[BO3]2O13 Ho8.66 B2[BO3]2O13,mS66,12 C12/m1 1.8207,0.36685,1.4024,90,119.81,90 - - 7.26 X 40613
B-Ho-Os HoOsB2 LuRuB2,oP16,62 Pnma 0.585,0.5286,0.6355,90,90,90 - - 12.73 A 13562
B-Ho-Os HoOsB4 YCrB4,oP24,55 Pbam 0.5943,1.1495,0.3548,90,90,90 - - 10.92 A 12511
B-Ho-Os Ho2 OsB6 Y2ReB6,oP36,55 Pbam 0.91229,1.14909,0.3632,90,90,90 - - 10.20 A 17266
B-Ho-Pd HoPd3B CaTiO3,cP5,221 Pm-3m 0.4126,0.4126,0.4126,90,90,90 perovskite family - 11.70 X 14482
B-Ho-Re HoReB4 YCrB4,oP24,55 Pbam 0.5964,1.153,0.3565,90,90,90 - - 10.69 A 6640
B-Ho-Re Ho2 ReB6 Y2ReB6,oP36,55 Pbam 0.9151,1.152,0.3648,90,90,90 - - 10.03 A 7007
B-Ho-Re Ho3 ReB7 Er3CrB7,oS44,63 Cmcm 0.3515,1.5743,0.936,90,90,90 - - 9.70 A 19085
B-Ho-Rh HoRhB4 YCrB4,oP24,55 Pbam 0.59446,1.15292,0.35405,90,90,90 - - 8.52 A 50916
B-Ho-Rh HoRh3B CaTiO3,cP5,221 Pm-3m 0.4151,0.4151,0.4151,90,90,90 perovskite family - 11.25 X 17128
B-Ho-Rh HoRh3B2 ErIr3 B2,mS12,12 C12/m1 0.5366,0.9307,0.31,90,91.,90 - - 10.63 A 14265
B-Ho-Rh Ho0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5584,0.5584,0.8496,90,90,120 - - 8.96 A 18557
B-Ho-Rh Ho2 RhB6 Y2ReB6,oP36,55 Pbam 0.9117,1.1458,0.36262,90,90,90 - - 8.73 A 44613
B-Ho-Ru HoRuB2 LuRuB2,oP16,62 Pnma 0.5875,0.5287,0.6332,90,90,90 - - 9.71 A 13562
B-Ho-Ru HoRuB4 YCrB4,oP24,55 Pbam 0.5933,1.148,0.3533,90,90,90 - - 8.54 A 12511
B-Ho-Ru HoRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5474,0.5474,0.3017,90,90,120 - - 10.39 X 13749
B-Ho-Ru HoRu4B4 LuRu4B4,tI72,142 I41/acd 0.7442,0.7442,1.4975,90,90,90 - - 9.81 A 11021
B-Ho-Ru Ho2 RuB6 Y2ReB6,oP36,55 Pbam 0.91083,1.14666,0.36407,90,90,90 - - 8.66 A 17266
B-Ho-S Ho3 B1.67S7 Cu2U3S7,hP24,173 P63 0.93703,0.93703,0.58826,90,90,120 - red 5.47 X 56910
B-Ho-Sc Sc0.25 Ho0.75 B4 UB4 ,tP20,127 P4/mbm 0.706,0.706,0.399,90,90,90 - - 5.95 A 26733
B-Ho-Sc Sc0.4 Ho0.6 B2 AlB2 ,hP3,191 P6/mmm 0.3225,0.3225,0.3708,90,90,120 AlB2 family - 6.89 X 26733
B-Ho-Sc Sc0.5 Ho0.5 B12 UB12 ,cF52,225 Fm-3m 0.744,0.744,0.744,90,90,90 - - 3.78 A 26733
B-Ho-Sc Sc0.6 Ho0.4 B2 AlB2 ,hP3,191 P6/mmm 0.3155,0.3155,0.354,90,90,120 AlB2 family - 6.23 X 26733
B-Ho-Si HoSi0.6 B1.4 AlB2 ,hP3,191 P6/mmm 0.34078,0.34078,0.39849,90,90,120 AlB2 family - 8.16 X 46652
B-Ho-Si Ho2.1 Si9B36 Tb1.8 Si8B36C2,hR147,166 R-3m 1.0063,1.0063,1.6365,90,90,120 - - 3.43 A 41869
B-Ho-Si Ho5 Si2B8 Y5Si1.9 B8,tP30,127 P4/mbm 0.7183,0.7183,0.799,90,90,90 - - 7.79 X 45149
B-Ho-Si Ho5 Si3B CuHf5Sn3,hP18,193 P63/mcm 0.83317,0.83317,0.62392,90,90,120 AlB2 family - 8.14 X 47006
B-Ho-V HoVB4 YCrB4,oP24,55 Pbam 0.5068,1.1563,0.3438,90,90,90 - - 8.54 A 27952
B-Ho-W HoWB4 YCrB4,oP24,55 Pbam 0.6029,1.163,0.3591,90,90,90 - - 10.34 A 6640
B-Ho-W Ho3 WB7 Er3CrB7,oS44,63 Cmcm 0.3447,1.586,0.9464,90,90,90 - - 9.68 A 25997
B-I-La La4B4I5 La4B4I5,mS28,12 C12/m1 1.9246,0.4342,1.0283,90,108.28,90 - green blue 5.02 X 33371
B-I-Nd Nd4 B4I5 La4B4I5,mS28,12 C12/m1 1.8831,0.42997,0.9978,90,107.18,90 - green blue 5.40 A 33371
B-I-Pr Pr4B4I5 La4B4I5,mS28,12 C12/m1 1.8896,0.4314,1.0039,90,107.39,90 - green blue 5.28 A 33371
B-I-S BSI *,mP36,14 P121/c1 1.443,0.4233,1.797,90,115.7,90 - - - N 8083
B-I-Tb Tb4BI5 *,mS20,12 C12/m1 1.8637,0.4057,0.8559,90,103.38,90 - - 6.76 N 35713
B-I-Tb Tb7BI12 Sc7NCl12,hR60,148 R-3 1.5283,1.5283,1.0321,90,90,120 - - 6.31 A 35713
B-I-Y Y4BI5 *,mS20,12 C12/m1 1.8634,0.405,0.8534,90,103.14,90 - - 5.30 N 35713
B-I-Zr Zr6BI12 Zr6CI12,hR57,148 R-3 1.4534,1.4534,0.9986,90,90,120 - - 5.67 X 19026
B-In-Ir Ir3In3B Ir3In3B,hP16,189 P-62m 0.68578,0.68578,0.2873,90,90,120 - gray dark 13.23 X 47031
B-In-Ir Ir9In5B4 Ir9In5B4,hP18,189 P-62m 0.559,0.559,1.0326,90,90,120 - gray dark 13.95 X 47031
B-In-La La3InB CaTiO3,cP5,221 Pm-3m 0.5095,0.5095,0.5095,90,90,90 perovskite family - 6.81 X 30305
B-In-Mg Mg0.9 In0.1 B2 AlB2 ,hP3,191 P6/mmm 0.3081,0.3081,0.352,90,90,120 AlB2 family - 3.15 X 52357
B-In-Ni Ni21 In2B6 Cr21 W2C6,cF116,225 Fm-3m 1.05911,1.05911,1.05911,90,90,90 - gray dark 8.54 X 36644
B-In-Ni Ni3InB0.5 CaTiO3,cP5,221 Pm-3m 0.3773,0.3773,0.3773,90,90,90 perovskite family - 9.16 X 2425
B-In-O In[BO3] Ca[CO3],hR30,167 R-3c 0.48217,0.48217,1.5438,90,90,120 - white 5.57 X 28422
B-In-Rh Rh3In3B Ir3In3B,hP16,189 P-62m 0.67847,0.67847,0.28861,90,90,120 - gray dark 9.58 X 47031
B-In-Sc Sc3In1.3 B0.7 CaTiO3,cP5,221 Pm-3m 0.466,0.466,0.466,90,90,90 perovskite family - 4.79 X 47389
B-Ir-La LaIr2B2 CaRh2B2,oF40,70 Fddd 0.606,0.942,1.064,90,90,90 - - 11.92 A 56621
B-Ir-La LaIr3B2 CeCo 3B2,hP6,191 P6/mmm 0.5543,0.5543,0.3116,90,90,120 - - 14.76 X 13749
B-Ir-La LaIr4B4 NdCo 4B4,tP18,86 P42/n 0.76719,0.76719,0.39739,90,90,90 - - 13.50 X 13546
B-Ir-Li LiIrB LiIrB,oF48,70 Fddd 0.6116,0.9154,1.0466,90,90,90 - black 9.52 X 28771
B-Ir-Lu LuIr3B2 ErIr3 B2,mS12,12 C12/m1 0.5394,0.9354,0.308,90,91.4,90 - - 16.53 A 14265
B-Ir-Mg MgIrB MgRhB,hP18,180 P6222 0.52752,0.52752,0.9439,90,90,120 - black 9.96 X 53554
B-Ir-Mg Mg10 Ir19B16 Mg10 Ir19B16,cI90,217 I-43m 1.05678,1.05678,1.05678,90,90,90 - - 11.45 X 47373
292 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Ir-Mg Mg2IrB1.65 Mg2IrB1.65 ,mS22,12 C12/m1 0.858,0.4846,0.6836,90,115.72,90 - gray 6.71 X 19728


B-Ir-Mg Mg2Ir0.7 B6.6 Mg2Rh0.75 B6.50 ,oP44,55 Pbam 0.87783,1.10671,0.35635,90,90,90 - gray 4.88 X 53556
B-Ir-Mn Mn16Ir7B6 Cr23C6,cF116,225 Fm-3m 1.1155,1.1155,1.1155,90,90,90 - - 10.96 A 7660
B-Ir-Mo Mo0.6Ir0.4B2 ReB2,hP6,194 P63 /mmc 0.2928,0.2928,0.7483,90,90,120 - - 9.33 A 11699
B-Ir-Mo Mo2IrB2 Mo2IrB2,oP20,58 Pnnm 0.7356,0.9422,0.3231,90,90,90 - - 12.03 X 6887
B-Ir-Mo Mo2.5Ir2.5B5 W2Ir3B5,oI22,71 Immm 0.2871,0.4733,1.5675,90,90,90 - - 12.08 X 6887
B-Ir-Na NaIr3B4 NaIr3B4,oS68,67 Cmme 0.9916,1.1366,0.8271,90,90,90 - - 9.16 X 21361
B-Ir-Nb Nb7Ir6B8 Nb7Ru6B8 ,hP21,175 P6/m 0.93178,0.93178,0.33192,90,90,120 - - 12.58 A 58368
B-Ir-Nd NdIr2B2 CaRh2B2,oF40,70 Fddd 0.597,0.9334,1.0654,90,90,90 - - 12.31 A 24867
B-Ir-Nd NdIr3B2 ErIr3B2,mS12,12 C12/m1 0.5513,0.954,0.3084,90,90.8,90 - - 15.21 A 14265
B-Ir-Nd NdIr4B4 NdCo4B4,tP18,86 P42 /n 0.7616,0.7616,0.3974,90,90,90 - - 13.78 X 12577
B-Ir-Ni Ir8.7 Ni12.3 B10.4 Ni20Ga1.6 B10.1 ,cF148,225 Fm-3m 1.09323,1.09323,1.09323,90,90,90 - - 12.74 X 54961
B-Ir-Pd IrPdB CuIrB,oF48,43 Fdd2 0.8771,1.0131,0.6621,90,90,90 - - 13.97 X 28771
B-Ir-Pr PrIr2B2 CaRh2B2,oF40,70 Fddd 0.59928,0.93523,1.06506,90,90,90 - - 12.17 X 56621
B-Ir-Pr PrIr3B2 CeCo 3B2,hP6,191 P6/mmm 0.55105,0.55105,0.31031,90,90,120 - - 15.04 X 41709
B-Ir-Pr PrIr4B4 NdCo4B4,tP18,86 P42 /n 0.7629,0.7629,0.3974,90,90,90 - - 13.68 A 14295
B-Ir-Pu PuIr3B2 ErIr3B2,mS12,12 C12/m1 0.54733,0.94748,0.30912,90,90.99,90 - - 17.45 A 19134
B-Ir-Pu PuIr4B4 NdCo4B4,tP18,86 P42 /n 0.76048,0.76048,0.39762,90,90,90 - - 15.25 A 19134
B-Ir-Sc ScIr3B CaTiO3,cP5,221 Pm-3m 0.3999,0.3999,0.3999,90,90,90 perovskite family - 16.42 X 10736
B-Ir-Sc ScIr3B2 ErIr3B2,mS12,12 C12/m1 0.5344,0.9307,0.3062,90,92.1,90 - - 14.04 A 14265
B-Ir-Sc ScIr3B3.75 ZrIr3B3.75 ,hP16,176 P63 /m 0.7576,0.7576,0.3442,90,90,120 - - 12.85 X 12459
B-Ir-Sc Sc2IrB6 Y2ReB6,oP36,55 Pbam 0.89149,1.1211,0.34837,90,90,90 - - 6.62 A 44881
B-Ir-Sc Sc3Ir5B2 Mg2Ir5SiB2,tP20,127 P4/mbm 0.9526,0.9526,0.3048,90,90,90 - - 13.42 A 34242
B-Ir-Sm SmIr2B2 CaRh2B2,oF40,70 Fddd 0.5892,0.9298,1.0718,90,90,90 - - 12.59 A 24867
B-Ir-Sm SmIr3B2 ErIr3B2,mS12,12 C12/m1 0.5492,0.9506,0.3076,90,90.8,90 - - 15.49 A 14265
B-Ir-Sm SmIr4B4 NdCo4B4,tP18,86 P42 /n 0.759,0.759,0.3976,90,90,90 - - 13.96 A 12590
B-Ir-Sn Ir6Sn5B2 Ir6Sn5B2,hP13,189 P-62m 0.65897,0.65897,0.55919,90,90,120 - gray 13.96 X 32484
B-Ir-Sn Ir7Sn4B3 Ir7Sn4B3,hP28,176 P63 /m 0.92663,0.92663,0.56319,90,90,120 - gray 14.69 X 32484
B-Ir-Sr SrIr2B2 CaRh2B2,oF40,70 Fddd 0.6027,0.9404,1.0723,90,90,90 - gray 10.79 X 12862
B-Ir-Ta Ta7Ir6B8 Nb7Ru6B8 ,hP21,175 P6/m 0.92885,0.92885,0.33164,90,90,120 - - 16.80 A 58368
B-Ir-Tb TbIr2B2 CaRh2B2,oF40,70 Fddd 0.5782,0.9255,1.0811,90,90,90 - - 12.97 A 24867
B-Ir-Tb TbIr3B2 ErIr3B2,mS12,12 C12/m1 0.5459,0.9464,0.3084,90,91.1,90 - - 15.79 A 14265
B-Ir-Tb TbIr4B4 NdCo4B4,tP18,86 P42 /n 0.7557,0.7557,0.3979,90,90,90 - - 14.19 A 12590
B-Ir-Th ThIr3B2 CeCo 3B2,hP6,191 P6/mmm 0.5449,0.5449,0.323,90,90,120 - - 16.60 X 13749
B-Ir-Th ThIr4B4 NdCo4B4,tP18,86 P42 /n 0.7668,0.7668,0.3972,90,90,90 - - 14.85 A 13546
B-Ir-Tm TmIr3B2 ErIr3B2,mS12,12 C12/m1 0.5404,0.9371,0.3097,90,91.3,90 - - 16.25 A 14265
B-Ir-Tm TmIr4B4 CeCo 4B4,tP18,137 P42 /nmc 0.5404,0.5404,0.7281,90,90,90 - - 15.32 A 12773
B-Ir-U UIr3B2 CeCo 3B2,hP6,191 P6/mmm 0.5369,0.5369,0.3181,90,90,120 - - 17.49 X 13749
B-Ir-V V2IrB2 Mo2IrB2,oP20,58 Pnnm 0.7145,0.9221,0.3126,90,90,90 - - 10.18 A 9240
B-Ir-W W0.52 Ir0.38 B2 ReB2,hP6,194 P63 /mmc 0.2926,0.2926,0.7559,90,90,120 - - 11.27 A 5470
B-Ir-W W2Ir3B5 W2Ir3B5,oI22,71 Immm 0.2875,0.4715,1.5707,90,90,90 - - 15.57 X 6887
B-Ir-Y YIr2B2 CaRh2B2,oF40,70 Fddd 0.5751,0.9247,1.0832,90,90,90 - - 11.42 X 24867
B-Ir-Y YIr3B2 ErIr3B2,mS12,12 C12/m1 0.5432,0.9398,0.3099,90,90.38,90 - - 14.43 X 43146
B-Ir-Y YIr4B4 NdCo4B4,tP18,86 P42 /n 0.7547,0.7547,0.398,90,90,90 - - 13.20 A 12590
B-Ir-Yb YbIr3B2 ErIr3B2,mS12,12 C12/m1 0.5401,0.9353,0.3099,90,91.3,90 - - 16.37 A 14265
B-Ir-Zn ZnIr2B2 CeAl2Ga2,tI10,139 I4/mmm 0.29631,0.29631,1.26208,90,90,90 - - 14.13 X 26096
B-Ir-Zn ZnIr4B3 ZnIr4B3,oP16,47 Pmmm 0.27998,0.28196,2.3177,90,90,90 - - 15.73 X 26096
B-Ir-Zn Zn2Ir2B Zn2Ir2B,oS60,63 Cmcm 0.28085,2.6571,1.0239,90,90,90 - - 13.72 X 26096
B-Ir-Zn Zn5Ir7B3 Zn5Ir7B3,oP30,51 Pmma 1.1161,0.28496,1.1781,90,90,90 - gray silver 15.11 X 36668
B-Ir-Zn Zn6Ir11B5.4 Zn6Ir11B5.36 ,oP23,47 Pmmm 0.2868,0.8471,1.1384,90,90,90 - - 15.40 X 26096
B-Ir-Zr ZrIr3B0.5 CaTiO3,cP5,221 Pm-3m 0.4012,0.4012,0.4012,90,90,90 perovskite family - 17.31 X 12459
B-Ir-Zr ZrIr3B3.75 ZrIr3B3.75 ,hP16,176 P63 /m 0.756,0.756,0.3512,90,90,120 - - 13.53 X 11332
B-Ir-Zr Zr2Ir6B K2PtCl6,cF36,225 Fm-3m 0.79906,0.79906,0.79906,90,90,90 fluorite family gray silver 17.53 X 55042
B-K-O KBO2 KBO2,hR72,167 R-3c 1.276,1.276,0.734,90,90,120 - - 2.37 X 4969
B-K-O KB3O5 hp KB3O5,mS72,15 C12/c1 0.96082,0.87704,0.90986,90,104.35,90 - colorless 2.71 X 56147
B-K-O KB3O5 KB3O5,mP108,14 P121/c1 0.9319,0.66448,2.1094,90,94.38,90 - - 2.32 X 42846
B-K-O KB5O8 ht KB5O8-a,oP112,61 Pbca 0.8383,0.8418,2.154,90,90,90 - - 1.93 X 6396
B-K-O KB5O8 rt KB5O8-b,oP112,61 Pbca 0.7418,1.1702,1.4745,90,90,90 - - 2.30 X 2445
B-K-O K2B4O7 K2B4O7,aP52,2 P-1 0.6484,0.9604,1.0413,89.28,77.25,78.75 - - 2.50 X 6454
B-K-O K5B19O31 K5B19O31,mS220,15 C12/c1 1.7888,1.1479,1.2973,90,95.52,90 - - 2.25 X 7935
B-K-P K3BP 2 K3BP 2,mS24,15 C12/c1 0.9362,0.8894,0.9013,90,110.99,90 - yellow 1.80 X 24259
B-K-S KBS2 KBO2,hR72,167 R-3c 1.552,1.552,0.8424,90,90,120 - white 1.94 X 26635
B-K-S K2B2S7 Na2B2Se7,mS44,15 C12/c1 1.47404,0.6827,1.166,90,122.45,90 - yellowish 2.18 X 29542
B-K-S K3BS3 K3BS3,mP28,14 P121/c1 1.0061,0.621,1.2538,90,112.97,90 - colorless 2.07 X 39559
B-K-Se K2B2Se7 Na2B2Se7,mS44,15 C12/c1 1.54462,0.7054,1.2092,90,120.404,90 - yellowish 3.81 X 29542
B-K-Se K4B9Se9 K4B9Se9,mS264,8 C1m1 1.6288,4.1617,0.9788,90,109.59,90 - colorless 3.07 X 42318
B-K-Si K3.5 Si19.5 B3.5 K3.5 Si15(Si0.56 B0.44 )8,cP118,223 Pm-3n 0.9952,0.9952,0.9952,90,90,90 clathrate - 2.43 X 47821
B-La-N LaBN2 LaBN2,aP24,2 P-1 0.6613,0.687,0.7798,106.06,90.55,115.63 - colorless 5.83 X 35398
B-La-N La15B8N25 Ce15B8N25 ,hR288,167 R-3c 1.47274,1.47274,2.14545,90,90,120 - - 6.23 A 22038
B-La-N La3B2N4 Ce3B2N4,oI18,71 Immm 0.36294,0.64125,1.0972,90,90,90 - black 6.43 X 36674
B-La-N La3B2N5 La3B2N5,mP80,14 P121/c1 0.97189,1.47941,0.76232,90,90.005,90 - black 6.16 X 39481
B-La-N La4B2N5 Ce4B2N5,mS22,12 C12/m1 1.2604,0.36615,0.9198,90,129.727,90 - - 6.58 A 39554
B-La-N La5B2N6 La5B2N6,mS26,12 C12/m1 1.2595,0.36853,0.9094,90,106.03,90 - black 6.55 X 38227
B-La-N La5B4N9 La5B4N9,oP72,57 Pbcm 0.98825,1.26348,0.77033,90,90,90 - black 5.97 X 36674
B-La-Nd La0.6 Nd0.4 B6 CaB6,cP7,221 Pm-3m 0.4148,0.4148,0.4148,90,90,90 - - 4.79 A 26046
B-La-Ni LaNi12B6 CeNi12B6,oS76,36 Cmc21 0.9598,0.7414,1.1075,90,90,90 - - 7.65 X 23406
B-La-Ni LaNi3B LaNi3B,oI20,74 Imma 0.49698,0.71337,0.83001,90,90,90 - - 7.35 X 44693
B-La-Ni LaNi4B CeCo 4B,hP12,191 P6/mmm 0.51213,0.51213,0.69879,90,90,120 - - 8.05 A 44693
Handbook of Inorganic Substances – Edition 2015 : Data 293

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-La-Ni La2Ni5B4 Nd2Ni5B4,mS22,12 C12/m1 0.9786,0.5158,0.67889,90,125.205,90 - - 7.29 X 18989


B-La-Ni La3Ni13B2 Nd3Ni13B2,hP18,191 P6/mmm 0.5094,0.5094,1.0986,90,90,120 - - 8.08 A 16144
B-La-O LaB3O6 hp mon BiB3 O6-b,mP40,14 P121/c1 0.42427,1.17217,0.7304,90,91.15,90 - colorless 4.89 X 47532
B-La-O LaB3O6 hp orth CeB3O6,oP40,29 Pca21 1.8482,0.44781,0.4308,90,90,90 - colorless 4.98 A 43986
B-La-O LaB3O6 LaB3O6,mS40,15 C12/c1 0.99939,0.8172,0.6509,90,127.121,90 - - 4.19 X 14614
B-La-O LaB5O9 LaB5O9,mP60,14 P121/c1 0.64418,1.16888,0.81706,90,105.167,90 - - 3.77 X 41375
B-La-O La[BO3] ht La[BO3],mP10,11 P121/m1 0.4186,0.5084,0.6348,90,107.89,90 - colorless 5.11 X 6353
B-La-O La[BO3] rt Ca[CO3]-a,oP20,62 Pnma 0.58744,0.51087,0.82581,90,90,90 - colorless 5.30 X 45951
B-La-O La26 [BO3]8O27 La26 [BO3]8O27,mP86,14 P121/c1 0.692,1.2923,1.4571,90,99.41,90 - colorless 5.83 X 32119
B-La-O La4B10O21 Pr4B10O21,mP140,14 P121/c1 0.7167,1.9715,1.15903,90,124.403,90 - colorless 4.91 X 59571
B-La-O La4B14O27 La4B14O27,mS180,15 C12/c1 1.12084,0.64198,2.5372,90,100.125,90 - colorless 4.21 X 51554
B-La-Os LaOs2B2 CeRu2B2,oF40,22 F222 0.65159,0.92152,1.02105,90,90,90 - - 11.72 A 20360
B-La-Os LaOs4B4 NdCo 4B4,tP18,86 P42/n 0.7611,0.7611,0.3998,90,90,90 - - 13.52 A 14295
B-La-Pb La5Pb3B CuHf5Sn3,hP18,193 P63/mcm 0.9537,0.9537,0.6997,90,90,120 AlB2 family - 8.00 A 29066
B-La-Pd LaPd3B CaTiO3,cP5,221 Pm-3m 0.4225,0.4225,0.4225,90,90,90 perovskite family - 10.32 X 14518
B-La-Pd LaPd8B1.54 CePd8B1.54 ,mS132,15 C12/c1 1.78304,1.04191,1.16737,90,118.49,90 - - 10.53 X 54693
B-La-Pd La2Pd15B5 Nd2Pd14.9 B4.9,tI96,141 I41/amd 0.8612,0.8612,1.6643,90,90,90 - - 10.37 A 52631
B-La-Pd La3Pd23.25 B7.93 La3Pd23.25 B7.93 ,mP142,14 P121/c1 1.17567,1.05757,1.60664,90,102.179,90 - - 10.12 X 52812
B-La-Pd La3Pd23.75 B6 Ce3Pd23.75 B6,mP140,14 P121/c1 1.17459,1.05683,1.6049,90,102.18,90 - - 10.26 A 54693
B-La-Pd La6Pd46.81 B6 La6Pd46.81 B6,mS130,12 C12/m1 1.03988,1.81941,1.02418,90,108.168,90 - - 10.60 X 54891
B-La-Pr La0.7 Pr0.3 B6 CaB6,cP7,221 Pm-3m 0.41495,0.41495,0.41495,90,90,90 - - 4.75 A 26046
B-La-Pt LaPt2B CePt2B,hP12,180 P6222 0.55222,0.55222,0.78978,90,90,120 - - 12.90 X 42224
B-La-Pt LaPt3B CePt3B,tP5,99 P4mm 0.40317,0.40317,0.51066,90,90,90 - - 14.70 A 41718
B-La-Pt LaPt4B CeCo 4B,hP12,191 P6/mmm 0.54661,0.54661,0.76011,90,90,120 - - 15.71 A 42926
B-La-Re LaRe 4B4 *,t**,* - 0.74,0.74,1.06,90,90,90 - - - N 11012
B-La-Re La2Re 3B7 La2Re3B7,oP48,54 Pcca 0.7681,0.6773,1.1658,90,90,90 - - 9.99 X 15106
B-La-Rh LaRh3B CaTiO3,cP5,221 Pm-3m 0.4242,0.4242,0.4242,90,90,90 perovskite family gray silver 9.97 X 17128
B-La-Rh LaRh3B2 CeCo 3B2,hP6,191 P6/mmm 0.5483,0.5483,0.3142,90,90,120 - - 9.53 X 18419
B-La-Rh La0.81 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5642,0.5642,0.8546,90,90,120 - - 9.36 X 18086
B-La-Rh La2Rh5B4 Ca2Rh5B4,oF44,69 Fmmm 0.5515,0.9964,1.1343,90,90,90 - - 8.90 X 23557
B-La-Ru LaRu2B2 CeRu2B2,oF40,22 F222 0.64369,0.92159,1.016,90,90,90 - - 7.99 A 20360
B-La-Ru LaRu4B4 NdCo 4B4,tP18,86 P42/n 0.7541,0.7541,0.4012,90,90,90 - - 8.54 X 12198
B-La-Ru La0.94 Ru3B2 CeCo 3B2,hP6,191 P6/mmm 0.55831,0.55831,0.30272,90,90,120 - - 9.25 X 49037
B-La-Ru La3Ru8B6 Ca3Rh8B6,oF68,69 Fmmm 0.55607,0.98035,1.75524,90,90,90 - - 8.96 X 49037
B-La-Sm La0.59 Sm0.41 B6 CaB6,cP7,221 Pm-3m 0.41546,0.41546,0.41546,90,90,90 - - 4.83 A 13632
B-La-Sr Sr0.5 La0.5 B6 CaB6,cP7,221 Pm-3m 0.4172,0.4172,0.4172,90,90,90 - - 4.07 A 11613
B-La-Tm La0.6 Tm0.4 B6 CaB6,cP7,221 Pm-3m 0.4134,0.4134,0.4134,90,90,90 - - 5.07 A 16207
B-La-W La0.1 W0.9 B0.6 rt MoB,tI16,141 I41/amd 0.327,0.327,1.68,90,90,90 - - 13.74 A 3095
B-La-W La0.1 W1.9 B CuAl2,tI12,140 I4/mcm 0.559,0.559,0.4655,90,90,90 - white 17.08 A 3095
B-La-W La0.5 W0.5 B6 CaB6,cP7,221 Pm-3m 0.4159,0.4159,0.4159,90,90,90 - violet 5.22 A 3095
B-La-Y La0.5 Y0.5 B6 CaB6,cP7,221 Pm-3m 0.413,0.413,0.413,90,90,90 - - 4.21 A 19651
B-La-Y La0.6 Y0.4 B4 UB4 ,tP20,127 P4/mbm 0.714,0.714,0.412,90,90,90 - - 5.13 A 19651
B-Li-Mg Li0.11 Mg0.89 B2 AlB2 ,hP3,191 P6/mmm 0.30826,0.30826,0.35109,90,90,120 AlB2 family - 2.53 X 51257
B-Li-N Li3BN2 ht Li3BN2,mP24,14 P121/c1 0.515,0.70824,0.67908,90,112.956,90 - colorless 1.74 X 19334
B-Li-N Li3BN2 rt Li3BN2,tP12,136 P42/mnm 0.46435,0.46435,0.52592,90,90,90 - - 1.75 X 20425
B-Li-N Li3BN2 tet Li3BN2,tI48,141 I41/amd 0.65992,0.65992,1.03483,90,90,90 - - 1.76 X 46748
B-Li-Ni Li1.2 Ni2.5 B2 MgNi3B2,hP18,180 P6222 0.4842,0.4842,0.8664,90,90,120 - - 5.00 X 11107
B-Li-Ni Li2.75 Ni16B7.75 Li3Ni16B8,tP54,127 P4/mbm 0.8216,0.8216,0.7414,90,90,90 - - 6.92 X 13816
B-Li-Ni Li3Ni20B6 Cr23 C6,cF116,225 Fm-3m 1.0478,1.0478,1.0478,90,90,90 - - 7.27 X 13816
B-Li-O LiBO2 ht1 CaGeN2,tI16,122 I-42d 0.41961,0.41961,0.65112,90,90,90 - colorless 2.88 X 3150
B-Li-O LiBO2 ht2 *,mP24,* - 0.7317,0.4603,0.7967,90,111.3,90 - - 1.98 N 30892
B-Li-O LiBO2 ht3 *,mP48,* - 0.7258,0.8959,0.7708,90,110.7,90 - - 2.11 N 30892
B-Li-O LiBO2 ht4 *,m*72,* - 0.8902,0.9055,0.9343,90,114.5,90 - - 2.17 N 30892
B-Li-O LiBO2 ht5 *,m*64,* - 0.7339,0.8314,0.9894,90,102.3,90 - - 2.24 N 30892
B-Li-O LiBO2 mon7 *,mP*,* - 1.1201,0.566,1.6227,90,93.15,90 - - - N 25176
B-Li-O LiBO2 rt LiBO2,mP16,14 P121/c1 0.5845,0.4353,0.6454,90,115.09,90 - colorless 2.22 X 15935
B-Li-O LiB3O5 hp LiB3 O5,oP144,62 Pnma 0.8297,0.7596,1.7268,90,90,90 - colorless 2.91 X 56888
B-Li-O LiB3O5 LiB3 O5,oP36,33 Pna21 0.8447,0.73789,0.51408,90,90,90 - colorless 2.47 X 25849
B-Li-O LiB5O8 *,mS112,15 C12/c1 1.0896,1.6014,1.33,90,112.72,90 - white 1.17 N 33189
B-Li-O Li2B4O7 Li2B4O7,tI104,110 I41cd 0.9475,0.9475,1.0283,90,90,90 diomignite colorless 2.43 X 51533
B-Li-O Li2B8O13 ht *,oP*,* - 0.7521,0.9723,1.5506,90,90,90 - - - N 25176
B-Li-O Li2B8O13 rt *,mP*,* - 0.9667,0.7789,1.7764,90,100.95,90 - white - N 33189
B-Li-O Li3B7O12 Li3B7O12,aP44,2 P-1 0.6487,0.784,0.851,92.11,104.85,99.47 - - 2.33 X 23164
B-Li-O Li3[BO3] rt Li3[BO3],mP28,14 P121/c1 0.3265,0.918,0.8316,90,101.05,90 - colorless 2.16 X 5718
B-Li-O Li7.4 B18O0.7 Li7.8 B18O0.9,hP34,191 P6/mmm 0.8223,0.8223,0.416,90,90,120 - red 1.75 X 49497
B-Li-Pd Li2Pd3B Mo3 Al2C,cP24,213 P4132 0.67534,0.67534,0.67534,90,90,90 - gray 7.42 X 33501
B-Li-Pt LiPt3B LiPt3B,hP15,189 P-62m 0.9236,0.9236,0.2768,90,90,120 - - 14.69 X 21374
B-Li-Pt Li2Pt3B Mo3 Al2C,cP24,213 P4132 0.67552,0.67552,0.67552,90,90,90 - gray 13.14 X 33501
B-Li-Rh Li2Rh3B2 Li2Rh3B2,oP14,55 Pbam 0.57712,0.94377,0.28301,90,90,90 - - 7.42 X 48933
B-Li-S Li10 B10S20 Li10B10S20,mS316,15 C12/c1 2.0996,2.1157,1.6197,90,128.53,90 - colorless 1.93 X 24126
B-Li-S Li2B2S5 Li2B2S5,oS36,63 Cmcm 1.5864,0.6433,0.6862,90,90,90 - pink flesh 1.86 X 31036
B-Li-S Li3BS3 Li3BS3,oP28,62 Pnma 0.8144,1.0063,0.6161,90,90,90 - yellowish 1.68 X 32401
B-Li-S Li5B7S13 Li5B7S13,mS208,15 C12/c1 1.7304,2.1922,1.2233,90,134.91,90 - colorless 2.13 X 28170
B-Li-S Li9B19S33 Li9B19S33,mS256,15 C12/c1 2.3669,1.4361,1.2237,90,103.77,90 - colorless 2.18 X 28170
B-Li-Se LiBSe 2 LiBSe 2,mS408,15 C12/c1 2.2336,2.2066,1.7381,90,128.596,90 - amber 3.49 X 47579
B-Li-Se Li2B2Se5 Li2B2Se5,mS36,15 C12/c1 1.0616,0.5318,1.2382,90,109.97,90 - yellow 4.35 X 39349
B-Li-Se Li7B7Se15 Li7B7Se15,tP128,133 P42/nbc 1.14107,1.14107,1.64251,90,90,90 - amber 4.06 X 47528
B-Li-Si LiSiB6 LiSiB6,oS64,64 Cmce 0.6106,1.09794,0.8405,90,90,90 - yellow 2.35 X 50071
294 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Lu-Mn LuMnB4 YCrB4,oP24,55 Pbam 0.5858,1.1322,0.3379,90,90,90 - - 8.10 X 31667


B-Lu-Ni LuNiB4 YCrB4,oP24,55 Pbam 0.5789,1.134,0.3469,90,90,90 - - 8.08 A 14175
B-Lu-Ni LuNi4B CeCo 4B,hP12,191 P6/mmm 0.4934,0.4934,0.6918,90,90,120 - - 9.58 A 15185
B-Lu-Ni Lu1.65 Ni21 B6 Cr21W2C6 ,cF116,225 Fm-3m 1.06269,1.06269,1.06269,90,90,90 - - 8.78 X 53367
B-Lu-Ni Lu2Ni10B5 Ho2Ni10B5 ,oP136,61 Pbca 0.8887,0.9418,1.7504,90,90,90 - - 8.99 A 24694
B-Lu-Ni Lu2Ni14B6 Sc2Ni14.5 B5,tI92,141 I41/amd 0.7634,0.7634,1.5546,90,90,90 - - 9.07 A 23385
B-Lu-Ni Lu2Ni15B9 Ho2Ni15B9 ,oS208,64 Cmce 1.5829,1.1545,1.1179,90,90,90 - - 8.63 A 24710
B-Lu-Ni Lu2Ni3B6 Lu2Ni3B6,oS22,65 Cmmm 0.763,0.8625,0.3439,90,90,90 - - 8.67 X 20012
B-Lu-Ni Lu3Ni7B2 Dy3Ni7B2,hP24,194 P63 /mmc 0.5007,0.5007,1.429,90,90,120 Laves-CaCu5 - 10.25 A 16239
B-Lu-Ni Lu4NiB13 Er4NiB13,tP36,128 P4/mnc 0.7151,0.7151,0.7356,90,90,90 - - 7.94 A 23385
B-Lu-Ni Lu5Ni19B6 Lu5Ni19B6 ,hP30,191 P6/mmm 0.4943,0.4943,1.7161,90,90,120 - - 9.40 X 17916
B-Lu-O LuB3O6 DyB3O6,oP160,62 Pnma 1.5767,0.7347,1.2115,90,90,90 - colorless 5.74 X 44103
B-Lu-O Lu[BO3] ht-hp Ca[CO3],hR30,167 R-3c 0.4915,0.4915,1.6211,90,90,120 - - 6.87 A 7566
B-Lu-O Lu[BO3] rt Y[BO3],hP18,194 P63 /mmc 0.3727,0.3727,0.8722,90,90,120 - - 7.40 X 1908
B-Lu-O Lu3B5O12 Er3B5O12,oP80,53 Pmna 1.2747,0.4571,1.2424,90,90,90 - colorless 7.07 X 44466
B-Lu-Os LuOsB2 LuRuB2,oP16,62 Pnma 0.5809,0.5231,0.6318,90,90,90 - - 13.38 A 13562
B-Lu-Os LuOsB4 YCrB4,oP24,55 Pbam 0.59232,1.14496,0.35284,90,90,90 - - 11.34 A 16154
B-Lu-Os LuOs3B2 CeCo 3B2,hP6,191 P6/mmm 0.5457,0.5457,0.3052,90,90,120 - - 16.19 X 13749
B-Lu-Os Lu2OsB6 Y2ReB6,oP36,55 Pbam 0.90331,1.14113,0.35842,90,90,90 - - 10.88 A 17266
B-Lu-Pd LuPd3B CaTiO3,cP5,221 Pm-3m 0.409,0.409,0.409,90,90,90 perovskite family - 12.26 X 14482
B-Lu-Pd Lu2Pd13.2 B5 Y2Pd14B5,tI84,141 I41/amd 0.84173,0.84173,1.65761,90,90,90 - - 10.23 X 54891
B-Lu-Pd Lu2Pd15B5 Nd2Pd14.9 B4.9,tI96,141 I41/amd 0.84237,0.84237,1.65824,90,90,90 - - 11.29 A 52631
B-Lu-Pt LuPt2B CePt2B,hP12,180 P6222 0.52417,0.52417,0.78583,90,90,120 - - 15.35 X 54844
B-Lu-Re Lu2ReB6 Y2ReB6,oP36,55 Pbam 0.9075,1.141,0.36,90,90,90 - - 10.71 A 7007
B-Lu-Rh LuRhB4 YCrB4,oP24,55 Pbam 0.59074,1.14523,0.3508,90,90,90 - - 8.99 A 50916
B-Lu-Rh LuRh3B CaTiO3,cP5,221 Pm-3m 0.412,0.412,0.412,90,90,90 perovskite family gray silver 11.74 X 17128
B-Lu-Rh LuRh3B2 ErIr3B2,mS12,12 C12/m1 0.5353,0.9276,0.3089,90,90.9,90 - - 10.94 A 14265
B-Lu-Rh LuRh4B4 orth LuRh4B4,oS108,68 Ccce 0.741,2.226,0.744,90,90,90 - - 10.23 X 14940
B-Lu-Rh LuRh4B4 tet CeCo 4B4,tP18,137 P42 /nmc 0.53,0.53,0.7352,90,90,90 - - 10.13 A 14294
B-Lu-Rh Lu0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.554,0.554,0.8479,90,90,120 - - 9.24 A 18557
B-Lu-Rh Lu2RhB6 Y2ReB6,oP36,55 Pbam 0.90435,1.1383,0.3595,90,90,90 - - 9.29 A 44613
B-Lu-Ru LuRuB2 LuRuB2,oP16,62 Pnma 0.5809,0.5229,0.6284,90,90,90 - - 10.36 X 13562
B-Lu-Ru LuRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5454,0.5454,0.3004,90,90,120 - - 10.73 X 13749
B-Lu-Ru LuRu4B4 LuRu4B4,tI72,142 I41/acd 0.7419,0.7419,1.4955,90,90,90 - - 10.05 X 11021
B-Lu-Ru Lu2RuB6 Y2ReB6,oP36,55 Pbam 0.90138,1.1388,0.35826,90,90,90 - - 9.32 A 17266
B-Lu-S Lu3B1.67 S7 Cu2U3S7,hP24,173 P63 0.92162,0.92162,0.58911,90,90,120 - yellow 5.88 X 56910
B-Lu-Si Lu2.1 Si9B36 Tb1.8 Si8B36 C2,hR147,166 R-3m 1.0063,1.0063,1.6295,90,90,120 - - 3.52 A 41869
B-Lu-Si Lu5Si3B CuHf5Sn3,hP18,193 P63 /mcm 0.81746,0.81746,0.60908,90,90,120 AlB2 family - 9.14 X 47006
B-Lu-U U0.5 Lu0.5 B4 UB4,tP20,127 P4/mbm 0.7067,0.7067,0.3983,90,90,90 - - 8.34 A 8302
B-Lu-V Lu0.85 V0.15 B2 AlB2,hP3,191 P6/mmm 0.3238,0.3238,0.3689,90,90,120 AlB2 family - 8.82 X 40680
B-Lu-V Lu1.34 V1.66 B6 Y2ReB6,oP36,55 Pbam 0.8947,1.1273,0.3381,90,90,90 - - 7.48 X 40680
B-Lu-W Lu0.85 W0.15 B2 AlB2,hP3,191 P6/mmm 0.31772,0.31772,0.35804,90,90,120 AlB2 family - 10.50 X 37968
B-Lu-W Lu2WB6 Y2ReB6,oP36,55 Pbam 0.91339,1.14865,0.35124,90,90,90 - - 10.79 X 37968
B-Lu-Yb Yb0.8 Lu0.2 B12 UB12,cF52,225 Fm-3m 0.7466,0.7466,0.7466,90,90,90 - - 4.84 A 24036
B-Lu-Yb Yb0.8 Lu0.2 B6 CaB6,cP7,221 Pm-3m 0.4144,0.4144,0.4144,90,90,90 - - 5.56 A 24036
B-Mg-Mn Mg0.98Mn0.02 B2 AlB2,hP3,191 P6/mmm 0.30822,0.30822,0.35164,90,90,120 AlB2 family - 2.67 X 51351
B-Mg-N MgB1.99 N0.01 AlB2,hP3,191 P6/mmm 0.3082,0.3082,0.3522,90,90,120 AlB2 family - 2.63 X 52357
B-Mg-N MgB9N MgB9N,hR66,166 R-3m 0.5496,0.5496,2.00873,90,90,120 - black 2.57 X 39777
B-Mg-N Mg3BN3 hp-ht Mg3BN3,oP7,47 Pmmm 0.30933,0.31336,0.77005,90,90,90 - - 2.80 X 27130
B-Mg-N Mg3BN3 rt Mg3BN3,hP14,194 P63 /mmc 0.35445,0.35445,1.60354,90,90,120 - - 2.39 X 24736
B-Mg-Nb Mg0.4 Nb0.6 B2 AlB2,hP3,191 P6/mmm 0.31,0.31,0.33199,90,90,120 AlB2 family - 5.23 X 50873
B-Mg-Ni MgNiB *,hP18,180 P6222 0.4913,0.4913,0.882,90,90,120 - - 5.07 N 8600
B-Mg-Ni MgNi3B2 MgNi3B2,hP18,180 P6222 0.488,0.488,0.8787,90,90,120 - - 6.10 X 48560
B-Mg-Ni MgNi7B3 ErNi7B3,tI88,141 I41/amd 0.74877,0.74877,1.54879,90,90,90 - - 7.15 X 54525
B-Mg-Ni Mg3Ni20B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0569,1.0569,1.0569,90,90,90 - - 7.38 X 2045
B-Mg-O MgB4O7 CdB4O7,oP96,61 Pbca 0.797,0.862,1.373,90,90,90 - - 2.53 X 3215
B-Mg-O Mg2B2O5 mon Mg2B2O5,mP36,14 P121/c1 0.9197,0.31228,1.2303,90,104.26,90 suanite colorless 2.91 X 29807
B-Mg-O Mg2B2O5 tricl Mg2B2O5,aP18,2 P-1 0.3121,0.6149,0.9221,104.3,90.29,92.23 - white 2.91 X 29820
B-Mg-O Mg3[BO3]2 Ni3[BO3]2 ,oP22,58 Pnnm 0.4497,0.5398,0.8416,90,90,90 kotoite colorless 3.10 X 17645
B-Mg-Os MgOs3B4 MgOs3B4,oS32,63 Cmcm 0.29128,1.1859,0.9758,90,90,90 - - 12.58 X 37693
B-Mg-P MgB1.99P 0.01 AlB2,hP3,191 P6/mmm 0.3085,0.3085,0.3519,90,90,120 AlB2 family - 2.64 X 52357
B-Mg-Pb Mg0.9Pb0.1 B2 AlB2,hP3,191 P6/mmm 0.3087,0.3087,0.3784,90,90,120 AlB2 family - 3.41 X 49191
B-Mg-Pd MgPd3B CaTiO3,cP5,221 Pm-3m 0.4051,0.4051,0.4051,90,90,90 perovskite family - 8.85 X 43342
B-Mg-Pt Mg8Pt4B Na8SnSb4,cF104,227 Fd-3m 1.22481,1.22481,1.22481,90,90,90 - - 7.13 X 47641
B-Mg-Rh Mg0.97 RhB MgRhB,hP18,180 P6222 0.52394,0.52394,0.94251,90,90,120 - - 6.10 X 45637
B-Mg-Rh Mg2Rh0.75 B6.50 Mg2Rh0.75 B6.50 ,oP44,55 Pbam 0.8795,1.106,0.35279,90,90,90 - - 3.79 X 48466
B-Mg-Rh Mg3Rh5B2 Ti3Co5B2,tP20,127 P4/mbm 0.9434,0.9434,0.2922,90,90,90 - - 7.78 A 39542
B-Mg-Rh Mg8Rh4B rt Na8SnSb4,cF104,227 Fd-3m 1.21711,1.21711,1.21711,90,90,90 - - 4.55 X 47028
B-Mg-Ru Mg2Ru5B4 Mg2Ru5B4 ,oP22,55 Pbam 0.8376,1.,0.29542,90,90,90 - black 8.02 X 18646
B-Mg-Ru Mg5Ru13B11 Mg5Ru13B11,oP62,55 Pbam 0.9967,2.1901,0.29465,90,90,90 - black 8.03 X 18646
B-Mg-Si MgSi0.05 B1.95 AlB2,hP3,191 P6/mmm 0.3079,0.3079,0.3517,90,90,120 AlB2 family - 2.69 X 52357
B-Mg-Si MgSi2B12 MgSi2B12,oP60,62 Pnma 1.09797,0.61098,0.83646,90,90,90 - yellow 2.49 X 46966
B-Mg-Tl Mg0.9 Tl0.1 B2 AlB2,hP3,191 P6/mmm 0.3079,0.3079,0.3518,90,90,120 AlB2 family - 3.68 X 52357
B-Mn-Mo Mo0.21Mn1.79 B CuAl2,tI12,140 I4/mcm 0.5164,0.5164,0.4248,90,90,90 - - 7.58 A 6289
B-Mn-Mo Mo0.3Mn0.7 B FeB-b,oP8,62 Pnma 0.5731,0.2986,0.4268,90,90,90 CrB(TlI)-FeB - 7.10 A 6289
B-Mn-Mo Mo0.45Mn0.55 B2 AlB2,hP3,191 P6/mmm 0.3039,0.3039,0.3103,90,90,120 AlB2 family - 6.36 X 6289
B-Mn-Mo Mo0.84Mn0.16 B TlI,oS8,63 Cmcm 0.3075,0.8488,0.3155,90,90,90 CrB(TlI)-FeB - 8.08 A 6289
B-Mn-Mo Mo1.79Mn0.21 B CuAl2,tI12,140 I4/mcm 0.5534,0.5534,0.4716,90,90,90 - - 8.93 A 6289
Handbook of Inorganic Substances – Edition 2015 : Data 295

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Mn-Mo Mo2 MnB2 Mo2 FeB2,tP10,127 P4/mbm 0.5812,0.5812,0.3136,90,90,90 - - 8.42 A 6289


B-Mn-Mo Mo2 MnB4 Ta3B4,oI14,71 Immm 0.3035,0.315,1.346,90,90,90 - - 7.49 A 4163
B-Mn-Nd NdMnB4 YCrB4,oP24,55 Pbam 0.6033,1.1629,0.3515,90,90,90 - - 6.53 A 23408
B-Mn-Nd Nd4.47 Mn2.53B6 Pr5Co2B6,hR39,166 R-3m 0.5466,0.5466,2.37,90,90,120 - - 6.89 A 23408
B-Mn-Ni Mn0.15 Ni1.85 B CuAl2,tI12,140 I4/mcm 0.5047,0.5047,0.4257,90,90,90 - - 7.82 A 6310
B-Mn-Ni Mn0.8 Ni0.2 B FeB-b,oP8,62 Pnma 0.5551,0.2973,0.4113,90,90,90 CrB(TlI)-FeB - 6.51 A 6310
B-Mn-Ni Mn1.85 Ni0.15 B CuAl2,tI12,140 I4/mcm 0.5144,0.5144,0.4207,90,90,90 - - 7.23 A 6310
B-Mn-Ni Mn2.85 Ni0.15 B4 Ta3B4,oI14,71 Immm 0.2958,0.3031,1.2825,90,90,90 - - 6.03 A 16609
B-Mn-Ni Mn6 Ni17B6 Cr23 C6,cF116,225 Fm-3m 1.063,1.063,1.063,90,90,90 - - 7.70 A 4808
B-Mn-O MnB2O4 CaGa2O4,mP56,14 P121/c1 0.7121,0.7471,0.8788,90,94.1,90 - brownish 4.00 X 57528
B-Mn-O MnB4O7 orth1 CdB4O7,oP96,61 Pbca 0.80724,0.86235,1.40071,90,90,90 - - 2.86 X 8309
B-Mn-O MnB4O7 orth2 ZnB4O7,oS48,63 Cmcm 1.0885,0.6633,0.5187,90,90,90 - colorless 3.73 X 51397
B-Mn-O Mn2 B2O5 mon *,mP28,14 P121/c1 0.3252,0.9537,0.98139,90,108.518,90 - - 2.43 N 1119
B-Mn-O Mn2 B2O5 tricl Mg2 B2O5,aP18,2 P-1 0.3271,0.6266,0.9575,104.92,90.57,91.88 - - 3.71 A 1119
B-Mn-O Mn2 [BO3]O Mn2 [BO3]O,mP28,14 P121/c1 0.32438,0.95333,0.97963,90,108.578,90 - black 4.27 X 30511
B-Mn-O Mn3 [BO3]O2 Fe3[BO3]O2,oP36,55 Pbam 0.926,1.2415,0.30496,90,90,90 - brown dark 4.84 X 32643
B-Mn-O Mn3 [BO3]2 Ni3[BO3]2,oP22,58 Pnnm 0.4646,0.5658,0.874,90,90,90 jimboite - 4.08 X 11886
B-Mn-P Mn3 B0.2P 0.8 Ni3P,tI32,82 I-4 0.9121,0.9121,0.453,90,90,90 - - 6.76 A 1626
B-Mn-P Mn5 B2P Mo5 SiB2,tI32,140 I4/mcm 0.554,0.554,1.049,90,90,90 - - 6.75 A 1626
B-Mn-Pr PrMnB4 YCrB4,oP24,55 Pbam 0.6033,1.1682,0.3532,90,90,90 - - 6.38 A 23408
B-Mn-Pr Pr4.47 Mn2.53 B6 Pr5Co2B6,hR39,166 R-3m 0.5489,0.5489,2.4257,90,90,120 - - 6.56 X 23408
B-Mn-Pr Pr41 Mn140 B140 Pr41Mn140 B140,tP642,94 P42212 0.7183,0.7183,14.024,90,90,90 - - 6.88 X 28743
B-Mn-Re Mn0.5 Re1.5 B Mg2 Cu,oF48,70 Fddd 0.4458,0.7832,1.538,90,90,90 - - 15.71 X 4608
B-Mn-Re Mn0.7 Re0.3 B FeB-b,oP8,62 Pnma 0.5775,0.2985,0.426,90,90,90 CrB(TlI)-FeB - 9.51 A 4608
B-Mn-Re Mn1.55 Re0.45 B CuAl2,tI12,140 I4/mcm 0.53,0.53,0.4398,90,90,90 - - 9.67 A 4608
B-Mn-Re Mn14.3 Re8.7B6 Cr23 C6,cF116,225 Fm-3m 1.1175,1.1175,1.1175,90,90,90 - - 11.76 A 4608
B-Mn-Rh Mn0.39 Rh6.61B3 Th7Fe3,hP20,186 P63mc 0.74634,0.74634,0.47644,90,90,120 - - 10.61 X 57499
B-Mn-Ru Mn0.5 Ru6.5 B3 Th7Fe3,hP20,186 P63mc 0.74537,0.74537,0.47119,90,90,120 - - 10.50 X 55424
B-Mn-Sc Sc0.3Mn0.7 B2 AlB2 ,hP3,191 P6/mmm 0.3051,0.3051,0.3077,90,90,120 AlB2 family - 4.92 X 45435
B-Mn-Sc Sc2.28 Mn0.72 B6 Y2ReB6,oP36,55 Pbam 0.8781,1.10641,0.33674,90,90,90 - - 4.20 X 45435
B-Mn-Si Mn5 SiB2 Mo5 SiB2,tI32,140 I4/mcm 0.5609,0.5609,1.0477,90,90,90 - - 6.54 A 5284
B-Mn-Sm SmMnB4 YCrB4,oP24,55 Pbam 0.5981,1.1569,0.3474,90,90,90 - - 6.87 X 24685
B-Mn-Sm SmMn4B4 *,t**,* - 0.73,0.73,2.04,90,90,90 - - - N 24685
B-Mn-Sm Sm5 Mn2B6 Pr5Co2B6,hR39,166 R-3m 0.5434,0.5434,2.342,90,90,120 - - 7.71 A 24685
B-Mn-Ta Ta0.9 Mn2.1 B4 Ta3B4,oI14,71 Immm 0.3023,0.3176,1.2985,90,90,90 - - 8.56 A 16115
B-Mn-Tb TbMnB4 YCrB4,oP24,55 Pbam 0.5541,1.1497,0.341,90,90,90 - - 7.86 A 39407
B-Mn-Tb Tb3MnB7 Er3CrB7,oS44,63 Cmcm 0.34472,1.5822,0.9355,90,90,90 - - 7.91 A 39407
B-Mn-Tm TmMnB4 YCrB4,oP24,55 Pbam 0.5869,1.132,0.34018,90,90,90 - - 7.85 A 39328
B-Mn-U UMnB4 YCrB4,oP24,55 Pbam 0.5875,1.1387,0.3454,90,90,90 - - 9.66 A 12511
B-Mn-W W0.18 Mn1.82 B CuAl2,tI12,140 I4/mcm 0.5167,0.5167,0.4248,90,90,90 - - 8.43 A 6289
B-Mn-W W0.2Mn0.8 B FeB-b,oP8,62 Pnma 0.5718,0.2991,0.4256,90,90,90 CrB(TlI)-FeB - 8.35 A 6289
B-Mn-W W0.84 Mn0.16 B TlI,oS8,63 Cmcm 0.3082,0.8494,0.3162,90,90,90 CrB(TlI)-FeB - 13.97 A 6289
B-Mn-W W1.2Mn1.8 B4 Ta3B4,oI14,71 Immm 0.3,0.3122,1.306,90,90,90 - - 9.85 A 4163
B-Mn-W W1.85 Mn0.15 B CuAl2,tI12,140 I4/mcm 0.5538,0.5538,0.4706,90,90,90 - - 16.53 A 6289
B-Mn-W W2MnB2 Mo2 FeB2,tP10,127 P4/mbm 0.5786,0.5786,0.316,90,90,90 - - 13.95 X 4017
B-Mn-Y YMnB4 YCrB4,oP24,55 Pbam 0.5913,1.142,0.3439,90,90,90 - - 5.35 A 5216
B-Mn-Y Y3MnB7 Er3CrB7,oS44,63 Cmcm 0.3464,1.5696,0.9313,90,90,90 - - 5.21 A 19085
B-Mn-Yb YbMnB4 YCrB4,oP24,55 Pbam 0.5865,1.1344,0.3385,90,90,90 - - 8.00 A 31667
B-Mo-Nb Nb0.1 Mo0.9 B rt MoB,tI16,141 I41/amd 0.3103,0.3103,1.697,90,90,90 - - 8.65 A 6286
B-Mo-Nb Nb0.28 Mo0.72B2 AlB2 ,hP3,191 P6/mmm 0.3068,0.3068,0.3143,90,90,120 AlB2 family - 7.56 X 6286
B-Mo-Nb Nb0.3 Mo1.7 B CuAl2,tI12,140 I4/mcm 0.5556,0.5556,0.4765,90,90,90 - - 9.11 A 6286
B-Mo-Nb Nb0.6 Mo0.4 B TlI,oS8,63 Cmcm 0.314,0.862,0.325,90,90,90 CrB(TlI)-FeB - 7.92 A 6286
B-Mo-Nb Nb1.95 Mo1.05B4 Ta3B4,oI14,71 Immm 0.31,0.325,1.4,90,90,90 - - 7.66 A 6286
B-Mo-Nb Nb2 MoB2 Mo2 FeB2,tP10,127 P4/mbm 0.608,0.608,0.326,90,90,90 - - 8.36 A 6286
B-Mo-Ni MoNi20B17 *,oP*,* - 0.2985,0.7553,1.3088,90,90,90 - - - N 17359
B-Mo-Ni Mo0.9 Ni0.1 B ht TlI,oS8,63 Cmcm 0.315,0.8399,0.3066,90,90,90 CrB(TlI)-FeB - 8.44 A 3195
B-Mo-Ni Mo2 NiB2 W2CoB2,oI10,71 Immm 0.31733,0.45746,0.70945,90,90,90 - - 8.78 X 47029
B-Mo-Ni Mo3 NiB3 W3CoB3,oS28,63 Cmcm 0.3175,0.8418,1.0734,90,90,90 - - 8.77 A 4792
B-Mo-Ni Mo3 Ni10B11 *,oP*,* - 0.3021,0.6197,1.0737,90,90,90 - - - N 17359
B-Mo-Ni Mo4 Ni23B29 *,oP*,* - 0.3074,0.875,0.9393,90,90,90 - - - N 17359
B-Mo-Os Mo0.3 Os0.7 B2 ReB2,hP6,194 P63/mmc 0.291,0.291,0.7442,90,90,120 - - 11.17 A 5470
B-Mo-Os Mo2 OsB2 Mo2 IrB2,oP20,58 Pnnm 0.7517,0.9618,0.3088,90,90,90 - - 12.01 A 11699
B-Mo-P Mo0.8 B1.86P0.14 rt MoB2,hR18,166 R-3m 0.302,0.302,2.097,90,90,120 - - 6.09 A 18396
B-Mo-P Mo3 B0.5P 0.5 V3S,tI32,121 I-42m 0.9718,0.9718,0.4765,90,90,90 - - 9.11 A 18396
B-Mo-P Mo5 B2P Mo5 SiB2,tI32,140 I4/mcm 0.5979,0.5979,1.1059,90,90,90 - - 8.94 X 18396
B-Mo-Re MoReB CuAl2,tI12,140 I4/mcm 0.552,0.552,0.465,90,90,90 - - 13.73 A 6743
B-Mo-Ru MoRu2B4 Ta3B4,oI14,71 Immm 0.3018,0.3227,1.3244,90,90,90 - - 8.79 X 6887
B-Mo-Ru Mo0.3 Ru0.7 B2 ReB2,hP6,194 P63/mmc 0.2901,0.2901,0.7395,90,90,120 - - 7.47 A 5465
B-Mo-Ru Mo0.5 Ru0.5 B FeB-b,oP8,62 Pnma 0.5955,0.303,0.4458,90,90,90 CrB(TlI)-FeB - 9.03 A 6887
B-Mo-Ru Mo1.75 Ru1.25B2 Mo2 IrB2,oP20,58 Pnnm 0.748,0.9599,0.3094,90,90,90 - - 9.44 A 9240
B-Mo-Si Mo5 Si0.89 B2.11 Mo5 SiB2,tI32,140 I4/mcm 0.60272,0.60272,1.10671,90,90,90 - - 8.72 X 38620
B-Mo-Si Mo5 Si2.58 B0.42 W5Si3,tI32,140 I4/mcm 0.964,0.964,0.488,90,90,90 - - 8.15 A 890
B-Mo-Ta Ta0.5 Mo1.5 B CuAl2,tI12,140 I4/mcm 0.559,0.559,0.477,90,90,90 - - 10.93 A 6743
B-Mo-Tb TbMoB4 YCrB4,oP24,55 Pbam 0.6044,1.167,0.3607,90,90,90 - - 7.78 A 6640
B-Mo-Tb TbMo 3B7 YMo 3B7,oP44,62 Pnma 1.102,0.3103,1.2861,90,90,90 - - 7.89 A 30110
B-Mo-Tb Tb0.15 Mo0.85 B2 ht AlB2 ,hP3,191 P6/mmm 0.3046,0.3046,0.3061,90,90,120 AlB2 family - 8.58 X 21849
B-Mo-Tb Tb3MoB7 Er3CrB7,oS44,63 Cmcm 0.3498,1.5942,0.9467,90,90,90 - - 8.16 A 21849
B-Mo-Th ThMoB4 ThMoB4,oS24,65 Cmmm 0.7481,0.9658,0.3771,90,90,90 - - 9.05 X 8421
296 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Mo-Ti Ti0.5 Mo0.5 B ht TlI,oS8,63 Cmcm 0.318,0.839,0.307,90,90,90 CrB(TlI)-FeB - 6.71 A 1275


B-Mo-Ti Ti0.5 Mo0.5 B2 AlB2,hP3,191 P6/mmm 0.3044,0.3044,0.3207,90,90,120 AlB2 family - 6.04 X 1275
B-Mo-Ti Ti0.5 Mo1.5 B CuAl2,tI12,140 I4/mcm 0.5535,0.5535,0.4734,90,90,90 - - 8.18 A 1275
B-Mo-Ti Ti0.75 Mo0.25 B FeB-b,oP8,62 Pnma 0.6028,0.3048,0.4539,90,90,90 CrB(TlI)-FeB - 5.63 A 1275
B-Mo-Ti Ti1.5 Mo1.5 B2 ht U3Si2,tP10,127 P4/mbm 0.6,0.6,0.316,90,90,90 - - 6.93 A 1275
B-Mo-Tm TmMo3B7 YMo3B7,oP44,62 Pnma 1.1004,0.3091,1.2794,90,90,90 - - 8.13 A 30110
B-Mo-U UMoB4 ThMoB4,oS24,65 Cmmm 0.73,0.9415,0.3648,90,90,90 - - 9.99 A 9210
B-Mo-U U2MoB6 Y2ReB6,oP36,55 Pbam 0.9301,1.1434,0.3678,90,90,90 - - 10.82 A 19609
B-Mo-U U5Mo10B24 U5Mo10B24 ,oP78,59 Pmmn 0.3118,1.7897,1.4585,90,90,90 - - 9.83 X 31715
B-Mo-V V0.14 Mo0.86 B rt MoB,tI16,141 I41/amd 0.3099,0.3099,1.687,90,90,90 - - 8.24 A 7032
B-Mo-V V0.15 Mo1.85 B CuAl2,tI12,140 I4/mcm 0.5519,0.5519,0.4717,90,90,90 - - 9.06 A 7032
B-Mo-V V0.4 Mo0.6B2 AlB2,hP3,191 P6/mmm 0.3025,0.3025,0.3073,90,90,120 AlB2 family - 6.79 X 7032
B-Mo-V V0.6 Mo0.4B TlI,oS8,63 Cmcm 0.31,0.823,0.302,90,90,90 CrB(TlI)-FeB - 6.88 A 7032
B-Mo-V V1.5 Mo1.5B2 U3Si2,tP10,127 P4/mbm 0.585,0.585,0.31,90,90,90 - - 7.57 A 7032
B-Mo-W W0.9Mo1.1 B CuAl2,tI12,140 I4/mcm 0.5547,0.5547,0.4733,90,90,90 - - 12.85 A 4267
B-Mo-Y YMoB4 YCrB4,oP24,55 Pbam 0.6018,1.165,0.3598,90,90,90 - - 6.01 X 6640
B-Mo-Y YMo3B7 YMo3B7,oP44,62 Pnma 1.1012,0.31013,1.2864,90,90,90 - - 6.84 X 29984
B-Mo-Y Y0.15 Mo0.85 B2 ht AlB2,hP3,191 P6/mmm 0.3036,0.3036,0.3062,90,90,120 AlB2 family - 7.92 X 7403
B-Mo-Y Y0.4 Mo0.6B ht TlI,oS8,63 Cmcm 0.314,0.846,0.3075,90,90,90 CrB(TlI)-FeB - 8.45 A 7403
B-Mo-Zr Zr0.5Mo0.5 B2 AlB2,hP3,191 P6/mmm 0.3085,0.3085,0.34,90,90,120 AlB2 family - 6.83 X 599
B-Mo-Zr Zr9Mo4B Hf9Mo4B,hP28,194 P63 /mmc 0.8634,0.8634,0.8566,90,90,120 - - 7.30 A 7664
B-N-Na Na3BN2 Li3BN2,mP24,14 P121/c1 0.5717,0.7931,0.7883,90,111.32,90 - - 2.15 X 23575
B-N-Nb Nb0.78 B1.97 N0.03 AlB2,hP3,191 P6/mmm 0.30908,0.30908,0.3314,90,90,120 AlB2 family - 5.70 X 44182
B-N-Nb Nb2BN0.98 Mo2BC,oS16,63 Cmcm 0.3172,1.7841,0.3114,90,90,90 - - 7.93 X 21254
B-N-Nd NdBN2 PrBN2,hR72,161 R3c 1.2074,1.2074,0.6945,90,90,120 - - 6.24 A 26432
B-N-Nd Nd3B2N4 Ce3B2N4,oI18,71 Immm 0.35152,0.62701,1.07559,90,90,90 - black 7.15 X 36674
B-N-Pr PrBN2 KBO2,hR72,167 R-3c 1.21195,1.21195,0.70153,90,90,120 - green 6.02 X 36655
B-N-Pr Pr15B8N25 Ce15B8N25 ,hR288,167 R-3c 1.44543,1.44543,2.10872,90,90,120 - - 6.66 A 22038
B-N-Pr Pr3B2N4 Ce3B2N4,oI18,71 Immm 0.35346,0.63004,1.07904,90,90,90 - black 6.92 X 36674
B-N-Sm SmBN2 PrBN2,hR72,161 R3c 1.1972,1.1972,0.685,90,90,120 - - 6.65 A 26432
B-N-Sr Sr3B2N4 rt *,cP*,221 Pm-3m 0.7655,0.7655,0.7655,90,90,90 - - - N 45128
B-N-Sr Sr4.5 B3N6 Sr4.5 B3N6,cI28,229 Im-3m 0.76456,0.76456,0.76456,90,90,90 - red 3.80 X 29560
B-N-Ti TiB0.02 N0.82 NaCl,cF8,225 Fm-3m 0.4236,0.4236,0.4236,90,90,90 rocksalt family - 5.21 X 9029
B-N-Ti TiB2N0.29 AlB2,hP3,191 P6/mmm 0.304,0.304,0.323,90,90,120 AlB2 family - 4.73 F 10660
B-N-U UBN UBC,oS12,63 Cmcm 0.35851,1.18273,0.33254,90,90,90 - - 12.38 X 24500
B-N-U UB0.12 N0.88 NaCl,cF8,225 Fm-3m 0.4889,0.4889,0.4889,90,90,90 rocksalt family - 14.30 X 3794
B-N-V VB1.96 N0.17 AlB2,hP3,191 P6/mmm 0.3,0.3,0.305,90,90,120 AlB2 family - 5.20 F 10660
B-N-V V0.77 B0.41 N0.59 rt NaCl,cF8,225 Fm-3m 0.4129,0.4129,0.4129,90,90,90 rocksalt family - 4.90 X 10660
B-N-Zr ZrB0.04 N0.93 NaCl,cF8,225 Fm-3m 0.4568,0.4568,0.4568,90,90,90 rocksalt family - 7.29 X 17027
B-N-Zr ZrB1.90 N0.05 AlB2,hP3,191 P6/mmm 0.317,0.317,0.3532,90,90,120 AlB2 family - 6.08 X 17027
B-Na-O NaBO2 rt KBO2,hR72,167 R-3c 1.1925,1.1925,0.6439,90,90,120 - - 2.48 X 1828
B-Na-O NaB3O5 mon1 NaB3O5-a,mP108,14 P121/c1 1.0085,1.1363,1.0845,90,104.48,90 - - 2.24 X 8011
B-Na-O NaB3O5 mon2 NaB3O5-b,mP108,14 P121/c1 0.899,1.1033,1.2107,90,90.5,90 - - 2.25 X 6391
B-Na-O NaB3O5 tricl *,aP*,* - 0.601,0.768,1.932,84.2,89.83,88.4 - - - N 11835
B-Na-O Na12B26O45 Na12B26O45 ,oI332,45 Iba2 0.9554,3.3359,1.0644,90,90,90 - - 2.50 X 45250
B-Na-O Na2B4O7 hp Na2B4O7,hP117,152 P3121 0.7655,0.7655,2.1423,90,90,120 - colorless 2.77 X 59511
B-Na-O Na2B4O7 ht Na2B4O7,aP52,2 P-1 0.65445,0.86205,1.04855,93.279,94.87,90.843 - - 2.27 X 8005
B-Na-O Na2B4O7 m2 Na2B4O7,aP78,2 P-1 0.6705,0.9601,1.3272,104.21,91.58,106.4 - - 2.54 X 44125
B-Na-O Na2B8O13 mon1 Na2B8O13,mP92,14 P121/c1 0.8377,1.7796,0.6507,90,96.6,90 - - 2.35 X 40994
B-Na-O Na2B8O13 mon2 Na2B8O13,mP100,14 P121/c1 1.1731,0.788,1.041,90,99.883,90 - - 2.39 X 40565
B-Na-O Na3B7O12 Li3B7O12,aP44,2 P-1 0.6638,0.8249,0.8836,95.875,100.68,99.688 - colorless 2.41 X 43069
B-Na-O Na3[BO3] Na3[BO3],mP28,14 P121/c1 0.5687,0.753,0.9589,90,123.835,90 - colorless 2.49 X 11051
B-Na-O Na4B2O5 Na4B2O5,mS44,15 C12/c1 1.0618,0.8015,0.6287,90,110.1,90 - colorless 2.56 X 12801
B-Na-P Na3BP 2 Li3BN2,mP24,14 P121/c1 0.6995,0.9279,0.9159,90,111.03,90 - yellow 1.70 X 24277
B-Na-Pt NaPt3B NaPt3B,hP10,191 P6/mmm 0.5547,0.5547,0.5504,90,90,120 - - 14.02 X 21374
B-Na-Pt Na3Pt9B5 Na3Pt9B5,oS68,63 Cmcm 0.5539,1.1401,1.5047,90,90,90 - - 13.13 X 21374
B-Na-S NaBS2 KBO2,hR72,167 R-3c 1.5118,1.5118,0.7512,90,90,120 - - 1.97 X 26635
B-Na-S Na2B2S5 Na2B2S5,oP36,62 Pnma 1.2545,0.7441,0.8271,90,90,90 - yellowish 1.96 X 31036
B-Na-S Na3BS3 Na3BS3,mS28,15 C12/c1 1.1853,0.6664,0.8406,90,118.18,90 - colorless 2.00 X 39559
B-Na-S Na3B5S9 Na3B5S9,tI272,142 I41/acd 1.4415,1.4415,2.6137,90,90,90 - yellowish 2.01 X 32490
B-Na-Se NaB9Se8 NaB9Se8,hP108,147 P-3 1.7021,1.7021,0.8903,90,90,120 - orange 3.35 X 45646
B-Na-Se Na2B2Se7 Na2B2Se7,mS44,15 C12/c1 1.4919,0.6703,1.1863,90,119.177,90 - yellowish 3.98 X 29542
B-Na-Se Na3B5Se9 Na3B5S9,tI272,142 I41/acd 1.5128,1.5128,2.7955,90,90,90 - colorless 3.46 X 40768
B-Na-Se Na4B9Se9 Na4B9Se9,mP88,14 P121/c1 1.099,1.6279,1.149,90,117.82,90 - colorless 3.29 X 43976
B-Na-Se Na6B18Se17 Na6B18Se17 ,mS168,15 C12/c1 1.8005,1.6549,1.1245,90,91.35,90 - colorless 3.32 X 39487
B-Na-Si Na4Si8.75 B37.25 Na4Si8.75 B37.25,hP104,194 P63 /mmc 1.02392,1.02392,1.09215,90,90,120 - black 2.48 X 54070
B-Na-Th Na0.77 Th0.23 B6 CaB6,cP7,221 Pm-3m 0.4151,0.4151,0.4151,90,90,90 - - 3.16 X 583
B-Nb-Ni NbNiB MoAlB,oS12,63 Cmcm 0.3268,1.345,0.3115,90,90,90 - - 7.88 X 4847
B-Nb-Ni NbNiB2 NbCoB2,oP16,62 Pnma 0.6037,0.3117,0.8192,90,90,90 - - 7.46 A 11759
B-Nb-Ni Nb3Ni20B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0584,1.0584,1.0584,90,90,90 - - 8.50 A 3772
B-Nb-Ni Nb4Ni2B0.32 W4Co2C,cF112,227 Fd-3m 1.1613,1.1613,1.1613,90,90,90 η-carbide - 8.35 X 3557
B-Nb-O NbBO4 m Zr[SiO4],tI24,141 I41/amd 0.62141,0.62141,0.5476,90,90,90 schiavinatoite - 5.27 X 21063
B-Nb-O NbB0.4 O2 NbO2,tI96,88 I41/a 1.3687,1.3687,0.5989,90,90,90 - - 6.12 F 21867
B-Nb-Re Nb0.2 Re2.8 B Re3B,oS16,63 Cmcm 0.2902,0.9375,0.7276,90,90,90 - - 18.48 A 5568
B-Nb-Re Nb0.5 Re6.5 B3 Th7Fe3,hP20,186 P63 mc 0.7523,0.7523,0.4877,90,90,120 - - 17.91 A 5568
B-Nb-Re Nb0.9 Re0.1 B TlI,oS8,63 Cmcm 0.3289,0.868,0.315,90,90,90 CrB(TlI)-FeB - 8.35 A 5568
B-Nb-Re Nb1.5 Re1.5 B2 U3Si2,tP10,127 P4/mbm 0.6002,0.6002,0.3291,90,90,90 - - 12.33 A 5568
B-Nb-Re Nb2.65 Re0.35 B4 Ta3B4,oI14,71 Immm 0.3105,0.3269,1.423,90,90,90 - - 8.15 A 5568
Handbook of Inorganic Substances – Edition 2015 : Data 297

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Nb-Rh Nb7 Rh6B8 Nb7Rh6B8,hP126,176 P63/m 1.61309,1.61309,0.65686,90,90,120 - - 9.12 X 58368


B-Nb-Ru Nb3 Ru5B2 Ti3Co 5B2,tP20,127 P4/mbm 0.9376,0.9376,0.29997,90,90,90 - gray silver 10.15 X 59500
B-Nb-Ru Nb3.1 Ru19.9 B6 Cr23 C6,cF116,225 Fm-3m 1.1329,1.1329,1.1329,90,90,90 - - 10.80 A 12581
B-Nb-Ru Nb7 Ru6B8 Nb7Ru6B8,hP21,175 P6/m 0.95061,0.95061,0.31284,90,90,120 - - 9.11 X 58368
B-Nb-Si Nb5 Si1.23 B1.77 Mo5 SiB2,tI32,140 I4/mcm 0.6274,0.6274,1.16443,90,90,90 - - 7.51 X 58902
B-Nb-Si Nb5 Si3B0.707 stab CuHf5Sn3,hP18,193 P63/mcm 0.75762,0.75762,0.5275,90,90,120 - - 7.05 X 58902
B-Nb-Ti Ti0.3 Nb0.7 B TlI,oS8,63 Cmcm 0.327,0.868,0.311,90,90,90 CrB(TlI)-FeB - 6.79 A 49294
B-Nb-Ti Ti0.35 Nb2.65 B4 Ta3B4,oI14,71 Immm 0.313,0.3291,1.407,90,90,90 - - 7.02 A 6286
B-Nb-Ti Ti0.48 Nb0.52 B FeB-b,oP8,62 Pnma 0.6136,0.3076,0.4645,90,90,90 CrB(TlI)-FeB - 6.22 A 49294
B-Nb-Ti Ti0.5 Nb0.5 B2 AlB2 ,hP3,191 P6/mmm 0.306,0.306,0.3264,90,90,120 AlB2 family - 5.77 X 599
B-Nb-V Nb0.36 V1.64 B3 V2B3,oS20,63 Cmcm 0.31086,1.85817,0.30114,90,90,90 - - 5.71 X 30300
B-Nb-V Nb0.5 V0.5 B2 AlB2 ,hP3,191 P6/mmm 0.305,0.305,0.32,90,90,120 AlB2 family - 6.03 X 7032
B-Nb-V Nb0.6 V0.4 B TlI,oS8,63 Cmcm 0.32,0.86,0.31,90,90,90 CrB(TlI)-FeB - 6.77 A 7032
B-Nb-V Nb1.5 V1.5 B2 U3Si2,tP10,127 P4/mbm 0.595,0.595,0.32,90,90,90 - - 6.96 A 7032
B-Nb-Zr Zr0.6 Nb0.4B2 AlB2 ,hP3,191 P6/mmm 0.315,0.315,0.345,90,90,120 AlB2 family - 6.36 X 52466
B-Nd-Ni NdNiB4 ErNiB4,tI48,139 I4/mmm 0.7667,0.7667,0.8649,90,90,90 - - 6.43 A 17494
B-Nd-Ni NdNi12B6 CeNi12B6,oS76,36 Cmc21 0.9549,0.7398,1.1029,90,90,90 - - 7.79 A 20086
B-Nd-Ni NdNi4B NdNi4B,oI72,74 Imma 0.5057,0.698,2.6271,90,90,90 - - 8.38 X 41649
B-Nd-Ni Nd2 NiB10 Th2NiB10,oP26,55 Pbam 0.5614,1.1192,0.4177,90,90,90 - - 5.76 X 37695
B-Nd-Ni Nd2 Ni5B4 Nd2Ni5B4,mS22,12 C12/m1 0.9783,0.5097,0.67648,90,125.687,90 - - 7.58 X 18546
B-Nd-Ni Nd3 Ni13B2 Nd3Ni13B2,hP18,191 P6/mmm 0.5005,0.5005,1.0904,90,90,120 - - 8.55 X 14138
B-Nd-O NdB3O6 hp DyB3O6,oP160,62 Pnma 1.6162,0.7474,1.2442,90,90,90 - - 4.82 X 49765
B-Nd-O NdB3O6 hp-ht CeB3O6,oP40,29 Pca21 1.8348,0.44394,0.4272,90,90,90 - violet pale 5.20 A 43986
B-Nd-O NdB3O6 mon LaB3O6,mS40,15 C12/c1 0.98324,0.80932,0.63771,90,126.639,90 - violet pale 4.45 X 42504
B-Nd-O NdB5O9 GdB5O9,tI240,142 I41/acd 0.8312,0.8312,3.37962,90,90,90 - - 3.89 A 41375
B-Nd-O Nd[BO3] orth Ca[CO3]-a,oP20,62 Pnma 0.57351,0.50564,0.80916,90,90,90 - violet pale 5.75 X 42504
B-Nd-O Nd[BO3] tricl Eu[BO3],aP20,2 P-1 0.63,0.65488,0.65486,93.904,107.686,107.304 - colorless 5.57 X 45999
B-Nd-O Nd13 [BO3]4O13.5 Nd13 [BO3]4O13.5 ,aP88,2 P-1 0.67643,1.2663,1.4271,90.553,99.778,90.511 - bluish 6.41 X 48493
B-Nd-Os NdOs2B2 CeRu2B2,oF40,22 F222 0.65622,0.90624,1.00229,90,90,90 - - 12.17 A 20360
B-Nd-Os NdOs4B4 NdCo 4B4,tP18,86 P42/n 0.75591,0.75591,0.40026,90,90,90 - - 13.77 X 14295
B-Nd-Pd NdPd3B CaTiO3,cP5,221 Pm-3m 0.418,0.418,0.418,90,90,90 perovskite family - 10.78 X 15209
B-Nd-Pd Nd2 Pd14.9 B4.9 Nd2Pd14.9 B4.9,tI96,141 I41/amd 0.85776,0.85776,1.66278,90,90,90 - - 10.46 X 52631
B-Nd-Pt NdPt2B CePt2B,hP12,180 P6222 0.54242,0.54242,0.78799,90,90,120 - - 13.53 X 42224
B-Nd-Pt NdPt3B CePt3B,tP5,99 P4mm 0.3989,0.3989,0.50475,90,90,90 - - 15.31 X 41718
B-Nd-Pt NdPt4B CeCo 4B,hP12,191 P6/mmm 0.54332,0.54332,0.75855,90,90,120 - - 16.02 A 42926
B-Nd-Re Nd2 Re3B6 Pr2Re3B6,mS44,15 C12/c1 0.6752,1.0568,0.7556,90,90.83,90 - - 11.24 A 22919
B-Nd-Re Nd8 Re12.9 B12 Pr8Re12.6 B12,hR99,166 R-3m 1.0653,1.0653,1.4617,90,90,120 - - 12.78 X 26001
B-Nd-Rh NdRh3B CaTiO3,cP5,221 Pm-3m 0.4206,0.4206,0.4206,90,90,90 perovskite family - 10.35 X 17128
B-Nd-Rh NdRh3B2 CeCo 3B2,hP6,191 P6/mmm 0.5443,0.5443,0.3118,90,90,120 - - 9.85 X 20758
B-Nd-Rh NdRh4B4 CeCo 4B4,tP18,137 P42/nmc 0.5333,0.5333,0.7468,90,90,90 - - 9.37 A 15479
B-Nd-Rh Nd0.71 Rh3.29 B2 (Nd0.71 Rh0.29 )Rh3B2,hP6,189 P-62m 0.5595,0.5595,0.2855,90,90,120 - - 9.92 X 16249
B-Nd-Ru NdRu2B2 CeRu2B2,oF40,22 F222 0.64807,0.90854,0.99753,90,90,90 - - 8.32 A 20360
B-Nd-Ru NdRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5544,0.5544,0.301,90,90,120 - - 9.72 X 13749
B-Nd-Ru NdRu4B4 LuRu4B4,tI72,142 I41/acd 0.751,0.751,1.5069,90,90,90 - gray 9.25 X 55439
B-Nd-S NdBS3 CeBS3,oP20,33 Pna21 0.74869,0.60055,0.88581,90,90,90 - - 4.19 X 55036
B-Nd-Si Nd5 Si3B0.6 CuHf5Sn3,hP18,193 P63/mcm 0.8665,0.8665,0.6526,90,90,120 AlB2 family - 6.35 A 46633
B-Nd-Sm Nd0.5 Sm0.5 B6 CaB6,cP7,221 Pm-3m 0.4134,0.4134,0.4134,90,90,90 - - 4.99 A 15162
B-Nd-Tm Nd0.57 Tm0.43 B6 CaB6,cP7,221 Pm-3m 0.4122,0.4122,0.4122,90,90,90 - - 5.21 A 21731
B-Nd-Yb Nd0.3 Yb0.7 B6 CaB6,cP7,221 Pm-3m 0.4137,0.4137,0.4137,90,90,90 - - 5.38 A 24036
B-Ni-O NiB2O4 m NiB2O4,mS28,15 C12/c1 0.9247,0.5523,0.4429,90,108.3,90 - green 4.46 X 47829
B-Ni-O NiB4O7 m ZnB4O7,oS48,63 Cmcm 1.0875,0.6368,0.518,90,90,90 - orange 3.96 X 51397
B-Ni-O Ni3[BO3]2 Ni3[BO3]2,oP22,58 Pnnm 0.4459,0.5396,0.8297,90,90,90 - green 4.89 X 17645
B-Ni-P NiB3P2 *,hR*,* - 0.67,0.67,3.84,90,90,120 - - - N 17018
B-Ni-P Ni2B0.6P 0.4 Fe2P,hP9,189 P-62m 0.5803,0.5803,0.31,90,90,120 Fe2P family - 7.51 A 17018
B-Ni-P Ni3B0.3P 0.7 Ni3P,tI32,82 I-4 0.8877,0.8877,0.4338,90,90,90 - - 7.81 A 17018
B-Ni-Pr PrNiB4 ErNiB4,tI48,139 I4/mmm 0.7683,0.7683,0.867,90,90,90 - - 6.30 A 17494
B-Ni-Pr PrNi12B6 CeNi12B6,oS76,36 Cmc21 0.9584,0.7379,1.1024,90,90,90 - - 7.75 A 20086
B-Ni-Pr PrNi4B CeCo 4B,hP12,191 P6/mmm 0.50673,0.50673,0.69769,90,90,120 - - 8.27 A 52494
B-Ni-Pr Pr2NiB10 Th2NiB10,oP26,55 Pbam 0.5619,1.1227,0.4192,90,90,90 - - 5.63 A 37695
B-Ni-Pr Pr2Ni5B4 Nd2Ni5B4,mS22,12 C12/m1 0.9754,0.5094,0.67449,90,125.766,90 - - 7.55 A 18989
B-Ni-Pr Pr3Ni13B2 Nd3Ni13B2,hP18,191 P6/mmm 0.5024,0.5024,1.0923,90,90,120 - - 8.40 A 17970
B-Ni-Re Re11.6 Ni11.4 B6 Cr23 C6,cF116,225 Fm-3m 1.1262,1.1262,1.1262,90,90,90 - - 13.46 A 7035
B-Ni-Re Re6.5 Ni0.5B3 Th7Fe3,hP20,186 P63mc 0.7501,0.7501,0.4805,90,90,120 - - 18.05 A 7035
B-Ni-Rh Rh6NiB3 Th7Fe3,hP20,186 P63mc 0.7441,0.7441,0.4714,90,90,120 - - 10.41 A 57499
B-Ni-Ru Ru0.5 Ni0.5B FeB-b,oP8,62 Pnma 0.5613,0.3117,0.4128,90,90,90 CrB(TlI)-FeB - 8.34 A 7670
B-Ni-Ru Ru6.5 Ni0.5B3 (Ru0.93 Ni0.07)7B3,hP26,186 P63mc 0.74475,0.74475,0.4701,90,90,120 - - 10.57 X 55424
B-Ni-Sb Ni21 Sb2B6 Cr21 W2C6,cF116,225 Fm-3m 1.0585,1.0585,1.0585,90,90,90 - - 8.63 X 2626
B-Ni-Sc ScNiB4 YCrB4,oP24,55 Pbam 0.57853,1.1208,0.32737,90,90,90 - - 4.60 X 21196
B-Ni-Sc ScNi3B0.5 rt CaTiO3,cP5,221 Pm-3m 0.3776,0.3776,0.3776,90,90,90 perovskite family gray silver 6.98 X 43195
B-Ni-Sc Sc2Ni14.5 B5 Sc2Ni14.5 B5,tI92,141 I41/amd 0.768,0.768,1.5382,90,90,90 - - 7.29 X 21823
B-Ni-Sc Sc2Ni21B6 Cr21 W2C6,cF116,225 Fm-3m 1.0594,1.0594,1.0594,90,90,90 - - 7.75 X 51615
B-Ni-Si Ni3.05 Si0.95B0.02 Ni+ rt CaTiO3,cP5,221 Pm-3m 0.35,0.35,0.35,90,90,90 close-packed structure - 7.98 X 19924
B-Ni-Si Ni4.6 Si2B Nb5Sn2Si,tI32,140 I4/mcm 0.8632,0.8632,0.429,90,90,90 - - 7.00 X 5044
B-Ni-Si Ni6Si2B K2UF6,hP9,189 P-62m 0.6105,0.6105,0.2895,90,90,120 Fe2P family - 7.45 X 1080
B-Ni-Sm SmNiB4 ErNiB4,tI48,139 I4/mmm 0.7627,0.7627,0.8601,90,90,90 - - 6.70 A 17494
B-Ni-Sm SmNi12B6 CeNi12B6,oS76,36 Cmc21 0.9544,0.7385,1.1013,90,90,90 - - 7.87 A 20086
B-Ni-Sm SmNi2B2 HoNi2B2,mS20,15 C12/c1 0.8478,0.5354,0.6902,90,127.09,90 AlB2 family - 7.69 A 24693
B-Ni-Sm SmNi4B CeCo 4B,hP12,191 P6/mmm 0.5027,0.5027,0.6954,90,90,120 - - 8.64 A 47249
298 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Ni-Sm Sm2NiB10 Th2NiB10,oP26,55 Pbam 0.5605,1.1133,0.4177,90,90,90 - - 5.96 A 37695


B-Ni-Sm Sm3Ni13B2 Nd3Ni13B2 ,hP18,191 P6/mmm 0.499,0.499,1.0885,90,90,120 - - 8.74 A 14138
B-Ni-Sm Sm3Ni7B2 Dy3Ni7B2,hP24,194 P63 /mmc 0.5142,0.5142,1.4348,90,90,120 Laves-CaCu5 - 8.93 A 13206
B-Ni-Sn Ni21.1 Sn1.9 B6 Mg3Ni20B6,cF116,225 Fm-3m 1.05827,1.05827,1.05827,90,90,90 - - 8.57 X 54961
B-Ni-Sr SrNi12B6 SrNi12B6,hR57,166 R-3m 0.959,0.959,0.7455,90,90,120 - gray 7.19 X 13817
B-Ni-Sr SrNi2B2 *,o*20,* - 0.3914,0.7557,1.0261,90,90,90 - - - N 13817
B-Ni-Ta TaNiB MoAlB,oS12,63 Cmcm 0.3265,1.347,0.3063,90,90,90 - - 12.35 A 4847
B-Ni-Ta TaNiB2 NbCoB2,oP16,62 Pnma 0.6041,0.3104,0.8171,90,90,90 - - 11.33 X 11759
B-Ni-Ta Ta2Ni21B6 Cr21W2C6 ,cF116,225 Fm-3m 1.055,1.055,1.055,90,90,90 - - 9.39 A 3738
B-Ni-Tb TbNiB4 ErNiB4,tI48,139 I4/mmm 0.7549,0.7549,0.854,90,90,90 - - 7.12 A 17494
B-Ni-Tb TbNi12B6 orth CeNi12B6,oS76,36 Cmc21 0.9536,0.7382,1.0991,90,90,90 - - 7.97 X 20086
B-Ni-Tb TbNi12B6 rhom SrNi12B6,hR57,166 R-3m 0.9518,0.9518,0.7411,90,90,120 - - 7.95 A 14139
B-Ni-Tb TbNi2B2 HoNi2B2,mS20,15 C12/c1 0.8389,0.5245,0.689,90,126.9,90 AlB2 family - 8.16 A 24693
B-Ni-Tb TbNi4B CeCo 4B,hP12,191 P6/mmm 0.49943,0.49943,0.69484,90,90,120 - - 8.95 X 48638
B-Ni-Tb Tb2NiB10 Th2NiB10,oP26,55 Pbam 0.5556,1.1109,0.415,90,90,90 - - 6.28 A 37695
B-Ni-Tb Tb2Ni10B5 Ho2Ni10B5 ,oP136,61 Pbca 0.9064,0.9483,1.7625,90,90,90 - - 8.41 A 24694
B-Ni-Tb Tb2Ni15B9 Ho2Ni15B9 ,oS208,64 Cmce 1.589,1.1609,1.1228,90,90,90 - - 8.31 A 24710
B-Ni-Tb Tb2Ni3B6 Lu2Ni3B6,oS22,65 Cmmm 0.7723,0.8636,0.348,90,90,90 - - 8.00 A 22279
B-Ni-Tb Tb3Ni13B2 Nd3Ni13B2 ,hP18,191 P6/mmm 0.4954,0.4954,1.0887,90,90,120 - - 9.05 X 17993
B-Ni-Tb Tb3Ni19B10 Ho3Ni19B10 ,mS64,12 C12/m1 1.3208,0.8747,0.5832,90,91.16,90 - - 8.38 A 24670
B-Ni-Tb Tb3Ni7B2 Dy3Ni7B2,hP24,194 P63 /mmc 0.5097,0.5097,1.431,90,90,120 Laves-CaCu5 - 9.38 A 16239
B-Ni-Tb Tb4NiB13 Er4NiB13,tP36,128 P4/mnc 0.7227,0.7227,0.7535,90,90,90 - - 7.05 A 16590
B-Ni-Th Th2NiB10 Th2NiB10,oP26,55 Pbam 0.5646,1.1204,0.4173,90,90,90 - - 7.94 X 31227
B-Ni-Ti Ti3Ni20B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0514,1.0514,1.0514,90,90,90 - - 7.90 X 56075
B-Ni-Tm TmNiB4 YCrB4,oP24,55 Pbam 0.5793,1.1456,0.3457,90,90,90 - - 7.84 A 14175
B-Ni-Tm TmNi4B CeCo 4B,hP12,191 P6/mmm 0.496,0.496,0.6917,90,90,120 - - 9.34 X 15185
B-Ni-Tm Tm2Ni10B5 Ho2Ni10B5 ,oP136,61 Pbca 0.8961,0.9435,1.7539,90,90,90 - - 8.77 A 24694
B-Ni-Tm Tm2Ni14.5 B5 Sc2Ni14.5 B5,tI92,141 I41/amd 0.7649,0.7649,1.556,90,90,90 - - 9.07 A 21823
B-Ni-Tm Tm2Ni15B9 Ho2Ni15B9 ,oS208,64 Cmce 1.5856,1.1565,1.1179,90,90,90 - - 8.53 A 24710
B-Ni-Tm Tm2Ni21B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0633,1.0633,1.0633,90,90,90 - - 9.04 X 13211
B-Ni-Tm Tm2Ni3B6 Lu2Ni3B6,oS22,65 Cmmm 0.7645,0.8625,0.3452,90,90,90 - - 8.45 A 22279
B-Ni-Tm Tm3Ni13B2 Nd3Ni13B2 ,hP18,191 P6/mmm 0.4925,0.4925,1.0865,90,90,120 - - 9.40 A 16066
B-Ni-Tm Tm3Ni7B2 Dy3Ni7B2,hP24,194 P63 /mmc 0.5007,0.5007,1.431,90,90,120 Laves-CaCu5 - 10.04 A 16239
B-Ni-Tm Tm4NiB13 Er4NiB13,tP36,128 P4/mnc 0.7178,0.7178,0.7411,90,90,90 - - 7.61 A 16590
B-Ni-U UNiB4 ErNiB4,tI48,139 I4/mmm 0.7515,0.7515,0.8523,90,90,90 - - 9.38 A 17494
B-Ni-U UNi4B CeCo 4B,hP12,191 P6/mmm 0.5053,0.5053,0.6998,90,90,120 - - 10.38 A 8176
B-Ni-U U2Ni21B6 Cr21W2C6 ,cF116,225 Fm-3m 1.0647,1.0647,1.0647,90,90,90 - - 9.76 X 2626
B-Ni-V V3Ni20B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0479,1.0479,1.0479,90,90,90 - - 8.03 A 7409
B-Ni-W WNi20B17 *,oP*,* - 0.2983,0.7567,1.3099,90,90,90 - - - N 17359
B-Ni-W W1.2 Ni0.6 B9 W1.83 B9,hP22,147 P-3 0.5207,0.5207,0.6303,90,90,120 - - 7.92 X 3670
B-Ni-W W2NiB2 W2CoB2,oI10,71 Immm 0.317,0.455,0.702,90,90,90 - - 14.70 A 3054
B-Ni-W W3NiB3 W3CoB3,oS28,63 Cmcm 0.3178,0.842,1.0733,90,90,90 - - 14.86 A 4792
B-Ni-Y YNiB4 ErNiB4,tI48,139 I4/mmm 0.7535,0.7535,0.8526,90,90,90 - - 5.24 A 30128
B-Ni-Y YNi0.3 B62 *,cP*,* - 2.3446,2.3446,2.3446,90,90,90 - - - N 37715
B-Ni-Y YNi12B6 CeNi12B6,oS76,36 Cmc21 0.9597,0.7375,1.1003,90,90,90 - - 7.32 A 30128
B-Ni-Y YNi12B6 SrNi12B6,hR57,166 R-3m 0.9525,0.9525,0.7421,90,90,120 - - 7.33 A 30128
B-Ni-Y YNi2B2 hp CeAl2Ga2,tI10,139 I4/mmm 0.3517,0.3517,1.0652,90,90,90 - - 5.75 A 32289
B-Ni-Y YNi2B2 HoNi2B2,mS20,15 C12/c1 0.8388,0.5212,0.6887,90,127.17,90 AlB2 family - 6.31 A 30128
B-Ni-Y YNi4B CeCo 4B,hP12,191 P6/mmm 0.4977,0.4977,0.6942,90,90,120 - - 7.46 X 7346
B-Ni-Y Y0.915 Ni4.12 B Y0.915 Ni4.12 B,hP113,191 P6/mmm 1.49143,1.49143,0.69123,90,90,120 - - 7.50 X 35811
B-Ni-Y Y2NiB10 Th2NiB10,oP26,55 Pbam 0.5557,1.1109,0.415,90,90,90 - - 4.47 A 37695
B-Ni-Y Y2Ni10B5 Ho2Ni10B5 ,oP136,61 Pbca 0.9018,0.9478,1.7594,90,90,90 - - 7.23 A 30128
B-Ni-Y Y2Ni15B6 Ho2Ni15B6 ,mP138,14 P121/c1 1.4224,1.0679,0.9577,90,94.37,90 - - 7.72 A 30128
B-Ni-Y Y2Ni15B9 Ho2Ni15B9 ,oS208,64 Cmce 1.5905,1.1615,1.1243,90,90,90 - - 7.39 A 30128
B-Ni-Y Y2Ni3B6 Lu2Ni3B6,oS22,65 Cmmm 0.775,0.8644,0.3486,90,90,90 - - 5.96 A 30128
B-Ni-Y Y3Ni13B2 Nd3Ni13B2 ,hP18,191 P6/mmm 0.49579,0.49579,1.09141,90,90,120 - - 7.52 X 45452
B-Ni-Y Y3Ni19B10 Ho3Ni19B10 ,mS64,12 C12/m1 1.3253,0.8776,0.5823,90,91.18,90 - - 7.31 A 30128
B-Ni-Y Y3Ni7B2 Dy3Ni7B2,hP24,194 P63 /mmc 0.5128,0.5128,1.4343,90,90,120 Laves-CaCu5 - 7.11 A 30128
B-Ni-Y Y4NiB13 Er4NiB13,tP36,128 P4/mnc 0.7223,0.7223,0.7541,90,90,90 - - 4.68 A 30128
B-Ni-Yb YbNiB4 YCrB4,oP24,55 Pbam 0.58645,1.1368,0.3385,90,90,90 - gray 8.09 X 45797
B-Ni-Yb YbNi4B hex1 CeCo 4B,hP12,191 P6/mmm 0.4935,0.4935,0.6905,90,90,120 - - 9.55 A 46614
B-Ni-Yb YbNi4B hex2 *,hP*,191 P6/mmm 1.4817,1.4817,0.6901,90,90,120 - - - N 46614
B-Ni-Yb YbNi6.5 B3 *,c**,* - 0.7726,0.7726,0.7726,90,90,90 - - - N 46614
B-Ni-Yb YbNi7B3 ErNi7B3,tI88,141 I41/amd 0.76471,0.76471,1.55453,90,90,90 - - 9.01 A 46614
B-Ni-Yb Yb1.70 Ni21 B6 Cr21W2C6 ,cF116,225 Fm-3m 1.06243,1.06243,1.06243,90,90,90 - - 8.82 X 53367
B-Ni-Yb Yb2Ni10B5 Ho2Ni10B5 ,oP136,61 Pbca 0.8943,0.9408,1.7524,90,90,90 - - 8.89 A 46614
B-Ni-Yb Yb2Ni14.5 B5 Sc2Ni14.5 B5,tI92,141 I41/amd 0.7674,0.7674,1.5474,90,90,90 - - 9.12 A 21823
B-Ni-Yb Yb2Ni15B9 Ho2Ni15B9 ,oS208,64 Cmce 1.5925,1.159,1.1232,90,90,90 - - 8.48 X 45791
B-Ni-Yb Yb2Ni3B6 Lu2Ni3B6,oS22,65 Cmmm 0.7627,0.8604,0.3443,90,90,90 - - 8.63 X 24717
B-Ni-Yb Yb3Ni13B2 Nd3Ni13B2 ,hP18,191 P6/mmm 0.4976,0.4976,1.0838,90,90,120 - - 9.32 A 17993
B-Ni-Yb Yb3Ni19B10 Ho3Ni19B10 ,mS64,12 C12/m1 1.3139,0.8676,0.5754,90,91.23,90 - - 8.83 A 46614
B-Ni-Yb Yb3Ni7B2 Dy3Ni7B2,hP24,194 P63 /mmc 0.5016,0.5016,1.4211,90,90,120 Laves-CaCu5 - 10.21 X 46614
B-Ni-Yb Yb4NiB13 Er4NiB13,tP36,128 P4/mnc 0.7165,0.7165,0.7379,90,90,90 - - 7.82 A 46614
B-Ni-Zn ZnNi12B7.57 Ni12AlB8,oS252,64 Cmce 1.0527,1.45236,1.45537,90,90,90 - gray 7.63 X 56377
B-Ni-Zn ZnNi3B2 ZnNi3B2,mS24,12 C12/m1 0.95101,0.28921,0.84366,90,101.096,90 - gray 7.67 X 56377
B-Ni-Zn Zn1.6 Ni21.4 B6 Mg3Ni20B6,cF116,225 Fm-3m 1.05409,1.05409,1.05409,90,90,90 - - 8.09 X 54961
B-Ni-Zn Zn2Ni21B20 Zn2Ni21B20 ,tI86,139 I4/mmm 0.72103,0.72103,1.42842,90,90,90 - gray 7.06 X 56377
B-Ni-Zr Zr3Ni20B6 Mg3Ni20B6,cF116,225 Fm-3m 1.0562,1.0562,1.0562,90,90,90 - - 8.53 X 56075
Handbook of Inorganic Substances – Edition 2015 : Data 299

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Np-Pu Np0.33Pu0.67 B2 AlB2 ,hP3,191 P6/mmm 0.31798,0.31798,0.39565,90,90,120 AlB2 family - 12.62 X 22389
B-O-P B[PO4] hp-ht Al[AsO4],hP18,152 P3121 0.44605,0.44605,0.99,90,90,120 - - 3.09 X 44046
B-O-P B[PO4] rt B[PO4],tI12,82 I-4 0.43404,0.43404,0.66502,90,90,90 - colorless 2.80 X 44023
B-O-Pb PbB4O7 SrB4 O7,oP24,31 Pmn21 1.08346,0.44535,0.42441,90,90,90 - colorless 5.88 X 58132
B-O-Pb Pb1.5 B2O4.5 Pb1.5 B2O4.5 ,hP11,149 P312 0.49253,0.49253,0.63884,90,90,120 - colorless 5.00 X 40603
B-O-Pb Pb6B10O21 Pb6B10O21,aP37,2 P-1 0.6833,0.69692,1.1125,82.429,78.,61.038 - - 6.18 X 7148
B-O-Pd PdB2O4 CuB2O4,tI84,122 I-42d 1.1672,1.1672,0.5698,90,90,90 - brown dark 4.93 X 14991
B-O-Pr PrB3O6 hp-ht CeB3O6,oP40,29 Pca21 1.8381,0.44464,0.4278,90,90,90 - green light 5.12 A 43986
B-O-Pr PrB3O6 LaB3O6,mS40,15 C12/c1 0.98498,0.80957,0.64102,90,126.783,90 - green 4.37 X 40974
B-O-Pr PrB5O9 GdB5O9,tI240,142 I41/acd 0.83912,0.83912,3.40541,90,90,90 - - 3.76 A 41375
B-O-Pr Pr[BO3] Ca[CO3]-a,oP20,62 Pnma 0.5771,0.5067,0.8133,90,90,90 - green 5.58 X 55586
B-O-Pr Pr4B10O21 Pr4B10O21,mP140,14 P121/c1 0.7102,1.9488,1.15448,90,124.621,90 - - 5.09 X 48950
B-O-Rb RbBO2 KBO2,hR72,167 R-3c 1.31572,1.31572,0.77434,90,90,120 - colorless 3.30 X 42590
B-O-Rb RbB3O5 hp KB3 O5,mS72,15 C12/c1 0.9823,0.8859,0.9199,90,104.,90 - colorless 3.38 X 59559
B-O-Rb RbB3O5 ht RbB3O5,oP36,19 P212121 0.624,0.8438,0.8719,90,90,90 - colorless 2.86 X 34919
B-O-Rb RbB3O5 rt CsB3O5,oP36,19 P212121 0.5382,0.8209,1.0092,90,90,90 - - 2.95 X 37789
B-O-Rb RbB5O8 ht KB5 O8-b,oP112,61 Pbca 0.7553,1.1857,1.4813,90,90,90 - colorless 2.68 X 39186
B-O-Rb Rb2B4O7 rt K2B4O7,aP52,2 P-1 0.6649,0.986,1.0653,89.1,76.6,78.6 - colorless 3.25 X 32939
B-O-Rb Rb3B7O12 Rb3B7O12,aP88,2 P-1 0.6603,0.6632,3.0085,91.183,91.781,119.293 - - 3.03 X 40819
B-O-Rb Rb5B19O31 K5B19O31,mS220,15 C12/c1 1.8211,1.1519,1.331,90,95.63,90 - colorless 2.70 X 36335
B-O-Rh Rh[BO3] Ca[CO3],hR30,167 R-3c 0.4615,0.4615,1.4349,90,90,120 - brown red 6.09 A 11829
B-O-Sc Sc[BO3] Ca[CO3],hR30,167 R-3c 0.4748,0.4748,1.5262,90,90,120 - white 3.47 X 20958
B-O-Sc Sc3B5O12 Er3B5O12,oP80,53 Pmna 1.2454,0.44346,1.2221,90,90,90 - colorless 3.75 X 53583
B-O-Se B2Se 2O7 B2Se2O7,oP44,19 P212121 0.74815,0.78984,0.90478,90,90,90 - colorless 3.62 X 46560
B-O-Sm SmBO3 rt YbBO3,hP30,193 P63/mcm 0.6696,0.6696,0.8968,90,90,120 - - 5.99 A 24827
B-O-Sm SmB3O6 mon LaB3O6,mS40,15 C12/c1 0.98229,0.806,0.633,90,127.055,90 - - 4.63 X 9341
B-O-Sm SmB3O6 orth DyB3O6,oP160,62 Pnma 1.6125,0.74602,1.24087,90,90,90 - - 4.96 X 49765
B-O-Sm SmB5O9 GdB5O9,tI240,142 I41/acd 0.82789,0.82789,3.3732,90,90,90 - - 4.00 A 41375
B-O-Sm Sm[BO3] ht Y[BO3],hP18,194 P63/mmc 0.3862,0.3862,0.8978,90,90,120 - - 5.99 X 1908
B-O-Sm Sm[BO3] rt Sm[BO3],aP20,1 P1 0.6242,0.6493,0.6499,93.33,107.79,107.42 - - 5.89 X 10159
B-O-Sm Sm2 B4O9 Gd2B4O9,mS300,15 C12/c1 2.5572,0.44516,2.4967,90,99.85,90 - colorless 5.79 X 44196
B-O-Sn SnB4O7 SrB4 O7,oP24,31 Pmn21 1.0864,0.4448,0.42396,90,90,90 - colorless 4.44 X 48190
B-O-Sr SrB2O4 hp1 CaB2O4,oP84,33 Pna21 1.2426,0.6418,1.1412,90,90,90 - - 3.79 A 4356
B-O-Sr SrB2O4 hp2 CaB2O4,cP84,205 Pa-3 0.92123,0.92123,0.92123,90,90,90 - colorless 4.42 X 24996
B-O-Sr SrB2O4 CaB2O4,oP28,60 Pbcn 1.20135,0.4339,0.65864,90,90,90 - colorless 3.35 X 31382
B-O-Sr SrB4O7 orth SrB4 O7,oP24,31 Pmn21 1.07237,0.44351,0.4241,90,90,90 - - 4.00 X 58132
B-O-Sr SrB4O7 trig SrB4 O7,hP108,143 P3 1.7145,1.7145,0.42527,90,90,120 - colorless 3.35 X 53706
B-O-Sr SrB8O13 SrB8 O13,mP176,14 P121/c1 0.8408,1.6672,1.3901,90,106.33,90 - colorless 2.71 X 51422
B-O-Sr Sr2B2O5 Sr2B2O5,mP36,14 P121/c1 0.7719,0.5341,1.1873,90,92.71,90 - colorless 3.76 X 36180
B-O-Sr Sr3[BO3]2 Ca3[BO3]2,hR66,167 R-3c 0.90429,0.90429,1.25664,90,90,120 - - 4.26 X 38902
B-O-Sr Sr4B14O25 Sr4B14O25,oS172,36 Cmc21 0.7734,1.6332,1.4556,90,90,90 - colorless 3.26 X 49444
B-O-Ta TaBO4 Zr[SiO4],tI24,141 I41/amd 0.62125,0.62125,0.54832,90,90,90 behierite colorless 8.03 X 32591
B-O-Tb TbBO3 YBO3,hP18,176 P63/m 0.3813,0.3813,0.8879,90,90,120 - - 6.47 X 57039
B-O-Tb TbB3O6 lt mon TbB3O6,mP40,14 P121/c1 0.77824,0.82053,0.61336,90,90.038,90 - colorless 4.87 X 50210
B-O-Tb TbB3O6 orth DyB3O6,oP160,62 Pnma 1.59897,0.74139,1.22958,90,90,90 - colorless 5.24 X 42308
B-O-Tb TbB3O6 rt mon LaB3O6,mS40,15 C12/c1 0.96856,0.80225,0.62147,90,126.388,90 - colorless 4.91 X 41237
B-O-Tb TbB5O9 GdB5O9,tI240,142 I41/acd 0.82178,0.82178,3.35759,90,90,90 - - 4.18 A 39962
B-O-Tb Tb2B4O9 Gd2B4O9,mS300,15 C12/c1 2.5294,0.4416,2.4843,90,99.88,90 - colorless 6.14 A 41334
B-O-Th ThB2O5 ThB2O5,mS64,15 C12/c1 1.1545,0.6937,1.0263,90,101.5,90 - colorless 5.50 X 24349
B-O-Th Th3B200.4 O (O) Th3B200O,cF1880,226 Fm-3c 2.353,2.353,2.353,90,90,90 - - 2.94 X 6095
B-O-Ti TiB0.024 O2 TiO2 ,tP6,136 P42/mnm 0.46092,0.46092,0.29673,90,90,90 - - 4.22 X 32134
B-O-Ti Ti[BO3] Ca[CO3],hR30,167 R-3c 0.46723,0.46723,1.4949,90,90,120 - brown red 3.76 X 31172
B-O-Ti Ti5B12O26 Ti5B12O26,tI344,142 I41/acd 1.1211,1.1211,2.2115,90,90,90 - black 3.75 X 52968
B-O-Tl TlBO2 *,tP32,76 P41 0.738,0.738,0.935,90,90,90 - - - N 11399
B-O-Tl TlB3 O5 CsB3O5,oP36,19 P212121 0.52099,0.8248,1.0206,90,90,90 - colorless 4.80 X 33458
B-O-Tl TlB5 O8 KB5 O8-b,oP112,61 Pbca 0.7557,1.1925,1.4734,90,90,90 - - 3.87 X 34769
B-O-Tl Tl[BO3] Ca[CO3],hR30,167 R-3c 0.4932,0.4932,1.5988,90,90,120 - - 7.79 A 7566
B-O-Tl Tl2B4O7 ht1 *,oS52,65 Cmmm 0.5347,1.2925,1.2338,90,90,90 - - - N 10568
B-O-Tl Tl2B4O7 ht2 Tl2B4O7,aP78,2 P-1 0.67415,1.3225,1.3389,119.093,92.288,91.012 - - 5.40 X 39156
B-O-Tl Tl2B4O7 rt *,hP78,147 P-3 1.3692,1.3692,0.6725,90,90,120 - - - N 10568
B-O-Tl Tl3[BO3] Tl3[BO3],hP14,176 P63/m 0.9275,0.9275,0.3775,90,90,120 - - 7.93 X 9308
B-O-Tm TmB3O6 DyB3O6,oP160,62 Pnma 1.5816,0.7362,1.2162,90,90,90 - colorless 5.58 X 44103
B-O-Tm Tm[BO3] Y[BO3],hP18,194 P63/mmc 0.3753,0.3753,0.8789,90,90,120 - - 7.06 X 1908
B-O-Tm Tm3 B5O12 Er3B5O12,oP80,53 Pmna 1.2805,0.4602,1.2481,90,90,90 - colorless 6.80 X 44466
B-O-U U[BO3]2 U[BO3]2,mS36,15 C12/c1 1.2504,0.4183,1.0453,90,122.18,90 - - 5.11 X 19869
B-O-U [UO2]B2O4 [UO2]B2O4,mS18,5 C121 1.04607,0.41863,0.56251,90,109.769,90 - green 5.10 X 54317
B-O-V VBO3 Ca[CO3],hR30,167 R-3c 0.462,0.462,1.4509,90,90,120 - brown red 4.08 X 51656
B-O-Y YBO3 hex1 YBO3,hP18,176 P63/m 0.3776,0.3776,0.8806,90,90,120 - - 4.51 X 33391
B-O-Y YBO3 hex2 YBO3,hP90,169 P61 0.6544,0.6544,2.643,90,90,120 - - 4.50 X 10863
B-O-Y Y8.67 B2[BO3]2O13 Y8.67 B2[BO3]2O13,mS64,8 C1m1 1.81662,0.36516,1.39775,90,119.75,90 - colorless 4.61 X 33520
B-O-Yb YbBO3 rt YbBO3,hP30,193 P63/mcm 0.646,0.646,0.874,90,90,120 - - 7.31 X 2892
B-O-Yb YbB3O6 DyB3O6,oP160,62 Pnma 1.5791,0.7352,1.214,90,90,90 - colorless 5.68 A 44103
B-O-Yb Yb[BO3] hp Ca[CO3],hR30,167 R-3c 0.4921,0.4921,1.6305,90,90,120 - - 6.76 X 39680
B-O-Yb Yb[BO3] ht Y[BO3],hP18,194 P63/mmc 0.3735,0.3735,0.8747,90,90,120 - - 7.29 X 1908
B-O-Yb Yb13 B6O28.5 Yb13 B6O28.5 ,mS106,12 C12/m1 2.4578,0.35837,1.43128,90,115.079,90 - - 8.06 X 56515
B-O-Yb Yb3B5O12 Er3B5O12,oP80,53 Pmna 1.2778,0.45896,1.2451,90,90,90 - colorless 6.96 X 44466
B-O-Zn ZnB4O7 hp-ht ZnB4O7,oS48,63 Cmcm 1.085,0.6489,0.5173,90,90,90 - colorless 4.02 X 42270
B-O-Zn ZnB4O7 CdB4O7,oP96,61 Pbca 0.81093,0.8634,1.372,90,90,90 - colorless 3.05 X 59368
300 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-O-Zn Zn3[BO3]2 ht Zn3[BO3]2 ,mS88,15 C12/c1 2.384,0.5049,0.8388,90,102.905,90 - colorless 4.24 X 46705


B-O-Zn Zn3[BO3]2 rt Zn3[BO3]2 ,aP44,2 P-1 0.6302,0.8248,1.002,89.85,89.79,73.25 - colorless 4.18 X 46705
B-O-Zn Zn4B6O13 Zn4B6O13,cI46,217 I-43m 0.74659,0.74659,0.74659,90,90,90 zeolite SOD colorless 4.26 X 13821
B-O-Zn Zn6B3O10.5 (H) Zn6[BO3]3 (O0.5 [OH]0.5)2,hR120,167 R-3c 0.81578,0.81578,2.61628,90,90,120 - - 3.92 X 27107
B-O-Zr ZrB2O5 HfB2O5,mP32,14 P121/c1 0.43904,0.6912,0.8968,90,90.96,90 - colorless 4.71 X 51655
B-Os-Pr PrOs2B2 CeRu2B2,oF40,22 F222 0.65496,0.91089,1.007,90,90,90 - - 12.01 A 20360
B-Os-Pr PrOs4B4 NdCo4B4,tP18,86 P42 /n 0.7567,0.7567,0.4002,90,90,90 - - 13.70 A 14295
B-Os-Pu PuOs3B2 URu3B2,hP48,147 P-3 1.10642,1.10642,0.6001,90,90,120 - - 17.46 A 19134
B-Os-Sc ScOsB2 LuRuB2,oP16,62 Pnma 0.5647,0.5178,0.6184,90,90,90 - - 9.43 A 13562
B-Os-Sc ScOs3B4 ht MgOs3B4,oS32,63 Cmcm 0.29503,1.1797,0.9819,90,90,90 - - 12.80 X 37693
B-Os-Sc Sc2Os5B4 Sc2Ru5B4,mP22,10 P12/m1 0.85499,0.30216,1.00477,90,90.03,90 - - 13.87 A 17279
B-Os-Sm SmOs2B2 CeRu2B2,oF40,22 F222 0.65847,0.90266,0.99413,90,90,90 - - 12.42 A 20360
B-Os-Sm SmOs4B4 NdCo4B4,tP18,86 P42 /n 0.7526,0.7526,0.4009,90,90,90 - - 13.96 A 12590
B-Os-Tb TbOsB2 LuRuB2,oP16,62 Pnma 0.5885,0.5309,0.6392,90,90,90 - - 12.33 A 13562
B-Os-Tb TbOsB4 YCrB4,oP24,55 Pbam 0.5966,1.1553,0.3561,90,90,90 - - 10.62 A 12511
B-Os-Tb Tb2OsB6 Y2ReB6,oP36,55 Pbam 0.91889,1.15612,0.36567,90,90,90 - - 9.80 A 17266
B-Os-Th ThOs2B2 CeRu2B2,oF40,22 F222 0.65169,0.91269,1.0134,90,90,90 - - 13.97 A 20360
B-Os-Th ThOs4B4 NdCo4B4,tP18,86 P42 /n 0.7579,0.7579,0.3999,90,90,90 - - 14.98 A 13546
B-Os-Ti Ti1.6 Os2.4 B2 Ti(Ti0.6 Os0.4 )Os2B2,hP36,189 P-62m 0.88332,0.88332,0.30299,90,90,120 - - 13.50 X 51508
B-Os-Tm TmOsB2 LuRuB2,oP16,62 Pnma 0.5817,0.5258,0.6328,90,90,90 - - 13.07 A 13562
B-Os-Tm TmOsB4 YCrB4,oP24,55 Pbam 0.5919,1.1461,0.3532,90,90,90 - - 11.15 A 12511
B-Os-Tm Tm2OsB6 Y2ReB6,oP36,55 Pbam 0.90677,1.14336,0.36037,90,90,90 - - 10.54 A 17266
B-Os-U UOsB4 ThMoB4,oS24,65 Cmmm 0.7331,0.9412,0.3548,90,90,90 - - 12.79 A 30207
B-Os-U UOs3B2 CeCo 3B2,hP6,191 P6/mmm 0.5523,0.5523,0.2976,90,90,120 - - 17.54 X 13749
B-Os-U UOs4B4 LuRu4B4,tI72,142 I41/acd 0.7512,0.7512,1.5053,90,90,90 - - 16.30 A 13546
B-Os-U U2OsB6 Y2ReB6,oP36,55 Pbam 0.9342,1.1408,0.3589,90,90,90 - - 12.70 A 30207
B-Os-V V0.4 Os0.6 B2 ReB2,hP6,194 P63 /mmc 0.29,0.29,0.7333,90,90,120 - - 9.71 A 11699
B-Os-V V1.8 Os1.2 B2 Mo2IrB2,oP20,58 Pnnm 0.7241,0.936,0.3001,90,90,90 - - 11.15 A 11699
B-Os-W W0.3 Os0.7B2 ReB2,hP6,194 P63 /mmc 0.2911,0.2911,0.7497,90,90,120 - - 12.67 A 5470
B-Os-W W1.85 Os1.15 B2 Mo2IrB2,oP20,58 Pnnm 0.752,0.9572,0.3066,90,90,90 - - 17.47 A 11699
B-Os-Y YOsB2 LuRuB2,oP16,62 Pnma 0.5905,0.5299,0.6391,90,90,90 - - 9.99 A 13562
B-Os-Y YOsB4 YCrB4,oP24,55 Pbam 0.5955,1.1527,0.3556,90,90,90 - - 8.77 A 12511
B-Os-Y Y2OsB6 Y2ReB6,oP36,55 Pbam 0.91592,1.15311,0.36473,90,90,90 - - 7.46 A 17266
B-Os-Y Y3Os8B6 Ca3Rh8B6,oF68,69 Fmmm 0.54792,0.95139,1.76972,90,90,90 - - 13.34 X 49037
B-Os-Yb YbOsB2 LuRuB2,oP16,62 Pnma 0.58042,0.52432,0.63155,90,90,90 - - 13.30 A 18331
B-Os-Yb YbOsB4 YCrB4,oP24,55 Pbam 0.5911,1.1449,0.3535,90,90,90 - - 11.29 A 12511
B-Os-Yb Yb2OsB6 Y2ReB6,oP36,55 Pbam 0.90504,1.14224,0.35939,90,90,90 - - 10.75 A 17266
B-P-Rb Rb3BP 2 K3BP 2,mS24,15 C12/c1 0.9533,0.9229,0.9418,90,110.53,90 - yellow 2.82 X 31185
B-P-S BPS4 ht *,mS*,* - 0.669,0.605,1.038,90,105.,90 - brown - N 2046
B-P-S BPS4 rt BPS4,oI12,23 I222 0.525,0.56,0.904,90,90,90 - colorless 2.12 X 2046
B-Pb-S Pb2B2S5 mon *,mP36,14 P121/c1 0.65,0.665,1.67784,90,108.432,90 - orange - N 2162
B-Pb-S Pb2B2S5 tet Pb2B2S5,tP72,92 P41212 0.9615,0.9615,1.5512,90,90,90 - red 5.52 X 3938
B-Pb-Sc Sc3PbB CaTiO3,cP5,221 Pm-3m 0.4622,0.4622,0.4622,90,90,90 perovskite family - 5.93 X 10736
B-Pd-Pr PrPd3B CaTiO3,cP5,221 Pm-3m 0.419,0.419,0.419,90,90,90 perovskite family - 10.63 X 15209
B-Pd-Pr Pr2Pd15B5 Nd2Pd14.9 B4.9,tI96,141 I41/amd 0.8582,0.8582,1.66,90,90,90 - - 10.50 A 52631
B-Pd-Sc ScPd3B0.5 CaTiO3,cP5,221 Pm-3m 0.4011,0.4011,0.4011,90,90,90 perovskite family - 9.51 X 43342
B-Pd-Sm SmPd3B rt CaTiO3,cP5,221 Pm-3m 0.4156,0.4156,0.4156,90,90,90 perovskite family - 11.11 X 15209
B-Pd-Sm Sm2Pd15B5 Nd2Pd14.9 B4.9,tI96,141 I41/amd 0.8516,0.8516,1.6589,90,90,90 - - 10.77 A 52631
B-Pd-Sr SrPd4B SrPd4B,oP24,62 Pnma 0.60014,0.55041,1.18723,90,90,90 - - 8.88 X 55527
B-Pd-Tb TbPd3B CaTiO3,cP5,221 Pm-3m 0.4138,0.4138,0.4138,90,90,90 perovskite family - 11.46 X 14482
B-Pd-Th ThPd0.84 B4.2 ThPd0.84 B4.2 ,cP10,200 Pm-3 0.42,0.42,0.42,90,90,90 - - 8.22 X 34000
B-Pd-Th Th2Pd14.9 B4.9 Nd2Pd14.9 B4.9,tI96,141 I41/amd 0.86102,0.86102,1.66019,90,90,90 - - 11.35 X 52631
B-Pd-Tm TmPd3B CaTiO3,cP5,221 Pm-3m 0.4111,0.4111,0.4111,90,90,90 perovskite family - 11.93 X 14482
B-Pd-U U2.5Pd20.5 B6 Cr23C6,cF116,225 Fm-3m 1.1687,1.1687,1.1687,90,90,90 - - 11.82 X 54679
B-Pd-W W0.9Pd0.9 B9 W1.83 B9,hP22,147 P-3 0.52,0.52,0.6316,90,90,120 - - 8.05 A 3670
B-Pd-W W1.33Pd1.82 B3.65 Mo2B4.65 ,hR21,166 R-3m 0.2981,0.2981,2.081,90,90,120 - - 14.86 A 3670
B-Pd-Y YPd3B0.5 CaTiO3,cP5,221 Pm-3m 0.4134,0.4134,0.4134,90,90,90 perovskite family - 9.72 X 43342
B-Pd-Y Y2Pd14B5 Y2Pd14B5,tI84,141 I41/amd 0.8484,0.8484,1.649,90,90,90 - - 9.63 X 41719
B-Pd-Yb YbPd3B CaTiO3,cP5,221 Pm-3m 0.4088,0.4088,0.4088,90,90,90 perovskite family - 12.23 X 14482
B-Pd-Yb Yb2Pd13.6 B5 Y2Pd14B5,tI84,141 I41/amd 0.83812,0.83812,1.66034,90,90,90 - - 10.52 X 54891
B-Pr-Pt PrPt2B CePt2B,hP12,180 P6222 0.54534,0.54534,0.78842,90,90,120 - - 13.29 A 42224
B-Pr-Pt PrPt3B CePt3B,tP5,99 P4mm 0.3995,0.3995,0.5061,90,90,90 - - 15.15 X 41718
B-Pr-Pt PrPt4B CeCo 4B,hP12,191 P6/mmm 0.5434,0.5434,0.7598,90,90,120 - - 15.93 X 42926
B-Pr-Re Pr2Re3B6 Pr2Re3B6,mS44,15 C12/c1 0.6779,1.0623,0.7569,90,90.84,90 - - 11.03 X 18931
B-Pr-Re Pr7Re24B24 Pr7Re24B24 ,tP220,116 P-4c2 1.0586,1.0586,2.522,90,90,90 - - 13.43 X 28743
B-Pr-Re Pr8Re12.62 B12 Pr8Re12.6 B12,hR99,166 R-3m 1.0665,1.0665,1.483,90,90,120 - - 12.30 X 24074
B-Pr-Rh PrRh3B CaTiO3,cP5,221 Pm-3m 0.421,0.421,0.421,90,90,90 perovskite family - 10.25 X 17128
B-Pr-Rh PrRh3B2 CeCo 3B2,hP6,191 P6/mmm 0.5456,0.5456,0.3113,90,90,120 - - 9.75 X 20758
B-Pr-Rh PrRh4B4 ht-hp CeCo 4B4,tP18,137 P42 /nmc 0.535,0.535,0.749,90,90,90 - - 9.23 A 20236
B-Pr-Rh PrRh4.8 B2 rt PrRh4.8 B2,oF116,69 Fmmm 0.5577,0.9697,2.564,90,90,90 - gray silver 9.43 X 21328
B-Pr-Rh Pr0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5612,0.5612,0.8577,90,90,120 - - 8.53 A 18158
B-Pr-Ru PrRu2B2 CeRu2B2,oF40,22 F222 0.64715,0.91117,1.00193,90,90,90 - - 8.20 A 20360
B-Pr-Ru PrRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5554,0.5554,0.3006,90,90,120 - - 9.63 X 13749
B-Pr-Ru PrRu4B4 LuRu4B4,tI72,142 I41/acd 0.7513,0.7513,1.5071,90,90,90 - gray 9.19 X 55439
B-Pr-S PrBS3 CeBS3,oP20,33 Pna21 0.75434,0.6013,0.8886,90,90,90 - green 4.09 X 55556
B-Pt-Rh Rh0.054 Pt0.928 B0.018 Cu,cF4,225 Fm-3m 0.3915,0.3915,0.3915,90,90,90 close-packed structure - 20.68 X 30195
B-Pt-Sr Sr0.67 Pt3B2 Ba0.67Pt3B2,hP12,194 P63 /mmc 0.6092,0.6092,0.5184,90,90,120 - - 13.27 A 11636
B-Pt-Tm TmPt2B CePt2B,hP12,180 P6222 0.5263,0.5263,0.78705,90,90,120 - - 15.04 X 54844
Handbook of Inorganic Substances – Edition 2015 : Data 301

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Pt-U UPt3B0.11 Mg3 Cd,hP8,194 P63/mmc 0.57606,0.57606,0.49055,90,90,120 close-packed structure - 19.42 F 21417
B-Pt-W W1.2Pt0.6 B9 W1.83 B9,hP22,147 P-3 0.5201,0.5201,0.631,90,90,120 - - 9.77 A 3670
B-Pt-Y YPt2B CePt2B,hP12,180 P6222 0.5296,0.5296,0.7879,90,90,120 - - 12.75 X 48628
B-Pt-Zn Zn3Pt9B3.86 Zn3Pt9B4,hP17,189 P-62m 0.91111,0.91111,0.286,90,90,120 - gray silver 16.10 X 29608
B-Pu-Rh PuRh3B2 ErIr3 B2,mS12,12 C12/m1 0.54246,0.93903,0.30844,90,90.82,90 - - 12.14 A 19134
B-Pu-Ru PuRu3B2 URu3B2,hP48,147 P-3 1.0987,1.0987,0.5972,90,90,120 - - 12.10 A 19134
B-Pu-Ru PuRu4B4 LuRu4B4,tI72,142 I41/acd 0.74611,0.74611,1.50064,90,90,90 - - 11.00 A 19134
B-Rb-S RbBS2 KBO2,hR72,167 R-3c 1.5813,1.5813,0.8804,90,90,120 - - 2.51 X 26635
B-Rb-S RbBS3 TlBS3,mP20,14 P121/c1 0.7082,1.1863,0.5794,90,106.54,90 - colorless 2.74 X 28109
B-Rb-S Rb3BS3 Rb3BS3,mP28,14 P121/c1 1.0215,0.6407,1.3069,90,103.64,90 - colorless 2.90 X 39559
B-Rb-S Rb4B9S9 Rb4B9Se9,aP44,2 P-1 1.0036,1.0085,1.0598,91.56,104.74,109.08 - yellow 2.48 X 42262
B-Rb-Se RbBSe 3 TlBS3,mP20,14 P121/c1 0.7279,1.2385,0.6169,90,105.67,90 - orange red 4.13 X 39104
B-Rb-Se Rb2B2Se7 Na2B2Se7,mS44,15 C12/c1 1.57686,0.7314,1.2414,90,121.433,90 - orange 4.05 X 39535
B-Rb-Se Rb4B9Se9 Rb4B9Se9,aP44,2 P-1 1.045,1.0512,1.0946,91.16,104.53,109.11 - colorless 3.49 X 36556
B-Re-Sc Sc0.8 Re0.2B2 AlB2 ,hP3,191 P6/mmm 0.3108,0.3108,0.3453,90,90,120 AlB2 family - 5.45 X 25444
B-Re-Sc Sc2ReB6 Y2ReB6,oP36,55 Pbam 0.8856,1.1169,0.3493,90,90,90 - - 6.56 A 25444
B-Re-Sm SmReB4 YCrB4,oP24,55 Pbam 0.6014,1.1631,0.3629,90,90,90 - - 9.94 A 15471
B-Re-Sm SmRe 4B4 *,t**,* - 0.7466,0.7466,1.059,90,90,90 - - - N 15471
B-Re-Sm Sm2 Re3B6 Pr2Re3B6,mS44,15 C12/c1 0.6733,1.0537,0.7499,90,90.4,90 - - 11.54 A 22919
B-Re-Ta Ta0.15 Re0.85 B2 ReB2,hP6,194 P63/mmc 0.29,0.29,0.7482,90,90,120 - - 12.62 A 5905
B-Re-Ta Ta0.2 Re2.8B Re3B,oS16,63 Cmcm 0.2902,0.9345,0.7322,90,90,90 - - 19.01 A 5905
B-Re-Ta Ta1.2 Re5.8B3 Th7Fe3,hP20,186 P63mc 0.7554,0.7554,0.4935,90,90,120 - - 18.11 A 5905
B-Re-Ta Ta1.5 Re1.5B2 U3Si2,tP10,127 P4/mbm 0.5989,0.5989,0.3282,90,90,90 - - 16.15 X 5905
B-Re-Tb TbReB4 YCrB4,oP24,55 Pbam 0.59776,1.1564,0.36058,90,90,90 - - 10.35 A 37960
B-Re-Tb Tb11 Re36B36 *,tP*,118 P-4n2 1.0624,1.0624,3.829,90,90,90 - - - N 37960
B-Re-Tb Tb2ReB6 Y2ReB6,oP36,55 Pbam 0.9206,1.156,0.3669,90,90,90 - - 9.68 A 37960
B-Re-Tb Tb3ReB7 Er3CrB7,oS44,63 Cmcm 0.3544,1.5884,0.94,90,90,90 - - 9.27 A 19085
B-Re-Tb Tb8Re 12.96 B12 Pr8Re12.6 B12,hR99,166 R-3m 1.06233,1.06233,1.4318,90,90,120 - - 13.58 X 37960
B-Re-Th ThReB4 ThMoB4,oS24,65 Cmmm 0.7436,0.9606,0.3715,90,90,90 - - 11.55 A 8421
B-Re-Ti Ti2ReB2 U3Si2,tP10,127 P4/mbm 0.5898,0.5898,0.3189,90,90,90 - - 9.09 X 5971
B-Re-Tm Tm2 ReB6 Y2ReB6,oP36,55 Pbam 0.9102,1.146,0.3622,90,90,90 - - 10.35 A 7007
B-Re-Tm Tm3 ReB7 Er3CrB7,oS44,63 Cmcm 0.3474,1.5582,0.9307,90,90,90 - - 10.13 A 19085
B-Re-U UReB3 UReB3,hP10,194 P63/mmc 0.5083,0.5083,0.5095,90,90,120 - - 13.30 X 20009
B-Re-U UReB4 ThMoB4,oS24,65 Cmmm 0.7318,0.9371,0.3597,90,90,90 - - 12.59 A 9210
B-Re-U U2ReB6 Y2ReB6,oP36,55 Pbam 0.93,1.1385,0.3634,90,90,90 - - 12.55 A 30207
B-Re-V V0.09 Re0.91B2 ReB2,hP6,194 P63/mmc 0.2887,0.2887,0.7442,90,90,120 - - 12.10 A 4655
B-Re-V V0.21 Re2.79B Re3B,oS16,63 Cmcm 0.2869,0.9335,0.7218,90,90,90 - - 18.59 A 4655
B-Re-V V0.38 Re1.62B Mg2 Cu,oF48,70 Fddd 0.4487,0.7845,1.5345,90,90,90 - - 16.32 X 4655
B-Re-V V0.4 Re0.6 B MoB,tI16,141 I41/amd 0.3023,0.3023,1.642,90,90,90 - - 12.65 X 4655
B-Re-V V0.8 Re1.2 B CuAl2,tI12,140 I4/mcm 0.5409,0.5409,0.4545,90,90,90 - - 13.74 X 4655
B-Re-V V0.86 Re0.14B TlI,oS8,63 Cmcm 0.3079,0.8032,0.2992,90,90,90 CrB(TlI)-FeB - 7.24 A 4655
B-Re-V V2.76 Re0.24B2 U3Si2,tP10,127 P4/mbm 0.5734,0.5734,0.3017,90,90,90 - - 6.93 A 4655
B-Re-W WReB CuAl2,tI12,140 I4/mcm 0.555,0.555,0.466,90,90,90 - - 17.62 A 6743
B-Re-Y YReB4 YCrB4,oP24,55 Pbam 0.6,1.148,0.3577,90,90,90 - - 8.58 A 11012
B-Re-Y YRe 11B *,cI*,* - 1.066,1.066,1.066,90,90,90 - - - N 11012
B-Re-Y YRe 4B4 *,t**,* - 0.74,0.74,1.058,90,90,90 - - - N 11012
B-Re-Y Y2ReB6 Y2ReB6,oP36,55 Pbam 0.9175,1.155,0.3673,90,90,90 - - 7.32 X 7007
B-Re-Y Y3ReB7 Er3CrB7,oS44,63 Cmcm 0.3537,1.5848,0.9396,90,90,90 - - 6.67 X 19085
B-Re-Yb YbReB4 YCrB4,oP24,55 Pbam 0.5926,1.143,0.3566,90,90,90 - - 11.07 A 31667
B-Re-Zr Zr9Re4B Hf9Mo4B,hP28,194 P63/mmc 0.8525,0.8525,0.8651,90,90,120 - - 9.62 A 7661
B-Rh-Sc ScRh3B CaTiO3,cP5,221 Pm-3m 0.408,0.408,0.408,90,90,90 perovskite family gray silver 8.91 X 43525
B-Rh-Sc Sc2RhB6 Y2ReB6,oP36,55 Pbam 0.89144,1.12105,0.34833,90,90,90 - - 4.92 X 44881
B-Rh-Sc Sc3Rh5B2 Ti3Co 5B2,tP20,127 P4/mbm 0.9419,0.9419,0.3085,90,90,90 - - 8.14 X 39542
B-Rh-Sc Sc4Rh17B12 *,mP132,14 P121/c1 0.91602,1.07074,1.60714,90,100.886,90 - - 8.84 N 51315
B-Rh-Sm SmRh3B CaTiO3,cP5,221 Pm-3m 0.4195,0.4195,0.4195,90,90,90 perovskite family - 10.57 X 17128
B-Rh-Sm SmRh3B2 rt CeCo 3B2,hP6,191 P6/mmm 0.542,0.542,0.311,90,90,120 - - 10.09 X 23665
B-Rh-Sm Sm0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5605,0.5605,0.8507,90,90,120 - - 8.73 A 18557
B-Rh-Sn Rh3SnB0.8 Rh3SnB0.8 ,tP24,127 P4/mbm 0.57031,0.57031,0.83599,90,90,90 - gray 10.65 X 32439
B-Rh-Sn Rh6Sn4B Rh6Sn4B,hP22,194 P63/mmc 0.56001,0.56001,1.3675,90,90,120 - brown gray 9.86 X 32439
B-Rh-Sn Rh6Sn5B2 Ir6Sn5B2,hP13,189 P-62m 0.6548,0.6548,0.55732,90,90,120 - gray 9.89 X 32439
B-Rh-Sr SrRh2B2 CaRh2B2,oF40,70 Fddd 0.5989,0.9399,1.0672,90,90,90 - gray 6.97 X 12862
B-Rh-Sr Sr2Rh5B4 Ca2Rh5B4,oF44,69 Fmmm 0.5537,1.0006,1.1265,90,90,90 - - 7.80 X 17131
B-Rh-Sr Sr3Rh8B6 Ca3Rh8B6,oF68,69 Fmmm 0.5572,0.9921,1.7118,90,90,90 - - 8.08 X 17131
B-Rh-Sr Sr5Rh14B10 Sr5Rh14B10,oF116,69 Fmmm 0.5601,0.9845,2.8903,90,90,90 - - 8.28 X 17131
B-Rh-Ta Ta7Rh6B8 Ta7Rh6B8,hP150,176 P63/m 1.60861,1.60861,0.65592,90,90,120 - - 13.36 X 58368
B-Rh-Tb TbRh3B CaTiO3,cP5,221 Pm-3m 0.4175,0.4175,0.4175,90,90,90 perovskite family - 10.92 X 17128
B-Rh-Tb TbRh3B2 ErIr3 B2,mS12,12 C12/m1 0.539,0.9335,0.31,90,91.,90 - - 10.42 A 14265
B-Rh-Tb Tb0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5584,0.5584,0.8499,90,90,120 - - 8.90 A 18557
B-Rh-Th ThRh3B CaTiO3,cP5,221 Pm-3m 0.4265,0.4265,0.4265,90,90,90 perovskite family - 11.81 X 20254
B-Rh-Th ThRh4B4 CeCo 4B4,tP18,137 P42/nmc 0.5352,0.5352,0.7532,90,90,90 - - 10.57 A 14294
B-Rh-Ti Ti2Rh6B K2PtCl6,cF36,225 Fm-3m 0.78191,0.78191,0.78191,90,90,90 fluorite family - 10.06 X 47697
B-Rh-Tm TmRhB4 YCrB4,oP24,55 Pbam 0.59237,1.14843,0.35218,90,90,90 - - 8.74 X 50916
B-Rh-Tm TmRh3B CaTiO3,cP5,221 Pm-3m 0.4129,0.4129,0.4129,90,90,90 perovskite family - 11.52 X 17128
B-Rh-Tm TmRh3B2 ErIr3 B2,mS12,12 C12/m1 0.5357,0.9285,0.3091,90,90.8,90 - - 10.79 A 14265
B-Rh-Tm TmRh4B4 orth LuRh4B4,oS108,68 Ccce 0.7432,2.228,0.7455,90,90,90 - - 10.07 A 14940
B-Rh-Tm TmRh4B4 tet CeCo 4B4,tP18,137 P42/nmc 0.5287,0.5287,0.7359,90,90,90 - - 10.07 A 16433
B-Rh-Tm Tm0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5562,0.5562,0.8487,90,90,120 - - 9.09 A 18557
B-Rh-Tm Tm2 RhB6 Y2ReB6,oP36,55 Pbam 0.9078,1.1433,0.36048,90,90,90 - - 8.98 A 44613
302 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Rh-U URh3B0.8 CaTiO3,cP5,221 Pm-3m 0.415,0.415,0.415,90,90,90 perovskite family - 12.90 X 22744


B-Rh-W W0.6 Rh1.2B9 W1.83 B9,hP22,147 P-3 0.52,0.52,0.6277,90,90,120 - - 7.48 A 3670
B-Rh-Y YRhB4 YCrB4,oP24,55 Pbam 0.59553,1.15494,0.35548,90,90,90 - - 6.39 X 50916
B-Rh-Y YRh3B0.706 CaTiO3,cP5,221 Pm-3m 0.4117,0.4117,0.4117,90,90,90 perovskite family gray silver 9.64 X 35940
B-Rh-Y YRh3B2 ErIr3B2,mS12,12 C12/m1 0.5377,0.9325,0.3102,90,90.9,90 - - 8.95 A 14265
B-Rh-Y YRh4B4 CeCo 4B4,tP18,137 P42 /nmc 0.5305,0.5305,0.74,90,90,90 - - 8.67 A 26059
B-Rh-Y Y0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5587,0.5587,0.8469,90,90,120 - - 8.16 A 18557
B-Rh-Yb YbRhB4 YCrB4,oP24,55 Pbam 0.59187,1.14805,0.35099,90,90,90 - - 8.89 X 50916
B-Rh-Yb YbRh2.67 B CaTiO3,cP5,221 Pm-3m 0.41299,0.41299,0.41299,90,90,90 perovskite family - 10.81 X 49897
B-Rh-Yb YbRh3B2 ErIr3B2,mS12,12 C12/m1 0.5355,0.928,0.309,90,90.9,90 - - 10.89 A 14265
B-Rh-Yb YbRh4B4 LuRh4B4,oS108,68 Ccce 0.7424,2.226,0.7458,90,90,90 - - 10.15 A 14940
B-Rh-Yb Yb0.5 Rh3B2 La0.81 Rh3B2,hP26,191 P6/mmm 0.5558,0.5558,0.845,90,90,120 - - 9.19 A 18557
B-Rh-Yb Yb2RhB6 Y2ReB6,oP36,55 Pbam 0.90744,1.14172,0.35929,90,90,90 - - 9.17 A 44613
B-Rh-Zn Zn11Rh18B8 Zn11Rh18B8,tP74,127 P4/mbm 1.7712,1.7712,0.2864,90,90,90 - gray 9.83 X 35216
B-Rh-Zn Zn5Rh7B3 Zn5Ir7B3,oP30,51 Pmma 1.1016,0.28394,1.1666,90,90,90 - gray silver 9.83 X 36668
B-Rh-Zn Zn5Rh8B4 Zn5Rh8B4,oS34,65 Cmmm 0.8467,1.6787,0.2846,90,90,90 - - 9.80 X 49588
B-Rh-Zn Zn7.4 Rh8.6 B3 Zn7(Zn0.4 Rh0.6 )Rh8B3,oP38,51 Pmma 1.1171,0.28538,1.4848,90,90,90 - gray silver 9.83 X 36668
B-Rh-Zr ZrRh3B CaTiO3,cP5,221 Pm-3m 0.4044,0.4044,0.4044,90,90,90 perovskite family - 10.31 X 12459
B-Ru-Sc ScRu4B4 LuRu4B4,tI72,142 I41/acd 0.7346,0.7346,1.4895,90,90,90 - - 8.14 A 12605
B-Ru-Sc Sc2Ru5B4 Sc2Ru5B4,mP22,10 P12/m1 0.8486,0.30001,0.9983,90,90.01,90 - - 8.34 X 17279
B-Ru-Sm SmRu2B2 CeRu2B2,oF40,22 F222 0.65081,0.90275,0.98803,90,90,90 - - 8.56 A 20360
B-Ru-Sm SmRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5536,0.5536,0.2997,90,90,120 - - 9.92 X 13749
B-Ru-Sm SmRu4B4 LuRu4B4,tI72,142 I41/acd 0.7491,0.7491,1.506,90,90,90 - gray 9.40 X 55439
B-Ru-Sr Sr2Ru7B8 Sr2Ru7B8,tP34,84 P42 /m 0.6444,0.6444,1.0156,90,90,90 - gray 7.63 X 25500
B-Ru-Ta Ta3.1 Ru19.9 B6 Cr23C6,cF116,225 Fm-3m 1.1347,1.1347,1.1347,90,90,90 - - 11.99 X 12581
B-Ru-Ta Ta7Ru6B8 Nb7Ru6B8 ,hP21,175 P6/m 0.94695,0.94695,0.3137,90,90,120 - - 13.36 X 58368
B-Ru-Tb TbRuB2 LuRuB2,oP16,62 Pnma 0.5897,0.5311,0.6367,90,90,90 - - 9.38 A 13562
B-Ru-Tb TbRuB4 YCrB4,oP24,55 Pbam 0.5958,1.1532,0.3551,90,90,90 - - 8.26 A 12511
B-Ru-Tb TbRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5495,0.5495,0.301,90,90,120 - - 10.21 X 13749
B-Ru-Tb TbRu4B4 LuRu4B4,tI72,142 I41/acd 0.7456,0.7456,1.4995,90,90,90 - - 9.66 A 11021
B-Ru-Tb Tb2RuB6 Y2ReB6,oP36,55 Pbam 0.91796,1.15407,0.3665,90,90,90 - - 8.28 A 17266
B-Ru-Th ThRu2B2 CeRu2B2,oF40,22 F222 0.64608,0.90759,1.00927,90,90,90 - - 10.23 A 20360
B-Ru-Th ThRu3B0.9 CaTiO3,cP5,221 Pm-3m 0.4231,0.4231,0.4231,90,90,90 perovskite family - 11.95 X 7754
B-Ru-Th ThRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5526,0.5526,0.307,90,90,120 - - 11.39 X 13749
B-Ru-Th ThRu4B4 LuRu4B4,tI72,142 I41/acd 0.754,0.754,1.5143,90,90,90 - - 10.49 A 11021
B-Ru-Ti Ti10Ru19B8 Zn11Rh18B8,tP74,127 P4/mbm 1.7591,1.7591,0.29645,90,90,90 - - 9.00 X 53460
B-Ru-Tm TmRuB2 LuRuB2,oP16,62 Pnma 0.5831,0.5254,0.6299,90,90,90 - - 10.04 A 13562
B-Ru-Tm TmRuB4 YCrB4,oP24,55 Pbam 0.5913,1.144,0.3511,90,90,90 - - 8.76 A 12511
B-Ru-Tm TmRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5461,0.5461,0.3012,90,90,120 - - 10.54 X 13749
B-Ru-Tm TmRu4B4 LuRu4B4,tI72,142 I41/acd 0.7429,0.7429,1.4965,90,90,90 - - 9.92 A 11021
B-Ru-Tm Tm2RuB6 Y2ReB6,oP36,55 Pbam 0.90605,1.14203,0.36091,90,90,90 - - 8.96 A 17266
B-Ru-U URuB4 ThMoB4,oS24,65 Cmmm 0.732,0.94,0.354,90,90,90 - - 10.43 A 30207
B-Ru-U URu3B0.75 CaTiO3,cP5,221 Pm-3m 0.4065,0.4065,0.4065,90,90,90 perovskite family - 13.58 X 7754
B-Ru-U URu3B2 URu3B2,hP48,147 P-3 1.09531,1.09531,0.59353,90,90,120 - - 12.13 X 13411
B-Ru-U URu4B4 LuRu4B4,tI72,142 I41/acd 0.7459,0.7459,1.4986,90,90,90 - - 10.92 X 13546
B-Ru-V V0.5 Ru0.5 B FeB-b,oP8,62 Pnma 0.5812,0.2996,0.4333,90,90,90 CrB(TlI)-FeB - 7.64 A 7670
B-Ru-W W0.3 Ru0.7B2 ReB2,hP6,194 P63 /mmc 0.2906,0.2906,0.7452,90,90,120 - - 8.99 A 5465
B-Ru-W W0.5 Ru0.5B FeB-b,oP8,62 Pnma 0.5971,0.3038,0.4455,90,90,90 CrB(TlI)-FeB - 12.60 A 6887
B-Ru-W W1.75 Ru1.25 B2 Mo2IrB2,oP20,58 Pnnm 0.7459,0.9579,0.3072,90,90,90 - - 14.21 A 9240
B-Ru-Y YRuB2 LuRuB2,oP16,62 Pnma 0.5918,0.5297,0.6377,90,90,90 - - 7.03 A 13562
B-Ru-Y YRuB4 YCrB4,oP24,55 Pbam 0.5954,1.1524,0.3559,90,90,90 - - 6.34 A 12511
B-Ru-Y YRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5481,0.5481,0.3028,90,90,120 - - 8.72 X 13749
B-Ru-Y YRu4B4 LuRu4B4,tI72,142 I41/acd 0.744,0.744,1.499,90,90,90 - - 8.59 X 16435
B-Ru-Y Y2RuB6 Y2ReB6,oP36,55 Pbam 0.91498,1.15139,0.36501,90,90,90 - - 5.94 A 17266
B-Ru-Yb YbRuB4 YCrB4,oP24,55 Pbam 0.5907,1.1429,0.352,90,90,90 - - 8.87 A 12511
B-Ru-Yb YbRu3B2 CeCo 3B2,hP6,191 P6/mmm 0.5464,0.5464,0.3006,90,90,120 - - 10.64 X 13749
B-Ru-Yb YbRu4B4 LuRu4B4,tI72,142 I41/acd 0.7427,0.7427,1.4962,90,90,90 - - 9.99 A 11021
B-Ru-Yb Yb2RuB6 Y2ReB6,oP36,55 Pbam 0.90371,1.14129,0.36011,90,90,90 - - 9.16 A 17266
B-S-Sm SmBS3 CeBS3,oP20,33 Pna21 0.73657,0.60272,0.88004,90,90,90 - brown red 4.38 X 55559
B-S-Sr SrB2S4 mon SrB2S4,mP28,14 P121/c1 0.6476,1.4147,0.6092,90,110.54,90 - colorless 3.02 X 25945
B-S-Sr SrB2S4 rhom SrB2S4,hR63,148 R-3 0.8605,0.8605,2.1542,90,90,120 - colorless 2.57 X 42391
B-S-Sr Sr3B2S6 Sr3B2S6,mS44,15 C12/c1 1.0187,0.661,1.5411,90,102.24,90 - colorless 3.12 X 42391
B-S-Tb TbBS3 CeBS3,oP20,33 Pna21 0.72053,0.60784,0.8719,90,90,90 - yellow 4.63 X 55560
B-S-Tl TlBS *,o*36,* - 0.504,1.059,1.818,90,90,90 - gray - N 10670
B-S-Tl TlBS2 TlBS2,hR72,166 R-3m 0.9891,0.9891,1.7412,90,90,120 - red dark 5.66 X 25945
B-S-Tl TlBS3 TlBS3,mP20,14 P121/c1 0.6874,1.1739,0.5775,90,113.08,90 - yellow 4.82 X 28109
B-S-Tl Tl3BS3 Tl3BS3,mP14,11 P121/m1 0.5444,0.9699,0.669,90,98.13,90 - black 6.84 X 21304
B-S-Tl Tl3B3S10 Tl3B3S10,aP32,2 P-1 0.6828,0.7713,1.3769,104.32,94.03,94.69 - yellow 4.60 X 28109
B-S-Tm Tm3B1.67 S7 Cu2U3S7,hP24,173 P63 0.92869,0.92869,0.58781,90,90,120 - orange 5.67 X 56910
B-S-Yb Yb3B1.67 S7 Cu2U3S7,hP24,173 P63 0.92514,0.92514,0.58805,90,90,120 - yellow 5.80 X 56910
B-Sc-Si Sc1.13 Si0.20 B22.3 Sc1.13 Si0.20 B22.3 ,tP216,92 P41212 1.03081,1.03081,1.42589,90,90,90 - - 2.61 X 39170
B-Sc-Sn Sc3SnB CaTiO3,cP5,221 Pm-3m 0.4571,0.4571,0.4571,90,90,90 perovskite family - 4.60 X 10736
B-Sc-Tl TlSc3B CaTiO3,cP5,221 Pm-3m 0.452,0.452,0.452,90,90,90 perovskite family - 6.29 X 10736
B-Sc-V Sc0.55 V0.45 B2 AlB2,hP3,191 P6/mmm 0.305,0.305,0.332,90,90,120 AlB2 family - 4.30 X 45618
B-Sc-V Sc0.95 V0.05 B2 AlB2,hP3,191 P6/mmm 0.314,0.314,0.351,90,90,120 AlB2 family - 3.71 X 45618
B-Sc-W Sc0.85 W0.15 B2 AlB2,hP3,191 P6/mmm 0.312,0.312,0.346,90,90,120 AlB2 family - 4.98 X 25444
B-Sc-Zr Sc0.4 Zr0.6 B12 lt (Sc0.5 Zr0.5)B12,hR78,166 R-3m 0.52278,0.52278,2.56752,90,90,120 - - 3.32 X 27995
B-Se-Tl TlBSe3 TlBSe3,mS20,9 C1c1 0.72356,1.2109,0.6166,90,117.31,90 - red deep 6.26 X 39104
Handbook of Inorganic Substances – Edition 2015 : Data 303

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

B-Se-Tl Tl2B2Se7 Na2B2Se7,mS44,15 C12/c1 1.52391,0.7091,1.1878,90,119.338,90 - red deep 5.84 X 39535


B-Se-Tl Tl3BSe 3 Tl3BS3,mP14,11 P121/m1 0.5547,1.0099,0.6852,90,97.59,90 - black 7.51 X 21304
B-Se-Tl Tl3B3Se10 Tl3B3S10,aP32,2 P-1 0.7099,0.8072,1.4545,105.24,95.82,92.79 - red deep 5.98 X 39535
B-Si-Sm Sm5 Si2B8 Y5Si1.9 B8,tP30,127 P4/mbm 0.72616,0.72616,0.8226,90,90,90 - - 6.85 X 45149
B-Si-Ta Ta3Si0.888 B0.112 Ti3P,tP32,86 P42/n 1.0183,1.0183,0.5169,90,90,90 - - 14.10 X 58902
B-Si-Ta Ta5Si1.3 B1.7 Cr5B3,tI32,140 I4/mcm 0.62603,0.62603,1.16008,90,90,90 - - 14.02 X 58902
B-Si-Ta Ta5Si2.58 B0.42 Mn5 Si3,hP16,193 P63/mcm 0.749,0.749,0.524,90,90,120 - - 12.81 A 790
B-Si-Tb Tb2.04 Si9.42 B36 Tb1.8 Si8B36C2,hR147,166 R-3m 1.0075,1.0075,1.639,90,90,120 - - 3.38 X 41869
B-Si-Tb Tb5Si2B8 Y5Si1.9 B8,tP30,127 P4/mbm 0.7232,0.7232,0.81263,90,90,90 - - 7.32 X 45149
B-Si-Tb Tb5Si3B CuHf5Sn3,hP18,193 P63/mcm 0.8427,0.8427,0.6332,90,90,120 AlB2 family - 7.59 A 47006
B-Si-Ti Ti5Si3B0.75 CuHf5Sn3,hP18,193 P63/mcm 0.7478,0.7478,0.51799,90,90,120 AlB2 family - 4.39 A 37280
B-Si-Ti Ti6Si2B K2UF6,hP9,189 P-62m 0.68015,0.68015,0.33377,90,90,120 Fe2P family - 4.40 X 42936
B-Si-Tm Tm2.1 Si9B36 Tb1.8 Si8B36C2,hR147,166 R-3m 1.0068,1.0068,1.631,90,90,120 - - 3.47 A 41869
B-Si-V V5Si0.52 B2.48 Mo5 SiB2,tI32,140 I4/mcm 0.5789,0.5789,1.0785,90,90,90 - - 5.44 A 52816
B-Si-V V5Si2.58 B0.42 Mn5 Si3,hP16,193 P63/mcm 0.719,0.719,0.49,90,90,120 - - 5.02 A 790
B-Si-W W5Si1.5 B1.5 Cr5B3,tI32,140 I4/mcm 0.6047,0.6047,1.099,90,90,90 - - 16.16 A 890
B-Si-W W5Si2.58 B0.42 W5Si3,tI32,140 I4/mcm 0.96,0.96,0.494,90,90,90 - - 14.54 A 790
B-Si-Y YSi0.15 B1.85 AlB2 ,hP3,191 P6/mmm 0.3305,0.3305,0.3856,90,90,120 AlB2 family - 5.15 X 46652
B-Si-Y YSi1.2 B41 YSi1.2 B41,oP384,55 Pbam 1.6674,1.7667,0.9511,90,90,90 - - 2.68 X 33499
B-Si-Y YSi1.25B41 YSi1.25 B41,oP356,55 Pbam 1.668,1.7652,0.9512,90,90,90 - black 2.69 X 56848
B-Si-Y Y0.68 Si3.12B12 Y0.68 Si3.14 B12,hR153,166 R-3m 1.00841,1.00841,1.64714,90,90,120 - - 2.86 X 40470
B-Si-Y Y5Si1.87 B8 Y5Si1.9 B8,tP30,127 P4/mbm 0.72234,0.72234,0.80961,90,90,90 - black 4.59 X 42447
B-Si-Y Y5Si3B0.65 CuHf5Sn3,hP18,193 P63/mcm 0.84033,0.84033,0.63351,90,90,120 AlB2 family - 4.59 X 47006
B-Si-Yb Yb2.1 Si9B36 Tb1.8 Si8B36C2,hR147,166 R-3m 1.0095,1.0095,1.647,90,90,120 - - 3.45 A 41869
B-Si-Zr Zr5Si2.58 B0.42 Mn5 Si3,hP16,193 P63/mcm 0.794,0.794,0.557,90,90,120 - - 5.82 A 790
B-Sm-Tm Sm0.65 Tm0.35 B6 CaB6,cP7,221 Pm-3m 0.4121,0.4121,0.4121,90,90,90 - - 5.26 A 21731
B-Sm-Yb Sm0.3 Yb0.7 B6 CaB6,cP7,221 Pm-3m 0.4136,0.4136,0.4136,90,90,90 - - 5.42 A 24036
B-Sn-Ti Ti0.89 Sn0.11 B0.08 Mg,hP2,194 P63/mmc 0.2963,0.2963,0.4736,90,90,120 close-packed structure - 5.22 F 44925
B-Ta-Te Ta4BTe 8 Ta4BTe 8,oP26,55 Pbam 1.1016,1.6755,0.3564,90,90,90 - - 8.86 X 35407
B-Ta-Ti Ti0.7 Ta0.3 B2 AlB2 ,hP3,191 P6/mmm 0.30738,0.30738,0.32109,90,90,120 AlB2 family - 6.92 X 54731
B-Ta-V Ta0.4 V0.6 B2 AlB2 ,hP3,191 P6/mmm 0.3034,0.3034,0.3144,90,90,120 AlB2 family - 8.25 X 3633
B-Ta-W TaWB CuAl2,tI12,140 I4/mcm 0.565,0.565,0.482,90,90,90 - - 16.21 A 6743
B-Ta-W Ta0.2 W0.8 B TlI,oS8,63 Cmcm 0.3083,0.8487,0.3168,90,90,90 CrB(TlI)-FeB - 15.55 A 6288
B-Ta-W Ta1.5 W1.5 B2 rt U3Si2,tP10,127 P4/mbm 0.5795,0.5795,0.338,90,90,90 - - 16.64 A 6288
B-Ta-Zr Zr0.6 Ta0.4 B2 AlB2 ,hP3,191 P6/mmm 0.315,0.315,0.345,90,90,120 AlB2 family - 8.33 X 52466
B-Tb-V TbVB4 YCrB4,oP24,55 Pbam 0.597,1.16,0.3475,90,90,90 - - 6.99 A 5216
B-Tb-W TbWB4 YCrB4,oP24,55 Pbam 0.6047,1.169,0.3606,90,90,90 - - 10.06 A 6640
B-Tb-W Tb3WB7 Er3CrB7,oS44,63 Cmcm 0.3479,1.608,0.9486,90,90,90 - - 9.22 A 25997
B-Th-U Th0.5 U0.5 B4 UB4 ,tP20,127 P4/mbm 0.719,0.719,0.4062,90,90,90 - - 8.80 A 1484
B-Th-V ThVB4 ThMoB4,oS24,65 Cmmm 0.7453,0.9623,0.3682,90,90,90 - - 8.21 A 8421
B-Th-W ThWB4 ThMoB4,oS24,65 Cmmm 0.7487,0.9681,0.3739,90,90,90 - - 11.25 X 8421
B-Ti-V Ti0.3 V0.7 B TlI,oS8,63 Cmcm 0.311,0.819,0.3,90,90,90 CrB(TlI)-FeB - 5.29 A 4885
B-Ti-V Ti0.5 V0.5 B2 AlB2 ,hP3,191 P6/mmm 0.301,0.301,0.315,90,90,120 AlB2 family - 4.77 X 599
B-Ti-V Ti0.75 V2.25 B2 U3Si2,tP10,127 P4/mbm 0.575,0.575,0.304,90,90,90 - - 5.69 A 4885
B-Ti-V Ti0.8 V0.2 B FeB-b,oP8,62 Pnma 0.6,0.3,0.45,90,90,90 CrB(TlI)-FeB - 4.86 A 4885
B-Ti-W Ti0.4 W0.6 B TlI,oS8,63 Cmcm 0.3075,0.8395,0.3187,90,90,90 CrB(TlI)-FeB - 11.33 A 6288
B-Ti-W Ti0.7 W0.3 B FeB-b,oP8,62 Pnma 0.5984,0.3049,0.4532,90,90,90 CrB(TlI)-FeB - 7.99 A 6288
B-Ti-W Ti0.91 W0.09B2 AlB2 ,hP3,191 P6/mmm 0.3026,0.3026,0.3213,90,90,120 AlB2 family - 5.33 X 6288
B-Ti-Zr Zr0.06 Ti0.94 B FeB-b,oP8,62 Pnma 0.6111,0.3053,0.4589,90,90,90 CrB(TlI)-FeB - 4.76 A 4867
B-Ti-Zr Zr0.5 Ti0.5 B2 AlB2 ,hP3,191 P6/mmm 0.31057,0.31057,0.34054,90,90,120 AlB2 family - 5.32 X 55921
B-Tm-W TmWB4 YCrB4,oP24,55 Pbam 0.59989,1.15866,0.35821,90,90,90 - - 10.57 X 37968
B-Tm-W Tm0.95 W0.05 B2 AlB2 ,hP3,191 P6/mmm 0.3247,0.3247,0.3711,90,90,120 AlB2 family - 9.38 X 37968
B-Tm-W Tm3 WB7 Er3CrB7,oS44,63 Cmcm 0.3416,1.57,0.938,90,90,90 - - 10.12 A 25997
B-Tm-Yb Tm0.3 Yb0.7 B12 UB12 ,cF52,225 Fm-3m 0.7473,0.7473,0.7473,90,90,90 - - 4.80 A 24036
B-Tm-Yb Tm0.3 Yb0.7 B6 CaB6,cP7,221 Pm-3m 0.4143,0.4143,0.4143,90,90,90 - - 5.53 A 24036
B-U-V UVB4 YCrB4,oP24,55 Pbam 0.608,1.148,0.3524,90,90,90 - - 8.97 A 8994
B-U-W UWB4 ThMoB4,oS24,65 Cmmm 0.7379,0.9435,0.3627,90,90,90 - - 12.23 A 9210
B-U-W U2WB6 Y2ReB6,oP36,55 Pbam 0.93111,1.14062,0.367,90,90,90 - - 12.35 A 16154
B-U-Y Y0.5 U0.5 B4 UB4 ,tP20,127 P4/mbm 0.7095,0.7095,0.4006,90,90,90 - - 6.81 A 20221
B-U-Zr U0.5 Zr0.5 B12 UB12 ,cF52,225 Fm-3m 0.747,0.747,0.747,90,90,90 - - 4.69 A 1712
B-V-W V0.45 W1.55 B CuAl2,tI12,140 I4/mcm 0.5589,0.5589,0.4739,90,90,90 - - 14.30 A 7032
B-V-W V0.6 W0.4 B TlI,oS8,63 Cmcm 0.312,0.822,0.302,90,90,90 CrB(TlI)-FeB - 9.86 A 7032
B-V-W V2.25 W0.75 B2 U3Si2,tP10,127 P4/mbm 0.5766,0.5766,0.3056,90,90,90 - - 8.96 A 7032
B-V-Y YVB4 YCrB4,oP24,55 Pbam 0.5975,1.16,0.3485,90,90,90 - - 5.03 A 5216
B-V-Zr ZrV1.9 B0.1 MgCu2,cF24,227 Fd-3m 0.7412,0.7412,0.7412,90,90,90 Friauf-Laves phase - 6.17 X 35965
B-W-Y YWB4 YCrB4,oP24,55 Pbam 0.6037,1.165,0.3598,90,90,90 - - 8.29 A 10196
B-W-Y Y0.01 W0.99 B ht TlI,oS8,63 Cmcm 0.3132,0.845,0.3073,90,90,90 CrB(TlI)-FeB - 15.82 A 7403
B-W-Y Y3WB7 Er3CrB7,oS44,63 Cmcm 0.3467,1.5952,0.9475,90,90,90 - - 6.67 X 25997
B-W-Zr Zr9W4B Hf9Mo 4B,hP28,194 P63/mmc 0.8619,0.8619,0.8635,90,90,120 - - 9.37 A 7664
Ba-Be-F BaBeF4 Ba[SO4],oP24,62 Pnma 0.88594,0.53265,0.70493,90,90,90 - colorless 4.44 X 44985
Ba-Be-N BaBe 2N2 CaB2C2,tI20,140 I4/mcm 0.56646,0.56646,0.83942,90,90,90 - green 4.52 X 45686
Ba-Be-O Ba3Be 5O8 Ba3Be5O8,oP72,62 Pnma 0.9429,1.16347,0.7421,90,90,90 - yellow 4.77 X 45686
Ba-Be-Si BaBe 0.75 Si1.25 AlB2 ,hP3,191 P6/mmm 0.405,0.405,0.505,90,90,120 AlB2 family gray 4.15 X 8675
Ba-Bi-Cd BaCdBi2 SrZnBi2,tI16,139 I4/mmm 0.4768,0.4768,2.36,90,90,90 - - 8.27 X 14270
Ba-Bi-Cd Ba11 Cd8Bi14 Ba11 Cd8Bi14,mS66,12 C12/m1 2.8193,0.4893,1.6823,90,90.836,90 - - 7.64 X 46482
Ba-Bi-Cd Ba2Cd3Bi4 Ba2Cd3Bi4,oS36,64 Cmce 0.7001,1.733,0.9224,90,90,90 - black 8.59 X 47056
Ba-Bi-Cd Ba21 Cd4Bi18 Ba21 Cd4Sb18,oS344,64 Cmce 1.8438,1.9303,3.766,90,90,90 - - 7.03 A 50402
Ba-Bi-Cu BaCuBi BeZrSi,hP6,194 P63/mmc 0.4726,0.4726,0.9438,90,90,120 AlB2 family - 7.46 X 23592
304 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Bi-F Ba0.8 Bi0.2F2.2 (Ca0.68 Y0.32 )F2.32 ,cF92,225 Fm-3m 0.61118,0.61118,0.61118,90,90,90 fluorite family - 5.63 X 26744
Ba-Bi-F Ba4Bi3F17 Ba4Y3F17,hR159,148 R-3 1.123,1.123,2.07766,90,90,120 - - 6.58 X 43450
Ba-Bi-H Ba5Bi3H2 Mn5Si3,hP16,193 P63 /mcm 1.0096,1.0096,0.7766,90,90,120 - - 6.37 F 46240
Ba-Bi-In Ba5In4Bi5 Ba5In4Bi5,tP28,104 P4nc 1.062,1.062,0.9009,90,90,90 - gray silver 7.16 X 42770
Ba-Bi-Mg BaMg2Bi2 Ce2SO2,hP5,164 P-3m1 0.486,0.486,0.822,90,90,120 - gray silver 5.97 X 11115
Ba-Bi-Mn BaMnBi2 SrZnBi2,tI16,139 I4/mmm 0.463,0.463,2.422,90,90,90 - gray steel 7.81 A 11112
Ba-Bi-Mn Ba14MnBi11 Ca14AlSb11 ,tI208,142 I41/acd 1.8633,1.8633,2.434,90,90,90 - bronze 6.72 X 25886
Ba-Bi-Mn Ba32Mn15 Bi32 *,oI316,74 Imma 2.562,2.5691,1.7156,90,90,90 - - 7.00 N 54022
Ba-Bi-N Ba3BiN BaNiO3,hP10,194 P63 /mmc 0.76111,0.76111,0.66792,90,90,120 perovskite family black 6.29 X 43975
Ba-Bi-Na NaBaBi ZrNiAl,hP9,189 P-62m 0.8591,0.8591,0.5091,90,90,120 Fe2P family blue 5.65 X 43927
Ba-Bi-O BaBiO2.5 ht *,t**,* - 0.4473,0.4473,0.4583,90,90,90 - - - N 23857
Ba-Bi-O BaBiO2.82 ht3 CaTiO3,cP5,221 Pm-3m 0.4427,0.4427,0.4427,90,90,90 perovskite family black 7.49 X 23857
Ba-Bi-O BaBiO3 ht BaBiO3,tP9,123 P4/mmm 0.4364,0.4364,0.4518,90,90,90 - brown dark 7.61 X 11052
Ba-Bi-O BaBiO3 ht2 BaBiO3,cF40,225 Fm-3m 0.87684,0.87684,0.87684,90,90,90 perovskite family brown dark 7.77 X 23857
Ba-Bi-O BaBiO3 lt mon1 BaBiO3,mS20,12 C12/m1 1.06459,0.6145,0.61908,90,125.393,90 perovskite family golden 7.93 X 23942
Ba-Bi-O BaBiO3 lt mon2 HoNiO3,mP20,14 P121/c1 0.61741,0.61248,1.06528,90,125.689,90 perovskite family - 8.01 X 46110
Ba-Bi-O BaBiO3 rt tricl (Zr0.52 Ti0.48 )PbO3,aP10,1 P1 0.6186,0.61557,0.61515,59.86,59.702,59.711 - - 7.95 X 54347
Ba-Bi-O BaBi15O23.5 *,hR*,* - 0.6018,0.6018,0.407,90,90,120 - - - N 49424
Ba-Bi-O BaBi2O4 *,oP*,47 Pmmm 0.4352,0.4352,0.4491,90,90,90 - - - N 32326
Ba-Bi-O BaBi4O7 *,tI*,* - 0.4297,0.4297,0.4472,90,90,90 - - - N 49424
Ba-Bi-O Ba0.04 Bi1.96 O2.98 Bi2O3,mP20,14 P121/c1 0.5847,0.8164,0.7508,90,112.98,90 - - 9.32 A 49424
Ba-Bi-O Ba0.468 Bi2.532 O4.266 ht (Eu0.5 Yb0.5 )Fe2O4,hR21,166 R-3m 0.4054,0.4054,2.888,90,90,120 - - 8.02 X 16619
Ba-Bi-O Ba0.468 Bi2.532 O4.266 rt (Eu0.5 Yb0.5 )Fe2O4,hR21,166 R-3m 0.4005,0.4005,2.854,90,90,120 - - 8.31 X 16619
Ba-Bi-O Ba0.6 Bi2.4O4.2 *,hR9,166 R-3m 0.401,0.401,2.863,90,90,120 - - 8.14 P 231
Ba-Bi-O Ba0.726 Bi1.274 O2.65 (Ba0.726 Bi0.274)BiO2.65 ,tP5,115 P-4m2 0.435,0.435,0.449,90,90,90 - - 7.98 X 231
Ba-Bi-O Ba1.11 Bi0.85 O3 ht1 BaBiO3,hR30,148 R-3 0.61803,0.61803,1.5054,90,90,120 perovskite family golden 7.56 X 27795
Ba-Bi-O Ba1.45 Bi0.55 O2.825 *,t**,* - 0.8925,0.8925,1.7303,90,90,90 - - - N 23759
Ba-Bi-O Ba12Bi22O45 *,oP*,47 Pmmm 0.4348,0.4356,0.4491,90,90,90 - - - N 32326
Ba-Bi-O Ba2Bi2O5 rt Ba2Bi2O5,mP18,14 P121/c1 0.73412,0.75793,0.60722,90,99.187,90 - purple 7.69 X 25056
Ba-Bi-O Ba2Bi6O11 *,mP*,* - 1.7314,1.79872,2.16425,90,90.221,90 - - - N 27703
Ba-Bi-O Ba2.5 Bi1.5O5.5 Sr3BiO5.5,tI20,139 I4/mmm 0.6205,0.6205,0.8733,90,90,90 - - 7.36 X 36725
Ba-Bi-O Ba3Bi2O6 *,oP*,47 Pmmm 0.4422,0.4458,0.4529,90,90,90 - yellow - N 33692
Ba-Bi-O Ba3Bi4O9 *,oP*,47 Pmmm 0.4361,0.4374,0.4455,90,90,90 - - - N 32326
Ba-Bi-O Ba3Bi8O15 *,oP*,47 Pmmm 0.4367,0.4394,0.4399,90,90,90 - - - N 32326
Ba-Bi-O Ba4Bi10O19 *,oP*,47 Pmmm 0.437,0.4396,0.44,90,90,90 - - - N 32326
Ba-Bi-O Ba4Bi2O Sr4Bi2O,tI16,139 I4/mmm 0.52662,0.52662,1.8625,90,90,90 - black 6.32 X 57477
Ba-Bi-O Ba4Bi2O7 *,oP*,47 Pmmm 0.4387,0.4387,0.4677,90,90,90 - yellow - N 33692
Ba-Bi-O Ba4Bi6O13 *,oP*,47 Pmmm 0.4368,0.4372,0.4459,90,90,90 - - - N 32326
Ba-Bi-O Ba5Bi4O11 *,oP*,47 Pmmm 0.4428,0.443,0.451,90,90,90 - orange - N 33692
Ba-Bi-O Ba6Bi10O21 *,oP*,47 Pmmm 0.4352,0.4366,0.4502,90,90,90 - - - N 32326
Ba-Bi-O Ba8Bi10O23 *,oP*,47 Pmmm 0.4364,0.4381,0.4511,90,90,90 - - - N 32326
Ba-Bi-O Ba8Bi14O29 *,oP*,47 Pmmm 0.4355,0.4361,0.4488,90,90,90 - - - N 32326
Ba-Bi-O Ba8Bi22O41 *,oP*,47 Pmmm 0.4373,0.4387,0.4392,90,90,90 - - - N 32326
Ba-Bi-O Ba8Bi6O17 *,oP*,47 Pmmm 0.4422,0.4426,0.4516,90,90,90 - yellow - N 33692
Ba-Bi-Pb BaPb2.73 Bi0.27 Cu3Au,cP4,221 Pm-3m 0.5159,0.5159,0.5159,90,90,90 close-packed structure - 9.18 X 3144
Ba-Bi-Pd BaPd2Bi2 SrPd2Bi2,mP10,11 P121/m1 0.4919,0.4854,1.0783,90,91.3,90 - red copper 9.91 X 47590
Ba-Bi-S BaBi2S4 hex1 BaBi2S4,hP64,176 P63 /m 2.1705,2.1705,0.4158,90,90,120 - - 6.02 X 15790
Ba-Bi-S BaBi2S4 hex2 Ba1.1 Bi2S4 ,hP86,176 P63 /m 2.5272,2.5272,0.41852,90,90,120 - - 5.88 X 15790
Ba-Bi-Sb Ba2BiSb2 W2CoB2,oI10,71 Immm 0.4803,0.7688,0.99,90,90,90 - gray silver 6.61 X 43006
Ba-Bi-Se BaBiSe3 BaBiSe3,oP40,19 P212121 0.437,1.6,1.724,90,90,90 - gray dark 6.43 X 13869
Ba-Bi-Se BaBi2Se4 Ba1.1 Bi2S4 ,hP86,176 P63 /m 2.6157,2.6157,0.43245,90,90,120 - - 6.77 X 38568
Ba-Bi-Se Ba3Bi6.67 Se13 Sr4Bi6Se13 ,mP46,11 P121/m1 1.72228,0.42729,1.84659,90,90.72,90 - black 6.92 X 37024
Ba-Bi-Sn Ba13Sn33.15 Bi5.85 Ba13Sn30(Sn0.36 Bi0.64 )9,hR156,166 R-3m 0.7273,0.7273,10.804,90,90,120 close-packed structure gray silver 6.99 X 49785
Ba-Bi-Sn Ba2Sn4.02 Bi1.98 Ba2Sn3(Sn0.34 Bi0.66 )3,hR48,166 R-3m 0.7276,0.7276,3.3713,90,90,120 close-packed structure gray silver 7.51 X 49785
Ba-Bi-Sn Ba3Sn3.16 Bi1.84 Tl4PbTe3,tI32,140 I4/mcm 0.9248,0.9248,1.3323,90,90,90 - gray dark 6.83 X 49581
Ba-Bi-Sn Ba4Sn10.28 Bi1.72 Ba4Sn9(Sn0.43 Bi0.57 )3,hP32,194 P63 /mmc 0.7271,0.7271,2.2165,90,90,120 close-packed structure gray silver 6.97 X 49785
Ba-Bi-Sn Ba5Sn11.35 Bi3.65 Ba5Sn9(Sn0.39 Bi0.61 )6,hP40,194 P63 /mmc 0.7274,0.7274,2.7943,90,90,120 close-packed structure gray silver 7.25 X 49785
Ba-Bi-Sr Ba0.45 Sr1.55 Bi3 Sr2Bi3,oP20,52 Pnna 1.5745,0.6829,0.6647,90,90,90 - - 7.66 X 50423
Ba-Bi-Te BaBiTe3 BaBiSe3,oP40,19 P212121 0.4626,1.707,1.832,90,90,90 - black 6.70 X 33081
Ba-Bi-Zn BaZnBi2 SrZnBi2,tI16,139 I4/mmm 0.4846,0.4846,2.198,90,90,90 - - 7.99 X 14270
Ba-Bi-Zn Ba2ZnBi2 K2ZnO2,oI20,72 Ibam 0.728,1.4325,0.7089,90,90,90 - black 6.81 X 54346
Ba-Br-Cl BaBr1.333 Cl0.667 PbCl2,oP12,62 Pnma 0.82031,0.48606,0.96359,90,90,90 - - 4.62 X 18835
Ba-Br-Cs CsBa2Br5 U2PbSe5,mP32,14 P121/c1 0.9987,0.8665,1.3816,90,90.2,90 - colorless 4.48 X 32526
Ba-Br-Cs Cs2BaBr4 *,tP28,* - 1.15447,1.15447,0.91023,90,90,90 - - 3.96 N 45871
Ba-Br-F BaBrF rt PbClF,tP6,129 P4/nmm 0.4508,0.4508,0.7441,90,90,90 - - 5.19 X 10420
Ba-Br-Fe BaFe2Br8 BaFe2Br8,oP88,61 Pbca 1.1093,2.1764,1.3054,90,90,90 - red dark 3.74 X 38157
Ba-Br-H BaBrH PbClF,tP6,129 P4/nmm 0.4532,0.4532,0.739,90,90,90 - colorless 4.78 X 16679
Ba-Br-H Ba2BrH3 Li3LaSb2,hP6,164 P-3m1 0.44492,0.44492,0.75448,90,90,120 - blue 4.59 X 49754
Ba-Br-I BaIBr BiSCl,oP12,62 Pnma 0.86,0.512,1.031,90,90,90 - - 5.04 A 3984
Ba-Br-La Ba11La4Br34 Ba9(Ba0.5 La0.5 )4La2Br34,tI106,87 I4/m 1.1909,1.1909,2.2888,90,90,90 - colorless 4.89 X 55714
Ba-Br-La Ba9La5Br33 (Sr0.64 Nd0.36)14Cl33,hR180,148 R-3 1.4098,1.4098,2.6678,90,90,120 - - 4.96 A 22371
Ba-Br-Nd Ba9Nd5Br33 (Sr0.64 Nd0.36)14Cl33,hR180,148 R-3 1.4039,1.4039,2.6477,90,90,120 - - 5.06 A 22371
Ba-Br-O Ba[BrO3]2 ht Sr[ClO3]2,oF72,43 Fdd2 1.2071,1.3488,0.7873,90,90,90 - - 4.07 X 23058
Ba-Br-O Ba[BrO3]2 rt Ba[IO3]2,mS36,15 C12/c1 1.23831,0.7902,0.858,90,129.534,90 - - 4.03 X 24322
Ba-Br-O Ba2Br2O K2ZnO2,oI20,72 Ibam 0.7244,1.2978,0.6574,90,90,90 - colorless 4.84 X 57488
Ba-Br-O Ba4Br6O Ba4Cl6O,hP22,186 P63 mc 1.0301,1.0301,0.78592,90,90,120 - colorless 4.80 X 51644
Ba-Br-P Ba2PBr NaFeO2,hR12,166 R-3m 0.4678,0.4678,2.338,90,90,120 rocksalt family brown red 4.33 A 11060
Ba-Br-P Ba4P 2.535 Br0.398 Th3P 4,cI28,220 I-43d 0.98,0.98,0.98,90,90,90 - black gray 4.66 X 11060
Handbook of Inorganic Substances – Edition 2015 : Data 305

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Br-Rb RbBa2Br5 U2PbSe5,mP32,14 P121/c1 0.98102,0.85839,1.37115,90,90.119,90 - - 4.37 A 32489


Ba-Br-Si Ba4Si3Br2 Ba4Si3Br2,mP36,14 P121/c1 1.5041,0.8845,0.8802,90,101.93,90 - black 4.60 X 38518
Ba-Br-Sr Ba0.05 Sr0.95 Br2 SrBr2,tP30,85 P4/n 1.1623,1.1623,0.7141,90,90,90 - - 4.30 A 3984
Ba-Br-Sr Ba0.35 Sr0.65 Br2 PbCl2,oP12,62 Pnma 0.8088,0.4848,0.9644,90,90,90 - - 4.65 A 3984
Ba-Br-Tc BaTcBr6 *,oP16,59 Pmmn 0.741,1.042,0.748,90,90,90 - - - N 20671
Ba-Br-Th BaThBr6 BaThBr6,oP16,51 Pmma 0.9992,0.449,1.2526,90,90,90 - - 5.02 X 31057
Ba-C-Ge Ba3Ge 4C2 Ba3Ge4C2,tI44,140 I4/mcm 0.884,0.884,1.2466,90,90,90 - gray dark 4.95 X 32576
Ba-C-K K3Ba3[C60] K3Ba3[C60],cI144,204 Im-3 1.12166,1.12166,1.12166,90,90,90 fullerene family - 2.94 X 37052
Ba-C-N Ba[NCN] Ba[NCN],hR72,167 R-3c 1.5282,1.5282,0.7013,90,90,120 - colorless 3.74 X 28779
Ba-C-N Ba[NC2N2]2 Ba[NC2N2]2,oP44,62 Pnma 1.36868,0.42907,1.22626,90,90,90 - white 2.49 X 39107
Ba-C-N Ba2[NCN][CN]2 Ba2[NCN][CN]2,hP50,194 P63/mmc 1.0634,1.0634,0.6989,90,90,120 - colorless 3.56 X 31074
Ba-C-O Ba[CO3] hp Ba[CO3],hP10,194 P63/mmc 0.5258,0.5258,0.564,90,90,120 - - 4.85 X 37923
Ba-C-O Ba[CO3] ht1 K[NO3],hR15,160 R3m 0.52212,0.52212,1.04921,90,90,120 - - 3.97 X 49248
Ba-C-O Ba[CO3] ht2 Rb[NO3],cF184,225 Fm-3m 0.696,0.696,0.696,90,90,90 - - 3.89 X 8698
Ba-C-O Ba[CO3] rt Ca[CO3]-a,oP20,62 Pnma 0.64353,0.53193,0.89056,90,90,90 witherite colorless 4.30 X 57748
Ba-C-O Ba[C2O4] Ba[C2O4],aP28,2 P-1 0.5127,0.8905,0.9068,82.74,80.54,79.9 - - 3.74 X 57322
Ba-C-O Ba[C4O4] rt Ba[C4O4],tI36,140 I4/mcm 0.63595,0.63595,1.24077,90,90,90 - colorless 3.30 X 42373
Ba-C-S BaCS3 *,hP30,168 P6 0.6527,0.6527,1.993,90,90,120 - yellow - N 3959
Ba-C-Si Ba3Si4C2 Ba3Ge4C2,tI52,140 I4/mcm 0.87693,0.87693,1.23885,90,90,90 - black 3.82 X 52550
Ba-Ca-F Ba0.03 Ca0.97 F2 CaF2 ,cF12,225 Fm-3m 0.5473,0.5473,0.5473,90,90,90 fluorite family - 3.28 X 44535
Ba-Ca-F Ba0.96 Ca0.04 F2 CaF2 ,cF12,225 Fm-3m 0.617,0.617,0.617,90,90,90 fluorite family - 4.85 X 44535
Ba-Ca-Ge BaCaGe TiNiSi,oP12,62 Pnma 0.854,0.51,0.921,90,90,90 AlB2 family - 4.14 X 9488
Ba-Ca-Ge Ba2.82 Ca0.18 Ge4 Ba3Ge4,oS56,65 Cmmm 1.1802,1.2147,1.1966,90,90,90 - black 5.30 X 36743
Ba-Ca-Li Li33.3 Ba13.1 Ca3 Li33.3 Ba13.1 Ca3,hR888,167 R-3c 1.99127,1.99127,9.0213,90,90,120 - - 2.07 X 49067
Ba-Ca-Pb BaCaPb TiNiSi,oP12,62 Pnma 0.885,0.532,1.001,90,90,90 AlB2 family - 5.42 A 9488
Ba-Ca-Pb Ba0.97 Ca0.03Pb3 Mg3 In,hR48,166 R-3m 0.726,0.726,3.443,90,90,120 close-packed structure - 9.59 X 51634
Ba-Ca-Si BaCaSi TiNiSi,oP12,62 Pnma 0.839,0.495,0.916,90,90,90 AlB2 family - 3.59 X 9488
Ba-Ca-Sn BaCaSn TiNiSi,oP12,62 Pnma 0.883,0.531,0.969,90,90,90 AlB2 family - 4.33 X 9488
Ba-Ca-Sn BaCaSn3 BaYbSn3,oS80,64 Cmce 1.5912,0.9497,1.7184,90,90,90 - - 5.46 X 48428
Ba-Cd-F BaCd2F6 ht *,oS72,20 C222 1 0.723,1.24,1.204,90,90,90 - - 5.86 N 6250
Ba-Cd-F BaCd2F6 rt *,o*144,* - 1.077,1.14,1.731,90,90,90 - - 5.95 N 6250
Ba-Cd-Ga BaCd3.2 Ga0.8 CeAl2Ga2,tI10,139 I4/mmm 0.476,0.476,1.15,90,90,90 - gray silver 7.05 X 26928
Ba-Cd-Ge BaCdGe BeZrSi,hP6,194 P63/mmc 0.4701,0.4701,0.9402,90,90,120 AlB2 family - 5.95 X 24876
Ba-Cd-Ge BaCd2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.46735,0.46735,1.1448,90,90,90 - - 6.74 X 55025
Ba-Cd-Ge Ba4CdGe22 Ba4Cd1.21 Ge20.54 ,cP78,223 Pm-3n 1.07571,1.07571,1.07571,90,90,90 - - 6.03 X 48741
Ba-Cd-Ge Ba4Cd4Ge19 Ba4Al3(Al0.25 Ge0.75)20 ,cP54,223 Pm-3n 1.096,1.096,1.096,90,90,90 - gray silver 6.00 X 31014
Ba-Cd-Ge Ba4Cd4Ge19 Na4Si23,cP54,223 Pm-3n 1.09539,1.09539,1.09539,90,90,90 clathrate - 6.01 X 48741
Ba-Cd-Hg Ba20 Cd4Hg99 Ba20 Cd4Hg99,cF492,216 F-43m 2.33157,2.33157,2.33157,90,90,90 - gray silver 12.08 X 59576
Ba-Cd-Hg Ba3CdHg10 La3Al11,oI28,71 Immm 0.5115,0.99154,1.49926,90,90,90 - - 11.05 X 59760
Ba-Cd-O BaCdO2 BaCdO2,oP16,62 Pnma 0.6168,0.366,1.195,90,90,90 - yellow 6.94 X 1769
Ba-Cd-O Ba0.96 Cd0.04 O NaCl,cF8,225 Fm-3m 0.535,0.535,0.535,90,90,90 rocksalt family - 6.61 X 22813
Ba-Cd-P BaCd2P 2 Ce2SO2,hP5,164 P-3m1 0.4402,0.4402,0.7557,90,90,120 - - 5.55 X 17679
Ba-Cd-Pb BaCdPb KHg2,oI12,74 Imma 0.5186,0.8497,0.8798,90,90,90 AlB2 family - 7.83 X 24876
Ba-Cd-S BaCdS2 BaCdO2,oP16,62 Pnma 0.72781,0.4167,1.39189,90,90,90 - yellow 4.94 X 8399
Ba-Cd-S Ba2CdS3 K2AgI3,oP24,62 Pnma 0.89145,0.43356,1.72439,90,90,90 - green olive 4.82 X 8399
Ba-Cd-Sb BaCdSb2 SrZnBi2,tI16,139 I4/mmm 0.4558,0.4558,2.416,90,90,90 - - 6.53 X 14270
Ba-Cd-Sb BaCd2Sb2 Ce2SO2,hP5,164 P-3m1 0.477,0.477,0.808,90,90,120 - gray 6.32 X 12909
Ba-Cd-Sb Ba11 Cd6Sb12 Sr11Cd6Sb12,mS58,12 C12/m1 3.4082,0.48915,1.3172,90,109.638,90 - - 5.86 X 50700
Ba-Cd-Sb Ba2Cd2Sb3 Ba2Cd2As3,mS28,12 C12/m1 1.8072,0.4824,1.3403,90,126.747,90 - black 6.13 X 54074
Ba-Cd-Sb Ba21 Cd4Sb18 Ba21 Cd4Sb18,oS344,64 Cmce 1.8191,1.9103,3.7062,90,90,90 - - 5.70 X 50402
Ba-Cd-Sb Ba3Cd2Sb4 (Ba0.98 Ca0.02)3Cd2Sb4,mS18,12 C12/m1 1.7835,0.48675,0.76837,90,112.214,90 - black 6.04 X 50392
Ba-Cd-Se Ba2CdSe 3 K2AgI3,oP24,62 Pnma 0.92247,0.44823,1.78706,90,90,90 - brown 5.61 X 8399
Ba-Cd-Si Ba4Cd3.5 Si19.5 Ba4Al3(Al0.25 Ge0.75)20 ,cP54,223 Pm-3n 1.05866,1.05866,1.05866,90,90,90 - - 4.17 X 52637
Ba-Cd-Sn BaCdSn KHg2,oI12,74 Imma 0.5122,0.8477,0.8594,90,90,90 AlB2 family - 6.56 X 24876
Ba-Cd-Te Ba2CdTe 3 K2AgI3,oP24,62 Pnma 0.98405,0.47502,1.91008,90,90,90 - red 5.73 X 57651
Ba-Ce-F Ba0.10Ce0.90 F2.90 HoH3,hP24,165 P-3c1 0.718,0.718,0.734,90,90,120 - - 5.93 A 10184
Ba-Ce-F Ba0.5 Ce0.5F2.5 (Ba0.5 Ce0.5 )F2.5,cF64,225 Fm-3m 0.6033,0.6033,0.6033,90,90,90 - - 5.63 X 22916
Ba-Ce-F Ba0.5 Ce0.5 F3 *,hP24,194 P63/mmc 0.734,0.734,0.743,90,90,120 - white - N 3979
Ba-Ce-I BaCeI4 SrLaI4,mS24,15 C12/c1 1.02827,1.498,0.7352,90,121.916,90 - black 5.42 X 43984
Ba-Ce-N BaCeN2 Ta(Ta0.5 Mn0.5)N2,hP8,194 P63/mmc 0.36506,0.36506,1.26603,90,90,120 - - 6.94 X 29694
Ba-Ce-O BaCeO3 hp2 GdFeO3,oP20,62 Pnma 0.62155,0.87766,0.62349,90,90,90 perovskite family white 6.36 X 52587
Ba-Ce-O BaCeO3 ht1 Ba(Pb0.5 Bi0.5 )O3,oI20,74 Imma 0.62334,0.87953,0.62622,90,90,90 - - 6.30 X 29473
Ba-Ce-O BaCeO3 ht2 LaAlO3,hR30,167 R-3c 0.62604,0.62604,1.52721,90,90,120 perovskite family - 6.26 X 29473
Ba-Ce-O BaCeO3 ht3 CaTiO3,cP5,221 Pm-3m 0.44447,0.44447,0.44447,90,90,90 perovskite family - 6.15 X 29473
Ba-Ce-O BaCe 2O4 CaV2O4,oP28,62 Pnma 1.0641,0.3676,1.2584,90,90,90 - colorless 6.50 A 7413
Ba-Ce-S BaCe 2S4 Th3P 4,cI28,220 I-43d 0.8864,0.8864,0.8864,90,90,90 - - 5.21 A 45099
Ba-Ce-Se BaCe 2Se4 Th3P 4,cI28,220 I-43d 0.9186,0.9186,0.9186,90,90,90 - - 6.28 A 2169
Ba-Cl-Co Ba2CoCl6 Ba2CoCl6,mP36,14 P121/c1 0.9141,0.8114,1.56979,90,125.393,90 - blue 3.82 X 38185
Ba-Cl-Dy Ba2DyCl7 Ba2ErCl7,mP40,14 P121/c1 0.6801,1.554,1.0517,90,90.56,90 - - 4.10 A 31501
Ba-Cl-Er Ba2ErCl7 Ba2ErCl7,mP40,14 P121/c1 0.6794,1.5525,1.0496,90,90.54,90 - pink 4.14 X 31501
Ba-Cl-Eu BaEuCl5 BaGdCl5,mS28,15 C12/c1 0.5538,1.9343,0.689,90,93.38,90 - - 4.21 A 34235
Ba-Cl-Eu Ba0.5 Eu0.5 Cl2 ht CaF2 ,cF12,225 Fm-3m 0.7171,0.7171,0.7171,90,90,90 fluorite family - 3.88 X 9990
Ba-Cl-Eu Ba0.7 Eu0.3 Cl2 rt PbCl2,oP12,62 Pnma 0.7768,0.4663,0.929,90,90,90 - - 4.20 A 9990
Ba-Cl-Eu Ba2EuCl7 Ba2ErCl7,mP40,14 P121/c1 0.68164,1.559,1.0543,90,90.67,90 - yellow 4.00 X 35339
Ba-Cl-Eu Ba8Eu7Cl34 *,tI98,87 I4/m 1.1215,1.1215,2.1492,90,90,90 - blue 4.14 N 33890
Ba-Cl-F BaClF PbClF,tP6,129 P4/nmm 0.4392,0.4392,0.7224,90,90,90 zhangpeishanite - 4.57 X 17548
Ba-Cl-F Ba12 Cl5F19 Ho5Ni19P 12,hP36,189 P-62m 1.40848,1.40848,0.42733,90,90,120 - - 4.94 X 32450
Ba-Cl-F Ba7Cl2F12 ht hex1 Ba7Cl2F12,hP24,174 P-6 1.06237,1.06237,0.41722,90,90,120 - - 5.13 X 46268
306 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Cl-F Ba7Cl2F12 ht hex2 Ba7Cl2F12 ,hP87,174 P-6 2.13281,2.13281,0.41993,90,90,120 - colorless 5.06 X 45927
Ba-Cl-F Ba7Cl2F12 rt Ba7Cl2F12 ,hP28,176 P63 /m 1.05955,1.05955,0.4201,90,90,120 - - 5.12 X 36664
Ba-Cl-Gd BaGdCl5 BaGdCl5,mS28,15 C12/c1 0.5521,1.9257,0.6874,90,93.25,90 - colorless 4.30 X 35190
Ba-Cl-Gd Ba2GdCl7 Ba2ErCl7,mP40,14 P121/c1 0.6826,1.5584,1.0557,90,90.67,90 - colorless 4.02 X 31501
Ba-Cl-H BaClH PbClF,tP6,129 P4/nmm 0.4394,0.4394,0.7238,90,90,90 - black 4.13 X 16679
Ba-Cl-H Ba2ClH3 Li3LaSb2,hP6,164 P-3m1 0.443,0.443,0.723,90,90,120 - orange 4.23 X 49754
Ba-Cl-Ho Ba2HoCl7 Ba2ErCl7,mP40,14 P121/c1 0.6796,1.5521,1.0491,90,90.54,90 - - 4.13 A 31501
Ba-Cl-K K2BaCl4 ht Th3P 4,cI28,220 I-43d 0.935,0.935,0.935,90,90,90 - - 2.90 A 16545
Ba-Cl-La Ba2LaCl7 *,hP*,* - 1.7637,1.7637,1.2495,90,90,120 - - - N 22371
Ba-Cl-Lu Ba2LuCl7 Ba2ErCl7,mP40,14 P121/c1 0.6758,1.5469,1.0462,90,90.38,90 - - 4.24 A 34235
Ba-Cl-Mo BaMo6Cl14 HgMo6Cl14 ,cP84,201 Pn-3 1.306,1.306,1.306,90,90,90 Chevrel phase - 3.61 A 19381
Ba-Cl-N Ba[N3]Cl Ba[N3]Cl,mP10,11 P121/m1 0.55746,0.45207,0.78081,90,101.835,90 - colorless 3.70 X 51525
Ba-Cl-N Ba2NCl NaFeO2,hR12,166 R-3m 0.41023,0.41023,2.26079,90,90,120 rocksalt family - 4.90 X 56403
Ba-Cl-O Ba[ClO3]2 Sr[ClO3]2,oF72,43 Fdd2 1.1774,1.3273,0.77184,90,90,90 - - 3.35 X 23058
Ba-Cl-O Ba4Cl6O Ba4Cl6O,hP22,186 P63 mc 0.997,0.997,0.749,90,90,120 - white 4.01 X 4984
Ba-Cl-P Ba2PCl NaFeO2,hR12,166 R-3m 0.4631,0.4631,2.271,90,90,120 rocksalt family brown dark 4.03 X 11060
Ba-Cl-P Ba2P 7Cl Ba2P 7Cl,mP20,11 P121/m1 0.6337,0.6829,1.1726,90,95.27,90 - red ruby 3.46 X 14721
Ba-Cl-P Ba4P 2.513 Cl0.465 Th3P 4,cI28,220 I-43d 0.9762,0.9762,0.9762,90,90,90 - black gray 4.60 A 11060
Ba-Cl-Pd BaPdCl4 BaPdCl4,oP24,60 Pbcn 0.6867,1.2588,0.7502,90,90,90 - orange 3.95 X 40838
Ba-Cl-Sc Ba2ScCl7 Ba2ScCl7,mP40,4 P1211 0.68888,1.34942,1.20735,90,94.93,90 - colorless 3.37 X 35205
Ba-Cl-Sm Ba17Sm10Cl64 Ba17Sm10Cl64,cP364,205 Pa-3 2.1366,2.1366,2.1366,90,90,90 - yellow 4.16 X 36231
Ba-Cl-Sr Ba0.20 Sr0.80 Cl2 CaF2,cF12,225 Fm-3m 0.7041,0.7041,0.7041,90,90,90 fluorite family - 3.21 X 1025
Ba-Cl-Sr Ba0.47 Sr0.53 Cl2 PbCl2,oP12,62 Pnma 0.772,0.466,0.918,90,90,90 - - 3.66 A 3984
Ba-Cl-Tb BaTbCl5 BaGdCl5,mS28,15 C12/c1 0.5511,1.9153,0.6844,90,93.11,90 - - 4.36 A 34235
Ba-Cl-Tb Ba2TbCl7 Ba2ErCl7,mP40,14 P121/c1 0.681,1.5553,1.0536,90,90.61,90 - - 4.06 A 31501
Ba-Cl-Tc BaTcCl6 *,oP16,59 Pmmn 0.703,1.007,0.706,90,90,90 - golden - N 20663
Ba-Cl-Tm Ba2TmCl7 Ba2ErCl7,mP40,14 P121/c1 0.6779,1.5501,1.0483,90,90.43,90 - - 4.17 A 31501
Ba-Cl-U Ba2UCl7 *,mP*,14 P121/c1 0.72,1.561,1.066,90,91.1,90 - black - N 34533
Ba-Cl-Y Ba2YCl7 Ba2ErCl7,mP40,14 P121/c1 0.6794,1.5528,1.05,90,90.49,90 - - 3.67 A 31501
Ba-Cl-Yb Ba2YbCl7 Ba2ErCl7,mP40,14 P121/c1 0.6764,1.5484,1.0465,90,90.41,90 - - 4.22 A 31501
Ba-Cl-Zn BaZnCl4 orth1 KTlBr4,oP24,52 Pnna 0.72415,0.98628,0.94771,90,90,90 - colorless 3.38 X 36651
Ba-Cl-Zn BaZnCl4 orth2 Bi[VO4],oP24,60 Pbcn 0.65041,1.5363,0.6819,90,90,90 - colorless 3.36 X 39216
Ba-Co-F BaCoF4 ht BaZnF4,oS24,36 Cmc21 0.42102,1.4628,0.58519,90,90,90 - red dark 5.02 X 5346
Ba-Co-F BaCoF5 *,oP*,* - 0.4965,0.56201,1.3922,90,90,90 - blue light - N 15652
Ba-Co-F Ba2CoF6 hp [NH4]2SiF6,hP9,164 P-3m1 0.5841,0.5841,0.4471,90,90,120 - - 5.63 A 8434
Ba-Co-F Ba2CoF6 NbBi2O4(O0.5 F0.5)2,tI18,139 I4/mmm 0.4101,0.4101,1.6284,90,90,90 - - 5.43 X 3759
Ba-Co-F Ba3Co2F12 *,tI68,87 I4/m 1.463,1.463,0.763,90,90,90 - brown - N 5827
Ba-Co-Ge BaCo2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.40859,0.40859,1.1779,90,90,90 - - 6.76 X 55501
Ba-Co-Ge BaCo4.7 Ge 9 BaCo4.7 Ge9,oP60,62 Pnma 1.3992,0.4022,1.6993,90,90,90 - - 7.42 X 52222
Ba-Co-Ge Ba4Co1.3 Ge20.2 Na4Si23,cP54,223 Pm-3n 1.06785,1.06785,1.06785,90,90,90 clathrate - 5.71 A 52233
Ba-Co-Ge Ba6Co1.1 Ge23.9 K6Sn25,cP124,213 P4132 1.45482,1.45482,1.45482,90,90,90 clathrate - 5.66 A 52233
Ba-Co-N BaCoN BaCoN,oP60,62 Pnma 0.9599,2.351,0.5476,90,90,90 - black 5.65 X 29531
Ba-Co-O BaCoO2 BaZnO2,hP12,152 P3121 0.585,0.585,0.673,90,90,120 - black 5.70 A 6557
Ba-Co-O BaCoO3 cub CaTiO3,cP5,221 Pm-3m 0.414,0.414,0.414,90,90,90 perovskite family - 5.72 X 22938
Ba-Co-O BaCoO3 hex BaNiO3,hP10,194 P63 /mmc 0.56525,0.56525,0.47629,90,90,120 perovskite family - 6.16 X 47372
Ba-Co-O Ba12Co11O33 Ba12Co11O33-a,mS224,15 C12/c1 1.14128,1.97677,1.47461,90,112.766,90 perovskite family - 6.12 X 39942
Ba-Co-O Ba2CoO4 mon Ca2[SiO4],mP28,14 P121/c1 0.59176,0.76192,1.1837,90,118.588,90 - purple dark 5.64 X 47329
Ba-Co-O Ba2CoO4 orth K2[SO4],oP28,62 Pnma 0.765,0.585,1.0337,90,90,90 - - 5.71 X 6336
Ba-Co-O Ba2Co2O4.12 Ca2(Fe0.5 Al0.5)2O5,oI36,46 Ima2 1.639,0.588,0.577,90,90,90 - - 5.48 A 6557
Ba-Co-O Ba2Co9O14 Ba2Co9O14 ,hR75,166 R-3m 0.56963,0.56963,2.8924,90,90,120 - black 6.31 X 48186
Ba-Co-O Ba3CoO5 Cs3CoCl5,tI36,140 I4/mcm 0.7303,0.7303,1.1639,90,90,90 - - 5.90 A 2847
Ba-Co-O Ba3Co10O17 Ba3Co10O17,hR90,166 R-3m 0.56901,0.56901,3.5937,90,90,120 - - 6.30 X 46510
Ba-Co-O Ba5Co5O14 Ba5V5O14,hP24,164 P-3m1 0.5657,0.5657,1.19223,90,90,120 - - 6.06 X 45460
Ba-Co-O Ba6Co6O15.6 Ba6Co6O15.6 ,hP58,194 P63 /mmc 0.5671,0.5671,2.8545,90,90,120 perovskite family - 5.96 X 13504
Ba-Co-O Ba8Co7O21 Ba8Co7O21 ,oF288,43 Fdd2 1.148,1.746,1.989,90,90,90 - - 6.16 X 37638
Ba-Co-O Ba9Co8O24 Ba9Rh8O24 ,hR246,167 R-3c 0.99,0.99,3.96,90,90,120 - - 6.20 A 36135
Ba-Co-S BaCoS2 ht BaCoS2,oS16,67 Cmme 0.64413,0.64926,0.89406,90,90,90 - black 4.63 X 29181
Ba-Co-S BaCoS2 rt mon BaCoS2,mP8,13 P12/c1 0.457,0.8937,0.64408,90,134.766,90 - black 4.63 X 28399
Ba-Co-S BaCoS2 rt tet BaNiS2,tP8,129 P4/nmm 0.4568,0.4568,0.8942,90,90,90 - black 4.63 X 32133
Ba-Co-S Ba2CoS3 K2CuCl3,oP24,62 Pnma 1.1994,0.4201,1.2472,90,90,90 - - 4.54 X 49043
Ba-Co-S Ba6Co25S27 Ba6Co25S27 ,cP58,221 Pm-3m 1.0033,1.0033,1.0033,90,90,90 - - 5.20 X 25968
Ba-Co-Sb Ba0.35 Co4Sb12 LaFe4P 12,cI34,204 Im-3 0.908,0.908,0.908,90,90,90 - - 7.74 A 38117
Ba-Co-Sn BaCo2Sn8 BaCo2Sn8 ,oS88,66 Cccm 1.0328,1.5168,1.4051,90,90,90 - - 7.27 X 59756
Ba-Cr-F BaCrF4 *,tI126,140 I4/mcm 1.4595,1.4595,0.7665,90,90,90 - - - N 5786
Ba-Cr-F BaCrF5 BaGaF5,oP28,19 P212121 0.4947,0.5711,1.3938,90,90,90 - green grass 4.80 X 15765
Ba-Cr-F BaCrF6 BaSiF6,hR24,166 R-3m 0.7328,0.7328,0.7137,90,90,120 - yellow 4.55 X 7049
Ba-Cr-F Ba2CrF6 Ba2CuF6,oS36,64 Cmce 1.61,0.6139,0.5868,90,90,90 - blue gray 5.05 A 23008
Ba-Cr-F Ba3Cr4F21 *,oP29,47 Pmmm 0.4949,0.5724,1.3949,90,90,90 - - - N 4523
Ba-Cr-F Ba5Cr3F18 Ba5Cr3F18 ,tI416,88 I41/a 2.0611,2.0611,1.5382,90,90,90 - - 4.82 X 23008
Ba-Cr-N Ba3CrN3 Ba3FeN3,hP14,176 P63 /m 0.8201,0.8201,0.5497,90,90,120 - green 5.25 X 31818
Ba-Cr-N Ba5CrN5 Ba5CrN5,mS44,12 C12/m1 1.054,1.1709,0.9377,90,110.79,90 - black 4.96 X 31086
Ba-Cr-O BaCrO3 hex1 BaMnO3,hP20,194 P63 /mmc 0.566,0.566,0.9357,90,90,120 perovskite family black 6.07 X 15362
Ba-Cr-O BaCrO3 hex2 BaTiO3,hP30,194 P63 /mmc 0.5629,0.5629,1.3698,90,90,120 perovskite family - 6.29 X 16291
Ba-Cr-O BaCrO3 hex3 BaCrO3,hP70,194 P63 /mmc 0.565,0.565,3.2467,90,90,120 perovskite family black 6.15 X 14985
Ba-Cr-O BaCrO3 rhom BaCrO3,hR144,166 R-3m 0.5652,0.5652,6.275,90,90,120 perovskite family black 6.13 X 13489
Ba-Cr-O BaCr10O15 BaV10O15,oS104,64 Cmce 1.1491,1.0126,0.9392,90,90,90 - black 5.45 X 22981
Ba-Cr-O BaCr2O4 SrCr2O4,oP28,59 Pmmn 0.5921,1.2286,0.5146,90,90,90 - green 5.42 X 21958
Ba-Cr-O Ba[CrO4] Ba[SO4],oP24,62 Pnma 0.9113,0.5528,0.7336,90,90,90 hashemite - 4.55 X 18919
Handbook of Inorganic Substances – Edition 2015 : Data 307

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Cr-O Ba[Cr2O7] Ba[Cr2O7],mS160,15 C12/c1 1.631,1.667,0.9474,90,95.53,90 - - 3.66 X 12166


Ba-Cr-O Ba2Cr6.5 O14 Ba2Cr6.5 O14,hR69,166 R-3m 0.5652,0.5652,2.777,90,90,120 - black 5.43 X 6380
Ba-Cr-O Ba2[CrO4] K2[SO4],oP28,62 Pnma 0.7626,0.5913,1.0457,90,90,90 - green dark 5.50 X 27746
Ba-Cr-O Ba3CrO5 Cs3CoCl5,tI36,140 I4/mcm 0.7308,0.7308,1.1669,90,90,90 - blue faint 5.80 X 27746
Ba-Cr-O Ba3Cr2O8 Ba3[PO4]2,hR39,166 R-3m 0.57416,0.57416,2.1383,90,90,120 - - 5.26 X 50764
Ba-Cr-O Ba3[CrO4]2 Ba3[PO4]2,hR39,166 R-3m 0.5745,0.5745,2.13883,90,90,120 - blue dark 5.25 X 47941
Ba-Cr-S BaCrS2 BaCrS2,oP8,59 Pmmn 0.42606,0.47944,0.94429,90,90,90 - gray 4.36 X 35727
Ba-Cr-S BaCr4S7 BaCr4S7,mP48,14 P121/c1 0.6739,2.2665,0.5907,90,90.1,90 - black green 4.19 X 48103
Ba-Cr-S Ba0.51 Cr5S8 Tl0.83 V5S8,mS28,12 C12/m1 1.775,0.3416,0.8554,90,104.72,90 - - 3.88 X 31005
Ba-Cr-S Ba0.705 Cr2S3.705 rt *,hP*,* - 2.199,2.199,0.3433,90,90,120 - black - N 10792
Ba-Cr-S Ba2Cr5S10 Ba2Cr5S10,aP36,2 P-1 0.594,0.6645,1.739,95.19,91.67,90.16 - black green 4.16 X 48103
Ba-Cr-S Ba3CrS5 Ba3CrS5,hP18,185 P63cm 0.91208,0.91208,0.6193,90,90,120 - black 4.65 X 42007
Ba-Cr-S Ba3Cr2S6 Ca3Co 2O6,hR66,167 R-3c 1.18179,1.18179,1.2796,90,90,120 - black 4.56 X 42007
Ba-Cr-Se Ba0.712 Cr2Se3.712 *,hP*,* - 2.293,2.293,0.362,90,90,120 - black - N 10792
Ba-Cs-I CsBa2I5 U2PbSe5,mP32,14 P121/c1 1.06166,0.93041,1.46998,90,90.208,90 - - 4.77 A 32489
Ba-Cs-N CsBa2[N3]5 CsBa2[N3]5,oP72,62 Pnma 1.2928,1.0966,0.8858,90,90,90 - colorless 3.27 X 15712
Ba-Cu-D Ba7Cu3D17 Ba7Cu3H17,hP54,159 P31c 1.17633,1.17633,0.74495,90,90,120 - - 4.41 X 31807
Ba-Cu-F BaCuF4 BaZnF4,oS24,36 Cmc21 0.4476,1.3972,0.5551,90,90,90 - colorless 5.30 X 5771
Ba-Cu-F Ba2CuF6 Ba2CuF6,oS36,64 Cmce 1.5852,0.5937,0.5837,90,90,90 - blue 5.47 X 7816
Ba-Cu-F Ba2Cu5F14 Ba2Cu5F14,mS84,15 C12/c1 1.817,0.6652,1.0328,90,117.1,90 - - 5.13 X 19559
Ba-Cu-F Ba6Cu11F34 Ba6Cu11F34,aP51,2 P-1 0.749,1.0031,1.0271,82.98,73.88,70.42 - - 5.16 X 19254
Ba-Cu-Ga BaCu2Ga SrCu2Ga,hR12,166 R-3m 0.4318,0.4318,1.6915,90,90,120 - - 6.09 A 21348
Ba-Cu-Ga BaCu6Ga7 NaZn13,cF112,226 Fm-3c 1.2026,1.2026,1.2026,90,90,90 - black 7.69 A 35768
Ba-Cu-Ge BaCu0.58 Ge1.42 AlB2 ,hP3,191 P6/mmm 0.4309,0.4309,0.4965,90,90,120 AlB2 family - 5.77 X 55025
Ba-Cu-Ge BaCu9Ge4 CeNi8(Ni0.5 Si0.5)Si4,tI56,140 I4/mcm 0.8329,0.8329,1.1896,90,90,90 - gray dark 8.05 X 59426
Ba-Cu-Ge Ba4Cu3Ge20 rt Na4Si23,cP54,223 Pm-3n 1.07492,1.07492,1.07492,90,90,90 clathrate gray 5.86 X 55297
Ba-Cu-In BaCu0.2 In3.8 BaAl4,tI10,139 I4/mmm 0.4897,0.4897,1.19866,90,90,90 - - 6.77 X 48345
Ba-Cu-In BaCu6In7 NaZn13,cF112,226 Fm-3c 1.274,1.274,1.274,90,90,90 - black 8.50 A 35768
Ba-Cu-N BaCuN BaCuN,mS36,15 C12/c1 1.4462,0.557,0.9478,90,102.96,90 - black 5.76 X 34587
Ba-Cu-N Ba8Cu6.5 N7.5 Ba8Cu6(Cu0.5 N0.5)N7 ,mP50,14 P121/c1 0.95611,0.72731,1.35225,90,93.115,90 - black 5.72 X 34587
Ba-Cu-O BaCuO2 hp *,t**,* - 0.569,0.569,1.42,90,90,90 - - - N 23920
Ba-Cu-O BaCuO2.4 hp BaCuO2.4 ,oP40,17 P222 1 0.56783,0.9827,0.95252,90,90,90 - - 5.98 X 29320
Ba-Cu-O BaCu1.5 O2.95 BaCu1.5 O2.95,oS28,63 Cmcm 0.73368,0.42359,1.13863,90,90,90 - - 5.25 X 22678
Ba-Cu-O BaCu2O2 SrCu2O2,tI20,141 I41/amd 0.5722,0.5722,1.0064,90,90,90 - - 5.98 X 7077
Ba-Cu-O BaCu3O4 BaCu3O4,oS16,65 Cmmm 0.547,1.094,0.391,90,90,90 - - 5.56 X 32216
Ba-Cu-O Ba2CuO3.02 ht2 K2NiF4,tI14,139 I4/mmm 0.39923,0.39923,1.29686,90,90,90 high-Tc family - 6.21 X 23478
Ba-Cu-O Ba2CuO3.39 ht1 Ba2CuO3.3 ,oI14,71 Immm 0.3905,0.40974,1.29467,90,90,90 - - 6.29 X 25197
Ba-Cu-O Ba2Cu2O5 *,oP*,* - 0.7415,0.8564,2.0827,90,90,90 - black - N 30532
Ba-Cu-O Ba2Cu2.89 O6 Ba2Cu2.89 O6,oP198,49 Pccm 1.3065,2.0654,1.1431,90,90,90 - - 5.37 X 36433
Ba-Cu-O Ba2Cu3O5 *,tP*,132 P42/mcm 1.6955,1.6955,1.2232,90,90,90 - - - N 28716
Ba-Cu-O Ba2Cu3O6 m *,hP*,* - 0.411,0.411,0.569,90,90,120 - - - N 23831
Ba-Cu-O Ba2Cu3O6 Ba2Cu3O6,mP44,10 P12/m1 0.848,0.733,1.2154,90,110.4,90 - - 5.27 X 23831
Ba-Cu-O Ba44 Cu45O90 Ba44 Cu45O90,cI400,229 Im-3m 1.82832,1.82832,1.82832,90,90,90 - black 5.62 X 22388
Ba-Cu-P BaCuP BeZrSi,hP6,194 P63/mmc 0.4239,0.4239,0.9006,90,90,120 AlB2 family gray 5.49 X 12867
Ba-Cu-P BaCu10P 4 BaCu10P 4,mS60,12 C12/m1 2.3288,0.3907,0.9534,90,92.26,90 - black 6.87 X 33029
Ba-Cu-P BaCu2P 4 BaCu2P 4,oF56,70 Fddd 0.5435,1.0244,1.8973,90,90,90 - black gray 4.88 X 23598
Ba-Cu-P BaCu3.8 P 2 CaCu4P 2,hR21,166 R-3m 0.4101,0.4101,2.3981,90,90,120 - - 6.29 A 36662
Ba-Cu-P BaCu6P 2 BaCu6P 2,tP9,123 P4/mmm 0.4117,0.4117,0.863,90,90,90 - - 6.59 X 30209
Ba-Cu-P BaCu8P 4 BaCu8P 4,tI26,87 I4/m 1.0192,1.0192,0.3878,90,90,90 - - 6.34 X 24199
Ba-Cu-P Ba2Cu3P 4 Ba2Cu3P 4,oI36,72 Ibam 0.9347,1.2415,0.6188,90,90,90 - gray 5.45 X 24149
Ba-Cu-P Ba4Cu8P 15 Cu8Ba4P 15,oP216,60 Pbcn 1.4117,1.0093,2.8022,90,90,90 clathrate black gray 5.07 X 31067
Ba-Cu-S BaCu2S2 lt BaCu2S2,oP20,62 Pnma 0.9273,0.4053,1.038,90,90,90 - orange red 5.59 X 36612
Ba-Cu-S BaCu2S2 rt Cu2TlSe 2,tI10,139 I4/mmm 0.39077,0.39077,1.26403,90,90,90 - black 5.65 X 36612
Ba-Cu-S BaCu4S3 ht BaCu4S3,oS32,63 Cmcm 0.40584,1.38637,1.03733,90,90,90 - black 5.55 X 6892
Ba-Cu-S BaCu4S3 rt BaCu4S3,oP32,62 Pnma 1.07686,0.40348,1.32805,90,90,90 - black 5.61 X 6892
Ba-Cu-S Ba3Cu16.95 S13.5 Ba3Cu16.95 S13.5 ,hR228,148 R-3 2.105,2.105,0.9258,90,90,120 - - 5.39 X 23875
Ba-Cu-Sb BaCuSb BeZrSi,hP6,194 P63/mmc 0.4614,0.4614,0.9412,90,90,120 AlB2 family - 6.17 X 23592
Ba-Cu-Sb BaCu2Sb2 lt BaCu2Sb2,tI30,139 I4/mmm 0.46438,0.46438,3.26,90,90,90 - - 7.20 X 59249
Ba-Cu-Sb BaCu2Sb2 orth BaCu2Sb2,oI30,71 Immm 0.46224,0.46679,3.2606,90,90,90 - - 7.19 X 59249
Ba-Cu-Sb BaCu2Sb2 rt CaBe2Ge2,tP10,129 P4/nmm 0.46536,0.46536,1.07946,90,90,90 - gray light 7.22 X 58922
Ba-Cu-Sb BaCu7.31 Sb5 BaNi9P 5,hP30,194 P63/mmc 0.70154,0.70154,1.25423,90,90,120 - gray 7.52 X 54382
Ba-Cu-Se BaCu2Se2 orth BaCu2S2,oP20,62 Pnma 0.9595,0.4208,1.0773,90,90,90 - black 6.45 X 36612
Ba-Cu-Se BaCu2Se2 tet Cu2TlSe 2,tI10,139 I4/mmm 0.404,0.404,1.31855,90,90,90 - red dark 6.52 X 36612
Ba-Cu-Si BaCu9Si4 CeNi8(Ni0.5 Si0.5)Si4,tI56,140 I4/mcm 0.8198,0.8198,1.1735,90,90,90 - gray dark 6.92 X 42309
Ba-Cu-Si Ba0.8 Cu0.33 Si1.87 AlB2 ,hP3,191 P6/mmm 0.4153,0.4153,0.5015,90,90,120 AlB2 family - 4.06 X 54715
Ba-Cu-Si Ba4Cu2Si21 Na4Si23,cP54,223 Pm-3n 1.0344,1.0344,1.0344,90,90,90 clathrate gray 3.80 X 24843
Ba-Cu-Si Ba4Cu2.37 Si20.63 Ba4Al3(Al0.25 Ge0.75)20 ,cP54,223 Pm-3n 1.03331,1.03331,1.03331,90,90,90 - - 3.85 X 54715
Ba-Cu-Sn BaCuSn2 CeNiSi2,oS16,63 Cmcm 0.479,1.9642,0.4634,90,90,90 - gray 6.68 X 15237
Ba-Cu-Sn BaCu9Sn4 CeNi8(Ni0.5 Si0.5)Si4,tI56,140 I4/mcm 0.8712,0.8712,1.2543,90,90,90 - - 8.26 X 56240
Ba-Cu-Te BaCu1.98 Te2 BaCu2S2,oP20,62 Pnma 1.01301,0.4461,1.1482,90,90,90 - black 6.64 X 50918
Ba-Cu-Te Ba2Cu3.25 Te5 Ba2Cu3.25 Te5,mS60,15 C12/c1 0.94428,0.93289,1.33028,90,101.635,90 - black 6.48 X 54365
Ba-Cu-Te Ba2Cu6.64 Te6 Ba2Cu6.64 Te6,mP30,11 P121/m1 0.68591,1.21439,0.90198,90,110.751,90 - black 6.91 X 58327
Ba-Cu-Te Ba3Cu13.65 Te12 Ba3Cu13.65 Te12,mP120,11 P121/m1 1.19091,2.1174,1.19826,90,117.071,90 - black 6.94 X 46230
Ba-Cu-Te Ba6.76 Cu2.42 Te14 Ba6.76 Cu2.42 Te14,hP60,193 P63/mcm 1.41332,1.41332,0.92108,90,90,120 - - 5.98 X 48388
Ba-D-Ga BaGa2D2 SrAl2H2,hP5,164 P-3m1 0.45286,0.45286,0.48991,90,90,120 - - 5.36 X 46562
Ba-D-Ir Ba3Ir2D12 Ba3Ir2H12,hP17,164 P-3m1 0.54761,0.54761,0.88318,90,90,120 - white 5.94 X 28794
Ba-D-Mg BaMgD4 LaNiH3.7 ,oS24,63 Cmcm 0.41992,1.37374,0.56852,90,90,90 - white 3.44 X 33195
Ba-D-Mg Ba2MgD6 [NH4]2SiF6,hP9,164 P-3m1 0.57118,0.57118,0.45043,90,90,120 - - 4.06 X 28372
308 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-D-Mg Ba2Mg3D10 Ba2Ni3F10 ,mS60,12 C12/m1 1.795,0.5856,0.7869,90,111.88,90 - - 3.18 X 28842


Ba-D-Mg Ba6Mg7D26 Ba6Mg7H26 ,oI78,71 Immm 0.58005,1.1925,1.4836,90,90,90 - white 3.39 X 33156
Ba-D-N Ba[ND] lt Ba[NH],tI6,119 I-4m2 0.4062,0.4062,0.6072,90,90,90 - yellow 5.08 X 23607
Ba-D-N Ba[ND] rt NaCl,cF8,225 Fm-3m 0.58613,0.58613,0.58613,90,90,90 rocksalt family yellow 5.06 X 23607
Ba-D-N Ba2ND NaFeO2,hR12,166 R-3m 0.4026,0.4026,2.0493,90,90,120 rocksalt family red dark 5.03 X 25915
Ba-D-O Ba[OD]2 m mon Ba[OH]2,mP60,14 P121/c1 0.70832,1.08967,1.77716,90,112.424,90 - - 4.54 X 38495
Ba-D-O Ba[OD]2 m orth Ba[OH]2,oP60,62 Pnma 1.10818,1.66025,0.71255,90,90,90 - - 4.39 X 38495
Ba-D-O Ba[OD]2 rt Ba[OH]2,mP24,14 P121/c1 0.67759,0.79101,1.10294,90,121.914,90 - - 4.59 X 38495
Ba-D-Os Ba2OsD6 K2PtCl6,cF36,225 Fm-3m 0.80357,0.80357,0.80357,90,90,90 fluorite family - 6.11 X 25073
Ba-D-Pt Ba2PtD6 Ba2CuF6,oS36,64 Cmce 1.444,0.59985,0.59985,90,90,90 - - 6.16 X 28371
Ba-D-Ru Ba2RuD6 K2PtCl6,cF36,225 Fm-3m 0.80166,0.80166,0.80166,90,90,90 fluorite family - 5.00 X 25073
Ba-Dy-F BaDy2F8 BaTm2F8,mS22,12 C12/m1 0.70185,1.0563,0.42825,90,99.79,90 - - 6.52 A 14696
Ba-Dy-F Ba0.20 Dy0.80 F2.80 HoH3,hP24,165 P-3c1 0.703,0.703,0.708,90,90,120 - - 6.93 A 10184
Ba-Dy-F Ba0.77Dy0.23 F2.23 BiF3,cF16,225 Fm-3m 0.6033,0.6033,0.6033,90,90,90 b.c.c. family - 5.61 X 7612
Ba-Dy-F Ba3.99 Dy3.01 F17.01 *,hR*,* - 2.937,2.937,4.092,90,90,120 - - - N 7612
Ba-Dy-O BaDy2O4 CaV2O4,oP28,62 Pnma 1.0419,0.34713,1.214,90,90,90 - colorless 7.96 A 46770
Ba-Dy-O Ba2Dy2O5 rt *,tP*,* - 0.43879,0.43879,1.1393,90,90,90 - gray - N 26415
Ba-Dy-O Ba3Dy4O9 ht Ba3Yb4O9 ,hR48,146 R3 0.6129,0.6129,2.5282,90,90,120 - blue light 7.30 X 27382
Ba-Dy-O Ba4Dy2O7 ht *,tI28,139 I4/mmm 0.43776,0.43776,2.8755,90,90,90 - gray - N 26415
Ba-Dy-S BaDy2S4 CaV2O4,oP28,62 Pnma 1.22001,0.40341,1.4478,90,90,90 - - 5.51 A 52663
Ba-Dy-S Ba3Dy2S6 *,oP*,59 Pmmn 1.191,1.212,1.234,90,90,90 - - - N 45099
Ba-Dy-Se BaDy2Se4 CaV2O4,oP28,62 Pnma 1.273,0.422,1.511,90,90,90 - - 6.37 A 2166
Ba-Dy-Te BaDy2 Te4 CaV2O4,oP28,62 Pnma 1.36567,0.44517,1.61465,90,90,90 - black 6.58 X 37351
Ba-Er-F BaEr2F8 BaTm2F8,mS22,12 C12/m1 0.6962,1.0486,0.42541,90,99.685,90 - - 6.77 X 43725
Ba-Er-F Ba0.625 Er0.375 F2.375 (Ba0.625 Er0.375)F2.375 ,tI34,139 I4/mmm 0.4199,0.4199,0.5986,90,90,90 fluorite family - 6.09 X 18523
Ba-Er-F Ba0.75 Er0.25 F2.25 Ba0.78 Tm0.22 F2.22 ,cF96,225 Fm-3m 0.6036,0.6036,0.6036,90,90,90 fluorite family - 5.67 X 52061
Ba-Er-F Ba4Er3F17 Ba4Y3F17,hR159,148 R-3 1.1059,1.1059,2.0346,90,90,120 - pink 6.35 X 39395
Ba-Er-O BaEr2O4 CaV2O4,oP28,62 Pnma 1.0369,0.3439,1.2076,90,90,90 - colorless 8.27 A 7413
Ba-Er-O Ba2Er2O5 rt *,t**,* - 0.43617,0.43617,1.1853,90,90,90 - pink - N 23706
Ba-Er-O Ba3Er4O9 ht Ba3Yb4O9 ,hR48,146 R3 0.6086,0.6086,2.5077,90,90,120 - red light 7.59 X 27382
Ba-Er-O Ba4Er2O7 ht *,tI28,139 I4/mmm 0.43436,0.43436,2.8742,90,90,90 - pink - N 23706
Ba-Er-S BaEr2S4 CaV2O4,oP28,62 Pnma 1.21455,0.39884,1.43837,90,90,90 - orange 5.72 X 59582
Ba-Er-S Ba3Er2S6 *,oP*,59 Pmmn 1.185,1.209,1.231,90,90,90 - - - N 45099
Ba-Er-Se BaEr2Se4 CaV2O4,oP28,62 Pnma 1.2628,0.41398,1.4953,90,90,90 - orange 6.69 X 51700
Ba-Er-Te BaEr2Te4 CaV2O4,oP28,62 Pnma 1.35677,0.44058,1.59989,90,90,90 - black 6.82 X 37351
Ba-Eu-F Ba0.10 Eu0.90 F2.90 HoH3,hP24,165 P-3c1 0.6989,0.6989,0.7148,90,90,120 - - 6.77 A 40649
Ba-Eu-F Ba0.15 Eu0.85 F2.85 Na3As,hP8,194 P63 /mmc 0.40636,0.40636,0.71819,90,90,120 - - 6.59 X 40649
Ba-Eu-F Ba0.75 Eu0.25 F2.25 (Ca0.68 Y0.32 )F2.32 ,cF92,225 Fm-3m 0.60665,0.60665,0.60665,90,90,90 fluorite family - 5.47 X 40649
Ba-Eu-F Ba4Eu3F17 Ba4Y3F17,hR159,148 R-3 1.11787,1.11787,2.05789,90,90,120 - - 5.94 X 40687
Ba-Eu-Ge Ba3.7 Eu0.3 Ge21.5 Cs4Sn22,cP78,223 Pm-3n 1.06294,1.06294,1.06294,90,90,90 - - 5.85 X 47675
Ba-Eu-Ge Ba5.4 Eu0.6 Ge25 Ba3(Ba0.8 Eu0.2 )3Ge25,cP148,213 P4132 1.45271,1.45271,1.45271,90,90,90 - - 5.74 X 42480
Ba-Eu-O BaEu2O4 CaV2O4,oP28,62 Pnma 1.0499,0.35379,1.229,90,90,90 - white 7.35 A 46770
Ba-Eu-O Ba3Eu4O9 *,hR48,166 R-3m 0.619,0.619,2.558,90,90,120 - colorless - N 7413
Ba-Eu-S Ba0.5 Eu0.5 S NaCl,cF8,225 Fm-3m 0.6187,0.6187,0.6187,90,90,90 rocksalt family - 4.96 X 5093
Ba-Eu-Si Ba2Eu3Si7 Ba2Eu3Si7 ,hP12,189 P-62m 0.92742,0.92742,0.40912,90,90,120 - gray 5.05 X 29863
Ba-F-Fe BaFeF4 rt BaZnF4,oS24,36 Cmc21 0.4236,1.4857,0.5835,90,90,90 - colorless 4.87 X 21926
Ba-F-Fe BaFeF5 mon BaFeF5,mP56,14 P121/c1 0.9532,0.7901,1.44117,90,127.866,90 - - 4.47 X 30020
Ba-F-Fe BaFeF5 tet BaFeF5,tI112,79 I4 1.4919,1.4919,0.7609,90,90,90 - green 4.52 X 5688
Ba-F-Fe BaFe2F7 BaMnFeF7,mP40,14 P121/c1 0.547,1.093,0.91,90,94.83,90 - - 4.68 A 3459
Ba-F-Fe Ba2FeF6 hp [NH4]2SiF6,hP9,164 P-3m1 0.5952,0.5952,0.4417,90,90,120 - - 5.45 A 8434
Ba-F-Fe Ba2FeF6 NbBi2O4(O0.5 F0.5)2,tI18,139 I4/mmm 0.4154,0.4154,1.6084,90,90,90 - colorless 5.32 A 3759
Ba-F-Fe Ba2Fe3F10 Ba2Fe3F10 ,mP60,14 P121/c1 0.78834,0.62295,1.86797,90,111.787,90 - colorless 4.93 X 20801
Ba-F-Fe Ba3Fe2F12 *,tI102,87 I4/m 1.454,1.454,0.762,90,90,90 - - - N 8512
Ba-F-Fe Ba4Fe5F20 *,oP58,62 Pnma 1.759,0.759,0.57,90,90,90 - - - N 3459
Ba-F-Fe Ba5Fe3F19 Ba5Fe3F19 ,tI136,87 I4/m 1.4835,1.4835,0.7667,90,90,90 - - 4.78 X 38128
Ba-F-Fe Ba7Fe7F34 Fe7Pb7F34 ,mS96,12 C12/m1 1.6986,1.1395,0.768,90,102.09,90 - - 4.57 A 24922
Ba-F-Ga BaGaF5 BaGaF5,oP28,19 P212121 0.4978,0.566,1.393,90,90,90 - colorless 5.11 X 11859
Ba-F-Ga Ba3Ga2F12 *,tI102,87 I4/m 1.4655,1.4655,0.763,90,90,90 - - - N 5103
Ba-F-Ga Ba3Ga4F21 *,oP29,47 Pmmm 0.494,0.566,1.394,90,90,90 - - - N 5103
Ba-F-Ga Ba5Ga3F19 Ba5Ga3F19 ,tI134,87 I4/m 1.466,1.466,0.7601,90,90,90 - - 5.11 X 38128
Ba-F-Gd Ba0.10 Gd0.90 F2.90 HoH3,hP24,165 P-3c1 0.703,0.703,0.712,90,90,120 - - 6.88 A 10184
Ba-F-Gd Ba0.76 Gd0.24 F2.24 ht BiF3,cF16,225 Fm-3m 0.6045,0.6045,0.6045,90,90,90 b.c.c. family - 5.55 X 7612
Ba-F-Gd Ba3.99 Gd3.01 F17.01 *,hR*,* - 2.953,2.953,4.116,90,90,120 - - - N 7612
Ba-F-Ge BaGeF6 BaSiF6,hR24,166 R-3m 0.72444,0.72444,0.72468,90,90,120 - - 4.90 X 183
Ba-F-H HBaF3 HBaF3,mP8,11 P121/m1 0.499,0.4312,0.68412,90,105.645,90 - colorless 4.58 X 15861
Ba-F-H H6BaF8 H6BaF8,hP36,190 P-62c 0.77756,0.77756,1.265,90,90,120 - colorless 2.96 X 47537
Ba-F-Hf BaHfF6 ht ZrPbF6,oS32,67 Cmme 0.756,1.137,0.547,90,90,90 - - 6.07 A 23401
Ba-F-Hf Ba0.86 Hf0.14 F2.28 *,cF*,225 Fm-3m 0.6128,0.6128,0.6128,90,90,90 - - 5.38 N 33696
Ba-F-Hf Ba2HfF8 *,tP44,* - 0.7981,0.7981,1.0425,90,90,90 - - 6.05 N 33696
Ba-F-Ho BaHo2F8 *,mS22,12 C12/m1 0.69932,1.0526,0.42696,90,99.77,90 - - - N 14696
Ba-F-Ho Ba0.9 Ho0.1 F2.1 (Th0.025Pb0.975)F2.05 ,cF60,225 Fm-3m 0.61348,0.61348,0.61348,90,90,90 fluorite family - 5.18 X 24118
Ba-F-Ho Ba3.99 Ho3.01 F17.01 *,h**,* - 2.93,2.93,4.084,90,90,120 - - - N 7612
Ba-F-I BaIF rt PbClF,tP6,129 P4/nmm 0.4654,0.4654,0.7962,90,90,90 - - 5.45 X 10420
Ba-F-In BaInF5 SrFeF5,mP56,14 P121/c1 0.7593,0.7718,1.5575,90,95.6,90 - - 5.08 A 7611
Ba-F-In Ba0.9 In0.1 F2.1 CeH3,cF44,225 Fm-3m 0.6107,0.6107,0.6107,90,90,90 fluorite family - 5.10 A 22806
Ba-F-In Ba3In2F12 rt Ba3In2F12,tP34,127 P4/mbm 0.9577,0.9577,0.5635,90,90,90 - colorless 5.59 X 18601
Ba-F-In Ba5In3F19 Ba5In3F19,tP216,76 P41 1.4983,1.4983,1.554,90,90,90 - colorless 5.30 X 36516
Ba-F-Ir BaIrF6 KAsF6,hR24,148 R-3 0.73965,0.73965,0.72826,90,90,120 - - 6.40 X 47875
Handbook of Inorganic Substances – Edition 2015 : Data 309

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-F-La Ba0.04 La0.96 F2.96 HoH3,hP24,165 P-3c1 0.7204,0.7204,0.7368,90,90,120 - - 5.87 X 34928


Ba-F-La Ba0.996 La0.004F2.004 CaF2 ,cF12,225 Fm-3m 0.61978,0.61978,0.61978,90,90,90 fluorite family - 4.89 X 14202
Ba-F-Li LiBaF3 CaTiO3,cP5,221 Pm-3m 0.3996,0.3996,0.3996,90,90,90 perovskite family - 5.24 X 29461
Ba-F-Lu BaLu2F8 ht BaLu2F8,oP88,62 Pnma 0.6889,0.8077,2.1869,90,90,90 - - 6.98 X 9357
Ba-F-Lu BaLu2F8 rt *,mS22,12 C12/m1 0.6972,1.0505,0.426,90,99.75,90 - - - N 34557
Ba-F-Lu Ba0.76 Lu0.24 F2.24 BiF3 ,cF16,225 Fm-3m 0.5988,0.5988,0.5988,90,90,90 b.c.c. family - 5.84 X 7612
Ba-F-Lu Ba4Lu3F17 *,hR*,* - 2.907,2.907,4.048,90,90,120 - - - N 7612
Ba-F-Mg BaMgF4 hp Bi[ReO4],oS24,63 Cmcm 0.4037,1.3741,0.56,90,90,90 - - 5.08 X 56611
Ba-F-Mg BaMgF4 BaZnF4,oS24,36 Cmc21 0.41274,1.45146,0.58203,90,90,90 - colorless 4.53 X 51877
Ba-F-Mg Ba2MgF6 hp [NH4]2SiF6,hP9,164 P-3m1 0.5768,0.5768,0.4498,90,90,120 - - 5.29 A 8434
Ba-F-Mg Ba2MgF6 NbBi2O4(O0.5 F0.5)2,tI18,139 I4/mmm 0.4043,0.4043,1.6515,90,90,90 - - 5.08 A 8434
Ba-F-Mg Ba2Mg3F10 Ba2Ni3F10,mS60,12 C12/m1 1.8495,0.59497,0.78187,90,112.04,90 - colorless 4.48 X 33829
Ba-F-Mg Ba6Mg11F34 Ba6Cu11F34,aP51,2 P-1 0.75084,0.99192,1.00354,81.563,72.402,71.798 - - 4.27 X 43640
Ba-F-Mg Ba6Mg7F26 Ba6Mg7H26,oI78,71 Immm 0.58535,1.21495,1.51109,90,90,90 - - 4.60 X 33817
Ba-F-Mn BaMnF4 lt BaMnF4,mP12,4 P1211 0.42091,0.60016,0.78286,90,105.544,90 - pink 4.68 X 51877
Ba-F-Mn BaMnF4 rt BaZnF4,oS24,36 Cmc21 0.42202,1.51002,0.60001,90,90,90 - pink 4.66 X 51877
Ba-F-Mn BaMnF5 BaGaF5,oP28,19 P212121 0.4881,0.5811,1.4115,90,90,90 - brown red 4.77 X 17575
Ba-F-Mn BaMnF6 BaSiF6,hR24,166 R-3m 0.735,0.735,0.709,90,90,120 - yellow 4.60 X 919
Ba-F-Mn Ba2MnF6 hp [NH4]2SiF6,hP9,164 P-3m1 0.6076,0.6076,0.4356,90,90,120 - - 5.29 A 8434
Ba-F-Mn Ba2MnF6 NbBi2O4(O0.5 F0.5)2,tI18,139 I4/mmm 0.4148,0.4148,1.6791,90,90,90 - - 5.10 A 8434
Ba-F-Mn Ba5Mn3F19 Ba5Mn3F19,tI140,108 I4cm 1.4689,1.4689,0.7703,90,90,90 - violet 4.85 X 38128
Ba-F-N BaN0.5 F0.5 cub NaCl,cF8,225 Fm-3m 0.56796,0.56796,0.56796,90,90,90 rocksalt family purple dark 5.58 X 43431
Ba-F-N Ba2NF rhom NaFeO2,hR12,166 R-3m 0.40242,0.40242,1.9975,90,90,120 rocksalt family - 5.47 X 56403
Ba-F-Nd Ba0.10 Nd0.90 F2.90 HoH3,hP24,165 P-3c1 0.712,0.712,0.726,90,90,120 - - 6.21 A 10184
Ba-F-Nd Ba0.78 Nd0.22 F2.22 (Ba0.5 Ce0.5 )F2.5,cF64,225 Fm-3m 0.60753,0.60753,0.60753,90,90,90 - - 5.36 X 32940
Ba-F-Nd Ba4Nd3F17 Ba4Y3F17,hR159,148 R-3 1.12818,1.12818,2.07788,90,90,120 - - 5.68 X 40689
Ba-F-Ni BaNiF4 rt BaZnF4,oS24,36 Cmc21 0.4137,1.4431,0.5781,90,90,90 - green 5.24 X 36561
Ba-F-Ni BaNiF5 *,oS28,20 C222 1 0.54719,0.9873,0.74387,90,90,90 - gray violet - N 15652
Ba-F-Ni BaNiF6 BaSiF6,hR24,166 R-3m 0.7268,0.7268,0.6981,90,90,120 - red 4.84 X 16647
Ba-F-Ni Ba2NiF6 hp [NH4]2SiF6,hP9,164 P-3m1 0.5768,0.5768,0.4516,90,90,120 - - 5.71 A 8434
Ba-F-Ni Ba2NiF6 NbBi2O4(O0.5 F0.5)2,tI18,139 I4/mmm 0.4054,0.4054,1.6341,90,90,90 - - 5.53 X 3759
Ba-F-Ni Ba2Ni2F9 *,mP52,* - 0.5631,1.759,0.7396,90,90.13,90 - brown - N 15687
Ba-F-Ni Ba2Ni3F10 mon1 Ba2Ni3F10,mS60,12 C12/m1 1.8542,0.5958,0.7821,90,111.92,90 - - 5.31 X 13464
Ba-F-Ni Ba2Ni3F10 mon2 Ba2Ni3F10,mP34,10 P12/m1 1.5534,0.5925,1.8469,90,111.82,90 - - 1.35 X 20267
Ba-F-Ni Ba2Ni7F18 Ba2Ni7F18,aP27,2 P-1 0.6937,0.7229,0.7456,94.37,93.16,115.86 - yellowish 5.11 X 21855
Ba-F-Np Ba0.5 Np0.5 F3 HoH3,hP24,165 P-3c1 0.7374,0.7374,0.745,90,90,120 - green grass 6.93 A 3629
Ba-F-Pb BaPbF6 BaSiF6,hR24,166 R-3m 0.745,0.745,0.752,90,90,120 - colorless 6.32 X 1021
Ba-F-Pd Ba2PdF6 Sr2CuF6,oS36,64 Cmce 1.709,0.6163,0.6158,90,90,90 - orange 5.07 X 36307
Ba-F-Pr BaPrF6 RbPaF6,oS32,67 Cmme 0.8024,1.158,0.5616,90,90,90 - colorless 4.99 A 16538
Ba-F-Pr Ba0.10Pr0.90 F2.90 HoH3,hP24,165 P-3c1 0.716,0.716,0.729,90,90,120 - - 6.02 A 10184
Ba-F-Pr Ba0.73Pr0.27 F2.27 (Th0.025Pb0.975)F2.05 ,cF60,225 Fm-3m 0.6118,0.6118,0.6118,90,90,90 fluorite family - 5.26 X 19590
Ba-F-Pt BaPtF6 BaSiF6,hR24,166 R-3m 0.741,0.741,0.727,90,90,120 - - 6.43 A 3439
Ba-F-Rh BaRhF6 BaSiF6,hR24,166 R-3m 0.7379,0.7379,0.7211,90,90,120 - yellow 5.19 X 8619
Ba-F-Ru BaRuF6 KAsF6,hR24,148 R-3 0.742,0.742,0.724,90,90,120 - yellow 5.09 A 3439
Ba-F-Sb BaSbF5 KTeF5,oP28,57 Pbcm 0.4676,0.9313,1.1213,90,90,90 - colorless 4.82 X 23183
Ba-F-Sb BaSb2F12 BaSb2F12,aP15,1 P1 0.4885,0.5074,0.80437,95.029,97.758,116.5 - - 5.80 X 24000
Ba-F-Sb Ba5Sb3F *,cI*,220 I-43d 1.05686,1.05686,1.05686,90,90,90 - - - N 46240
Ba-F-Sc Ba1.56 ScF6.1 *,mP56,14 P121/c1 1.514,0.727,0.7,90,102.5,90 - - - N 5261
Ba-F-Sc Ba3Sc 2F12 ht *,tI102,87 I4/m 1.4891,1.4891,0.7691,90,90,90 - - - N 5798
Ba-F-Si BaSiF6 BaSiF6,hR24,166 R-3m 0.7198,0.7198,0.702,90,90,120 - colorless 4.42 X 18762
Ba-F-Si Ba5Si3F0.16 Ba5Si3F0.16 ,tP36,130 P4/ncc 0.84726,0.84726,1.6443,90,90,90 - - 4.36 X 39140
Ba-F-Sm Ba0.10 Sm0.90 F2.90 HoH3,hP24,165 P-3c1 0.703,0.703,0.716,90,90,120 - - 6.64 A 10184
Ba-F-Sm Ba0.74 Sm0.26 F2.26 BiF3 ,cF16,225 Fm-3m 0.6056,0.6056,0.6056,90,90,90 b.c.c. family - 5.49 X 7612
Ba-F-Sm Ba3.85 Sm3.15 F17.15 *,hR*,* - 2.962,2.962,4.129,90,90,120 - - - N 7612
Ba-F-Sn BaSnF4 PbSnF4,tP12,129 P4/nmm 0.4345,0.4345,1.1228,90,90,90 - white 5.20 X 52593
Ba-F-Sn BaSnF6 rt KAsF6,hR24,148 R-3 0.74279,0.74279,0.7418,90,90,120 - colorless 5.20 X 24235
Ba-F-Sn BaSn2F6 *,o*36,* - 0.431,0.932,1.538,90,90,90 - colorless 5.25 N 3615
Ba-F-Sn BaSn4F10 *,m*60,* - 1.073,0.759,1.073,90,112.,90 - colorless 6.58 N 3615
Ba-F-Sn Ba0.5 Sn0.5 F2 ht CaF2 ,cF12,225 Fm-3m 0.6199,0.6199,0.6199,90,90,90 fluorite family - 4.63 X 52593
Ba-F-Sr Ba0.5 Sr0.5 F2 CaF2 ,cF12,225 Fm-3m 0.5978,0.5978,0.5978,90,90,90 fluorite family - 4.68 X 28021
Ba-F-Ta BaTaF7 BaNb([OH]0.21 F0.79)7 ,cP72,205 Pa-3 0.99009,0.99009,0.99009,90,90,90 - colorless 6.18 X 49514
Ba-F-Tb BaTbF6 ht ZrPbF6,oS32,67 Cmme 0.7761,1.1513,0.55234,90,90,90 - colorless 5.52 X 32805
Ba-F-Tb BaTbF6 rt BaTbF6,aP32,2 P-1 0.7344,0.84475,0.8677,101.63,96.89,114.62 - colorless 5.84 X 33343
Ba-F-Tb Ba0.20Tb0.80 F2.80 HoH3,hP24,165 P-3c1 0.707,0.707,0.711,90,90,120 - - 6.73 A 10184
Ba-F-Tb Ba0.76 Tb0.24 F2.24 BiF3 ,cF16,225 Fm-3m 0.6043,0.6043,0.6043,90,90,90 b.c.c. family - 5.57 X 7612
Ba-F-Tb Ba3.92 Tb3.08 F17.08 *,hR*,* - 2.945,2.945,4.1,90,90,120 - - - N 7612
Ba-F-Te BaTeF6 BaTeF6,oF128,43 Fdd2 1.5059,1.5206,0.9005,90,90,90 - - 4.88 X 36020
Ba-F-Te BaTe 2F10 BaTe 2F10,mS52,15 C12/c1 1.7311,0.48316,1.0233,90,111.602,90 - - 4.86 X 31855
Ba-F-Th Ba0.5 Th0.5 F3 Na3As,hP8,194 P63/mmc 0.4217,0.4217,0.7431,90,90,120 - colorless 7.01 X 56085
Ba-F-Ti BaTiF5 BaTiF5,tI140,87 I4/m 1.5091,1.5091,0.767,90,90,90 - purple dark 4.26 X 17214
Ba-F-Ti BaTiF6 BaSiF6,hR24,166 R-3m 0.73676,0.73676,0.7252,90,90,120 - rose violet 4.37 X 24235
Ba-F-Tl BaTlF5 *,oP112,58 Pnnm 1.0616,1.402,1.144,90,90,90 - - - N 5813
Ba-F-Tl BaTl2F8 *,mS22,12 C12/m1 0.6864,1.0463,0.4229,90,98.98,90 - - - N 5813
Ba-F-Tl BaTl6F20 *,oP*,* - 0.8179,1.327,1.5968,90,90,90 - - - N 9311
Ba-F-Tl Ba2TlF7 mon RhPb2F7,mP40,14 P121/c1 0.5751,1.3001,0.8753,90,90.51,90 - - 6.21 A 16673
Ba-F-Tl Ba2TlF7 orth *,oP*,* - 1.119,1.4005,1.5548,90,90,90 - - - N 9311
Ba-F-Tm BaTm2F8 BaTm2F8,mS22,12 C12/m1 0.6935,1.0457,0.4243,90,99.67,90 - - 6.87 X 5205
Ba-F-Tm Ba0.78 Tm0.22 F2.22 Ba0.78 Tm0.22 F2.22 ,cF96,225 Fm-3m 0.60291,0.60291,0.60291,90,90,90 - - 5.65 X 50247
310 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-F-Tm Ba4.025 Tm2.975 F16.975 *,h**,* - 2.919,2.919,4.066,90,90,120 - - - N 7612


Ba-F-U Ba0.5 U0.5 F3 HoH3,hP24,165 P-3c1 0.7403,0.7403,0.7482,90,90,120 - green 6.87 A 3629
Ba-F-V BaVF5 BaFeF5,tI112,79 I4 1.497,1.497,0.753,90,90,90 - - 4.46 A 4560
Ba-F-V Ba3V2F12 rt *,tI102,* - 1.48,1.48,0.763,90,90,90 - - 4.42 N 4560
Ba-F-Y BaY2F8 rt BaTm2F8,mS22,12 C12/m1 0.69829,1.0519,0.42644,90,99.676,90 - - 5.02 X 27879
Ba-F-Y Ba0.5 Y0.5 F2.5 nano (Ba0.5 Ce0.5 )F2.5,cF96,225 Fm-3m 0.589,0.589,0.589,90,90,90 b.c.c. family - 5.22 X 54829
Ba-F-Y Ba0.76 Y0.24 F2.24 BiF3,cF16,225 Fm-3m 0.604,0.604,0.604,90,90,90 b.c.c. family - 5.07 X 7612
Ba-F-Y Ba4Y3F17 Ba4Y3F17,hR159,148 R-3 1.1075,1.1075,2.0372,90,90,120 - - 5.24 X 31529
Ba-F-Yb BaYbF6 KAsF6,hR24,148 R-3 0.686,0.686,0.657,90,90,120 - - 7.90 A 5255
Ba-F-Yb BaYb2F8 ht *,oP88,59 Pmmn 0.812,2.1908,0.6928,90,90,90 - - - N 14696
Ba-F-Yb BaYb2F8 rt BaTm2F8,mS22,12 C12/m1 0.6919,1.044,0.4238,90,99.7,90 - - 6.99 A 32288
Ba-F-Yb Ba0.77 Yb0.23 F2.23 cub2 BiF3,cF16,225 Fm-3m 0.6,0.6,0.6,90,90,90 b.c.c. family - 5.78 X 7612
Ba-F-Yb Ba0.8 Yb0.2 F2.2 cub1 (Ba0.8 Yb0.2 )F2.2,cP39,221 Pm-3m 0.6096,0.6096,0.6096,90,90,90 - - 5.46 X 40610
Ba-F-Yb Ba4Yb3F17 Ba4Y3F17,hR159,148 R-3 1.1,1.1,2.0262,90,90,120 - - 6.53 X 31529
Ba-F-Zn BaZnF4 hp BaZnF4,mP24,7 P1c1 0.3998,0.5804,1.39874,90,105.89,90 - - 5.93 X 56611
Ba-F-Zn BaZnF4 BaZnF4,oS24,36 Cmc21 0.41903,1.45184,0.58361,90,90,90 - colorless 5.21 X 51877
Ba-F-Zn Ba2ZnF6 hp [NH4]2SiF6,hP9,164 P-3m1 0.5823,0.5823,0.4502,90,90,120 - - 5.70 A 8434
Ba-F-Zn Ba2ZnF6 NbBi2O4(O0.5 F0.5)2,tI18,139 I4/mmm 0.4101,0.4101,1.6263,90,90,90 - - 5.51 X 3759
Ba-F-Zn Ba2Zn3F10 Ba2Ni3F10 ,mS60,12 C12/m1 1.878,0.607,0.791,90,112.3,90 - - 5.26 A 3759
Ba-F-Zn Ba2Zn7F18 Ba2Ni7F18 ,aP27,2 P-1 0.7032,0.7292,0.7505,94.24,92.82,116.39 - - 5.21 X 19561
Ba-F-Zn Ba6Zn7F26 Ba6Zn7F26 ,mS78,12 C12/m1 1.946,0.5956,1.2243,90,128.88,90 - - 5.34 X 18252
Ba-F-Zr BaZrF6 ht ZrPbF6,oS32,67 Cmme 0.7681,1.135,0.5511,90,90,90 - colorless 4.74 X 10248
Ba-F-Zr BaZrF6 rt BaZrF6,mP32,14 P121/c1 0.6493,0.953,0.9203,90,127.09,90 - - 5.01 X 11171
Ba-F-Zr BaZr2F10 ht BaZr2F10,mS52,15 C12/c1 0.6064,1.5383,0.87131,90,106.867,90 - - 4.35 X 21443
Ba-F-Zr BaZr2F10 rt *,aP104,2 P-1 0.7794,1.3013,1.6102,72.783,84.906,87.9 - - 4.36 N 12708
Ba-F-Zr Ba0.87 Zr0.13 F2.26 *,cF*,225 Fm-3m 0.6124,0.6124,0.6124,90,90,90 - - 5.04 N 33696
Ba-F-Zr Ba1.88 Zr1.06 F8 Ba1.87 Zr1.065 F8,tP40,129 P4/nmm 0.5637,0.5637,1.0423,90,90,90 - - 5.08 X 13027
Ba-F-Zr Ba2ZrF8 Ba2ZrF8,oP44,62 Pnma 0.97401,0.56167,1.18839,90,90,90 - - 5.29 X 34296
Ba-F-Zr Ba3ZrF10 ZrPb3F10,oS56,63 Cmcm 1.0984,1.3332,0.608,90,90,90 - - 5.17 A 13575
Ba-Fe-Ge Ba4Fe0.23 Ge21.24 Na4Si23,cP54,223 Pm-3n 1.06672,1.06672,1.06672,90,90,90 clathrate - 5.76 A 52233
Ba-Fe-Ge Ba6Fe0.9 Ge 24.1 K6Sn25,cP124,213 P4132 1.4554,1.4554,1.4554,90,90,90 clathrate - 5.65 A 52233
Ba-Fe-N Ba3FeN3 Ba3FeN3,hP14,176 P63 /m 0.8014,0.8014,0.5608,90,90,120 - black 5.43 X 25617
Ba-Fe-O BaFeO2 (Ba0.8 Sr0.2)FeO2,tP22,123 P4/mmm 0.83746,0.83746,0.38787,90,90,90 - - 5.50 A 58422
Ba-Fe-O BaFeO2.75 BaTiO3,tP5,99 P4mm 0.3982,0.3982,0.401,90,90,90 perovskite family - 6.19 A 5453
Ba-Fe-O BaFeO2.91 BaTiO3,hP30,194 P63 /mmc 0.56743,0.56743,1.39298,90,90,120 perovskite family - 6.15 X 42026
Ba-Fe-O BaFeO2.93 BaFeO2.93 ,hR60,160 R3m 0.56915,0.56915,2.7981,90,90,120 perovskite family - 6.09 X 22241
Ba-Fe-O BaFeO3 CaTiO3,cP5,221 Pm-3m 0.39711,0.39711,0.39711,90,90,90 perovskite family - 6.40 X 55622
Ba-Fe-O BaFeO4 Ba[SO4],oP24,62 Pnma 0.9103,0.5445,0.7301,90,90,90 - - 4.72 A 1252
Ba-Fe-O BaFe12O19 BaFe12O19 ,hP66,194 P63 /mmc 0.5892,0.5892,2.3183,90,90,120 barioferrite black 5.30 X 18207
Ba-Fe-O BaFe15O23 BaFe15O23 ,hR234,166 R-3m 0.588,0.588,8.411,90,90,120 - - 5.31 X 899
Ba-Fe-O BaFe18O27 BaFe18O27 ,hP92,194 P63 /mmc 0.588,0.588,3.2845,90,90,120 - - 5.32 X 899
Ba-Fe-O BaFe2O4 ht1 *,o*28,* - 0.5463,0.871,0.9461,90,90,90 - black 4.62 N 6383
Ba-Fe-O BaFe2O4 ht2 BaAl2O4,hP14,182 P6322 0.5458,0.5458,0.9016,90,90,120 - - 4.47 X 6383
Ba-Fe-O BaFe2O4 m BaFe2O4,oP112,62 Pnma 1.08818,1.7347,0.93358,90,90,90 - black 4.72 X 19700
Ba-Fe-O BaFe2O4 rt BaFe2O4,oS56,36 Cmc21 0.84385,1.89978,0.53802,90,90,90 - brown dark 4.82 X 50537
Ba-Fe-O BaFe4O7 BaFe4O7,hP24,176 P63 /m 0.516,0.516,1.3811,90,90,120 - red 4.93 X 7197
Ba-Fe-O BaFe7O11 Ba(Zn0.5 Fe0.5)2Fe5O11,hR114,166 R-3m 0.5852,0.5852,4.3627,90,90,120 - - 5.42 A 19209
Ba-Fe-O Ba2FeO4 Ca2[SiO4],mP28,14 P121/c1 0.6034,0.7647,1.15501,90,118.518,90 - black 5.60 X 40042
Ba-Fe-O Ba2Fe2O5 Ba2Fe2O5,mP126,14 P121/c1 0.6969,1.1724,2.3431,90,98.74,90 - brown 5.73 X 26984
Ba-Fe-O Ba2Fe6O11 Ba2Fe6O11 ,oP76,58 Pnnm 0.5181,2.3024,0.89,90,90,90 - - 4.92 X 12526
Ba-Fe-O Ba3FeO5 Ba3FeS5,oP36,62 Pnma 1.0301,0.8151,0.7611,90,90,90 - black 5.69 X 40042
Ba-Fe-O Ba3Fe26O41 Ba3Fe20(Fe 0.67Co0.33 )6O41,hP140,194 P63 /mmc 0.59,0.59,5.23,90,90,120 - - 5.31 A 861
Ba-Fe-O Ba5Fe5O13.25 hex Ba5Fe5O14 ,hP48,194 P63 /mmc 0.57794,0.57794,2.46087,90,90,120 - - 5.50 X 39158
Ba-Fe-O Ba5Fe5O14 orth Ba5Fe5O14 ,oS96,63 Cmcm 0.57615,0.99792,2.4347,90,90,90 - black 5.65 X 43554
Ba-Fe-O Ba8Fe8O21 *,cF*,* - 0.805,0.805,0.805,90,90,90 - - - N 617
Ba-Fe-P BaFe2P 2 CeAl2Ga2,tI10,139 I4/mmm 0.38435,0.38435,1.2422,90,90,90 - black 5.63 X 55263
Ba-Fe-S BaFe2S2.5 BaFe2S2.5 ,oP12,59 Pmmn 0.4016,0.9616,0.6514,90,90,90 - black 4.35 X 15323
Ba-Fe-S BaFe2S3 CsCu2Cl3,oS24,63 Cmcm 0.87835,1.1219,0.5286,90,90,90 - - 4.40 X 6853
Ba-Fe-S BaFe2S4 tet2 BaFe2S4,tI14,87 I4/m 0.7678,0.7678,0.5292,90,90,90 - black 4.02 X 13451
Ba-Fe-S Ba0.5 FeS2 tet1 Sr0.5 AlTe2 ,tI16,140 I4/mcm 0.8111,0.8111,0.559,90,90,90 - - 3.41 X 11760
Ba-Fe-S Ba15Fe7S25 Ba15Fe7S25 ,oP188,62 Pnma 4.191,0.9572,1.2654,90,90,90 - black 4.26 X 9959
Ba-Fe-S Ba2FeS3 K2CuCl3,oP24,62 Pnma 1.2087,0.4246,1.2359,90,90,90 - - 4.47 A 6853
Ba-Fe-S Ba3FeS5 hp Ba3FeS5,hP56,188 P-6c2 0.9218,0.9218,1.8042,90,90,120 - black 4.71 X 11498
Ba-Fe-S Ba3FeS5 Ba3FeS5,oP36,62 Pnma 1.2405,0.9516,0.85212,90,90,90 - - 4.15 X 9959
Ba-Fe-S Ba4Fe2S7.33 Ba4Fe2S7.33 ,aP30,2 P-1 0.67086,0.9002,1.26927,75.14,76.172,89.259 - - 4.14 X 10815
Ba-Fe-S Ba5Fe4S11 rt Ba5Fe4S11 ,oP40,31 Pmn21 1.606,0.726,0.8863,90,90,90 - black 4.06 X 13496
Ba-Fe-S Ba5Fe9S18 Ba5Fe9S18 ,tP128,130 P4/ncc 0.7776,0.7776,4.986,90,90,90 - black 3.89 X 8838
Ba-Fe-S Ba6Fe8S15 Ba6Fe8S15 ,tI58,87 I4/m 1.1408,1.1408,1.0256,90,90,90 - - 4.36 X 6853
Ba-Fe-S Ba7Fe6S14 Ba7Fe6S14 ,mS108,15 C12/c1 2.549,0.8244,1.4949,90,118.852,90 - black 4.21 X 5942
Ba-Fe-S Ba9Fe16S32 Ba9Fe16S32 ,tP116,128 P4/mnc 0.77758,0.77758,4.4409,90,90,90 - - 3.90 X 10492
Ba-Fe-S Ba9Fe4S15 ht Ba9Fe4S15 ,oP112,62 Pnma 2.5212,0.9594,1.2575,90,90,90 - black 4.24 X 11716
Ba-Fe-S Ba9Fe4S15 rt Ba9Fe4S15 ,tI136,88 I41/a 0.9634,0.9634,3.4311,90,90,90 - - 4.05 X 11716
Ba-Fe-Sb BaFe4Sb12 LaFe4P 12,cI34,204 Im-3 0.9188,0.9188,0.9188,90,90,90 - gray 7.80 X 25017
Ba-Fe-Se BaFe1.8 Se3 CsAg2I3,oP24,62 Pnma 1.1776,0.5457,0.9158,90,90,90 - black 5.36 X 57224
Ba-Fe-Se Ba2FeSe3 K2CuCl3,oP24,62 Pnma 1.235,0.4439,1.2921,90,90,90 - - 5.32 A 6853
Ba-Fe-Se Ba3Fe3Se7 Ba3Fe3Se7 ,hP26,186 P63 mc 1.0843,1.0843,0.7384,90,90,120 - black 5.00 X 6853
Ba-Ga-Ge BaGaGe hex1 AlB2,hP3,191 P6/mmm 0.43351,0.43351,0.50947,90,90,120 AlB2 family - 5.60 X 53230
Ba-Ga-Ge BaGaGe hex2 YPtAs,hP12,194 P63 /mmc 0.4302,0.4302,2.0567,90,90,120 AlB2 family gray 5.63 A 23024
Handbook of Inorganic Substances – Edition 2015 : Data 311

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Ga-Ge Ba3Ga0.7 Ge4.3 Pu3Pd5,oS32,63 Cmcm 1.0351,0.86147,1.03676,90,90,90 - - 5.55 X 54542


Ba-Ga-Ge Ba4Ga1.5 Ge21.5 Ba4(Ga0.09 Ge0.91 )23,cI432,230 Ia-3d 2.12891,2.12891,2.12891,90,90,90 clathrate - 6.10 X 46726
Ba-Ga-Ge Ba4Ga3Ge20 Sr4(Ga0.35 Ge0.65)23-a,cP72,223 Pm-3n 1.06881,1.06881,1.06881,90,90,90 clathrate - 6.01 X 45912
Ba-Ga-Ge Ba4Ga8Ge15 Na4Si23,cP54,223 Pm-3n 1.07828,1.07828,1.07828,90,90,90 clathrate gray 5.82 X 46550
Ba-Ga-Ge Ba6Ga1.5 Ge23.5 K6Sn25,cP124,213 P4132 1.45122,1.45122,1.45122,90,90,90 clathrate - 5.73 X 45912
Ba-Ga-H BaGa2H2 SrAl2H2,hP5,164 P-3m1 0.45334,0.45334,0.49069,90,90,120 - - 5.30 A 46562
Ba-Ga-H Ba5Ga6H2 Ba5Ga6H2,hP26,158 P3c1 0.77698,0.77698,1.43902,90,90,120 - - 4.89 X 33024
Ba-Ga-Hg BaHg2.1 Ga1.9 Ba(Hg0.525 Ga0.475)4,tI40,141 I41/amd 0.6713,0.6713,2.2204,90,90,90 - - 9.17 X 59760
Ba-Ga-Hg BaHg5.2 Ga0.8 BaHg3(Hg0.73 Ga0.27)3,oS28,63 Cmcm 0.72977,1.9101,0.50748,90,90,90 - - 11.61 X 59624
Ba-Ga-Hg Ba3Hg10.8 Ga0.2 Ba3ZnHg10,oP28,59 Pmmn 0.70936,1.70796,0.63078,90,90,90 - - 11.27 X 59760
Ba-Ga-In BaGa0.54 In0.46 EuGa,aP8,2 P-1 0.6611,0.6794,0.7124,69.13,77.14,84.27 - gray silver 5.19 X 51659
Ba-Ga-In BaGa0.6 In1.4 KHg2,oI12,74 Imma 0.5138,0.8426,0.8354,90,90,90 AlB2 family gray silver 6.24 X 49752
Ba-Ga-In BaGa1.7 In0.3 AlB2 ,hP3,191 P6/mmm 0.4506,0.4506,0.5104,90,90,120 AlB2 family gray silver 5.37 X 49752
Ba-Ga-N Ba3Ga2N4 Sr3Al2N4,oP36,52 Pnna 0.6201,1.0511,1.007,90,90,90 - black 6.15 X 31391
Ba-Ga-N Ba3Ga3N5 Ba3Ga3N5,mS88,15 C12/c1 1.6801,0.83296,1.1623,90,109.92,90 - orange 6.00 X 57945
Ba-Ga-N Ba6Ga5N Sr6Ga5N,hR72,167 R-3c 0.7905,0.7905,4.1965,90,90,120 - gray silver 5.21 A 29866
Ba-Ga-O BaGa12O19 BaFe 12O19,hP66,194 P63/mmc 0.5814,0.5814,2.3038,90,90,120 magnetoplumbite family yellow 6.29 X 34760
Ba-Ga-O BaGa2O4 ht BaAl2O4,hP18,182 P6322 0.53925,0.53925,0.89739,90,90,120 - colorless 5.01 X 40816
Ba-Ga-O BaGa2O4 rt BaGa2O4,hP168,173 P63 1.86403,1.86403,0.86801,90,90,120 - colorless 5.20 X 37723
Ba-Ga-O Ba3Ga2O6 Ba3Ga2O6,cP272,205 Pa-3 1.6746,1.6746,1.6746,90,90,90 - yellow 5.49 X 38576
Ba-Ga-O Ba4Ga2O7 Ba4Ga2O7,mP78,14 P121/c1 1.77447,1.06719,0.72828,90,98.962,90 - - 5.86 X 39506
Ba-Ga-P BaGa2P 2 BaGa2P 2,mP20,14 P121/c1 0.73363,0.96648,0.74261,90,115.373,90 - black 4.73 X 54386
Ba-Ga-P Ba2Ga2.5 P4 Ba2Ga2.5 P4,oI44,72 Ibam 0.72368,1.79538,0.65563,90,90,90 - black 4.47 X 56142
Ba-Ga-P Ba3GaP 3 Ba3AlSb3,oS56,64 Cmce 1.9475,0.6708,1.3017,90,90,90 - - 4.49 X 32561
Ba-Ga-Pb Ba5Ga5Pb Ba5Al5Sn,hP11,187 P-6m2 0.60176,0.60176,1.09151,90,90,120 - - 6.03 X 47801
Ba-Ga-Pt BaPt2Ga2 BaRh2Si2,mP20,14 P121/c1 0.8504,0.6473,0.8198,90,95.97,90 - gray 9.87 X 33761
Ba-Ga-S BaGa2S4 CaB2O4,cP84,205 Pa-3 1.2685,1.2685,1.2685,90,90,90 - white 3.95 X 15431
Ba-Ga-S BaGa4S7 BaAl4S7,oP24,31 Pmn21 1.4775,0.6228,0.5929,90,90,90 - yellow 3.90 X 51947
Ba-Ga-S Ba2GaS4 Ba2GaS4,mP56,14 P121/c1 1.2739,0.6201,1.983,90,104.254,90 - yellow 4.14 X 56355
Ba-Ga-S Ba2Ga2S5 Tl2Ge2S5,mS72,15 C12/c1 1.5294,1.4793,0.858,90,106.04,90 - rose 4.09 X 16761
Ba-Ga-S Ba3Ga2S6 Ba3Ga2S6,mS44,15 C12/c1 0.9089,1.4477,0.9028,90,91.81,90 - rose 4.16 X 17465
Ba-Ga-S Ba4Ga2S7 Ba4Ga2S7,mP26,11 P121/m1 0.9028,0.7164,1.1766,90,108.32,90 - rose 4.20 X 17465
Ba-Ga-S Ba5Ga2S8 Ba5Ga2S8,oS120,64 Cmce 2.2494,1.2146,1.1887,90,90,90 - colorless 4.43 X 17715
Ba-Ga-Sb BaGa2Sb2 BaGa2Sb2,oP40,62 Pnma 2.5454,0.44421,1.0273,90,90,90 - - 5.95 X 38682
Ba-Ga-Sb Ba0.875 GaSb Eu0.875 GaSb,hP24,194 P63/mmc 0.47045,0.47045,1.8123,90,90,120 - gray 5.96 X 54111
Ba-Ga-Sb Ba3GaSb3 Ba3GaSb3,oP56,62 Pnma 1.4117,2.1167,0.7128,90,90,90 - - 5.28 X 18707
Ba-Ga-Sb Ba3Ga4Sb5 Ba3Ga4Sb5,oP52,62 Pnma 1.3248,0.45085,2.4374,90,90,90 - black 5.93 X 41990
Ba-Ga-Sb Ba7Ga2Sb6 Sr7Ga2Sb6,cI60,220 I-43d 1.0319,1.0319,1.0319,90,90,90 - black 5.54 X 50912
Ba-Ga-Sb Ba7Ga4Sb9 Ba7Ga4Sb9,oP40,59 Pmmn 1.0861,1.8024,0.71,90,90,90 - - 5.58 X 19670
Ba-Ga-Se BaGa2Se4 SrAl2Se4,oS28,66 Cccm 0.648,1.113,1.124,90,90,90 - orange 4.86 X 14709
Ba-Ga-Se BaGa4Se7 BaGa4Se7,mP24,7 P1c1 0.76252,0.65114,1.4702,90,121.24,90 - yellow 5.16 X 54396
Ba-Ga-Se Ba5Ga2Se8 Ba5Ga2S8,oS120,64 Cmce 2.3433,1.2461,1.2214,90,90,90 - yellow 5.43 X 56495
Ba-Ga-Se Ba5Ga4Se10 Ba5Ga4Se10,tI52,140 I4/mcm 0.8752,0.8752,1.3971,90,90,90 - red 5.45 X 56112
Ba-Ga-Si BaGaSi AlB2 ,hP3,191 P6/mmm 0.42479,0.42479,0.51106,90,90,120 AlB2 family - 4.89 X 53230
Ba-Ga-Si BaGa0.11 Si0.89 TlI,oS8,63 Cmcm 0.50112,1.2038,0.4151,90,90,90 CrB(TlI)-FeB - 4.51 X 52438
Ba-Ga-Si Ba3Ga0.7 Si4.3 Pu3Pd5,oS32,63 Cmcm 1.02482,0.85658,1.02418,90,90,90 - - 4.30 X 54542
Ba-Ga-Si Ba4Ga7.5 Si15.5 cub1 Na4Si23,cP54,223 Pm-3n 1.05319,1.05319,1.05319,90,90,90 clathrate - 4.29 X 58958
Ba-Ga-Si Ba4Ga8Si15 cub2 Sr4(Ga0.35 Ge0.65)23-a,cP72,223 Pm-3n 1.05397,1.05397,1.05397,90,90,90 - - 4.34 X 38963
Ba-Ga-Sn BaGaSn CaIn2,hP6,194 P63/mmc 0.45807,0.45807,1.03303,90,90,120 AlB2 family - 5.76 X 53230
Ba-Ga-Sn BaGa0.17 Sn0.83 TlI,oS8,63 Cmcm 0.5258,1.2561,0.4632,90,90,90 CrB(TlI)-FeB - 5.38 X 52438
Ba-Ga-Sn BaGa1.79 Sn4.21 Eu(Ga0.33 Ge0.67)6,oS28,63 Cmcm 0.45383,1.22486,1.43747,90,90,90 clathrate gray 6.33 X 56022
Ba-Ga-Sn BaGa3.11 Sn0.89 BaAl4,tI10,139 I4/mmm 0.47455,0.47455,1.0554,90,90,90 - gray 6.43 X 47955
Ba-Ga-Sn Ba2Ga4Sn13 Ba2Ga4Sn13,cF152,227 Fd-3m 1.7054,1.7054,1.7054,90,90,90 - gray 5.62 X 35325
Ba-Ga-Sn Ba4Ga6.6 Sn16.4 cub1 Ba4(Ga0.36 Sn0.64)22Sn,cI54,217 I-43m 1.15843,1.15843,1.15843,90,90,90 - black 6.32 X 56022
Ba-Ga-Sn Ba4Ga7.25 Sn15.75 cub2 Sr4(Ga0.35 Ge0.65)23-b,cP72,223 Pm-3n 1.168,1.168,1.168,90,90,90 clathrate gray silver 6.09 X 56022
Ba-Ga-Sn Ba5Ga5Sn Ba5Al5Sn,hP11,187 P-6m2 0.59945,0.59945,1.086,90,90,120 - - 5.67 X 47801
Ba-Ga-Te Ba0.5 GaTe2 Sr0.5 AlTe2,tI16,140 I4/mcm 0.842,0.842,0.678,90,90,90 - red dark 5.44 X 7074
Ba-Gd-O BaGd2O4 CaV2O4,oP28,62 Pnma 1.0491,0.35149,1.2265,90,90,90 - white 7.58 A 46770
Ba-Gd-O Ba3Gd4O9 *,hR48,166 R-3m 0.6164,0.6164,2.55,90,90,120 - colorless - N 7413
Ba-Gd-S BaGd2S4 CaV2O4,oP28,62 Pnma 1.22551,0.40787,1.45998,90,90,90 - - 5.28 A 52663
Ba-Gd-S Ba0.05 Gd2.63 S4 Th3P 4,cI28,220 I-43d 0.8388,0.8388,0.8388,90,90,90 - - 6.18 A 35075
Ba-Gd-S Ba0.94 Gd0.04 S NaCl,cF8,225 Fm-3m 0.6378,0.6378,0.6378,90,90,90 rocksalt family - 4.29 X 35075
Ba-Gd-Se BaGd2Se4 CaV2O4,oP28,62 Pnma 1.274,0.424,1.52,90,90,90 - - 6.21 A 2166
Ba-Gd-Te BaGd2 Te4 CaV2O4,oP28,62 Pnma 1.36924,0.44822,1.62597,90,90,90 - black 6.41 X 37351
Ba-Ge-I Ba3GeI2 Na2PtO3,oF96,70 Fddd 1.0064,1.4082,2.9605,90,90,90 - - 4.68 X 37649
Ba-Ge-In BaInGe EuGe2,hP3,164 P-3m1 0.45709,0.45709,0.50994,90,90,120 AlB2 family - 5.84 X 53230
Ba-Ge-In Ba3In0.7 Ge4.3 Pu3Pd5,oS32,63 Cmcm 1.0513,0.86405,1.0547,90,90,90 - - 5.58 X 54542
Ba-Ge-In Ba4In8Ge15 Na4Si23,cP54,223 Pm-3n 1.11195,1.11195,1.11195,90,90,90 clathrate gray silver 6.18 X 45459
Ba-Ge-In Ba6In4Ge21 Ba6(In0.36 Ge0.64)11Ge14,cP124,213 P4132 1.4739,1.4739,1.4739,90,90,90 clathrate gray silver 5.82 X 35326
Ba-Ge-Ir BaIrGe 3 BaNiSn3,tI10,107 I4mm 0.45406,0.45406,1.02132,90,90,90 - - 8.63 X 55025
Ba-Ge-Ir BaIr2Ge2 CaRh2B2,oF40,70 Fddd 0.6318,1.0844,1.2995,90,90,90 - - 9.95 A 40908
Ba-Ge-Ir Ba2Ir4Ge5 *,oS*,63 Cmcm 1.1313,0.6754,1.1576,90,90,90 - - - N 40908
Ba-Ge-Li LiBaGe 2 (Li0.9 Mg0.1 )BaSi2,oP16,62 Pnma 0.7381,0.4617,1.1837,90,90,90 - black 4.77 X 52445
Ba-Ge-Li LiBa2Ge3 LiSr2Si3,oF96,70 Fddd 0.8901,1.5469,1.943,90,90,90 - - 4.96 X 31310
Ba-Ge-Li Li2BaGe4 *,hR*,166 R-3m 0.4582,0.4582,2.6287,90,90,120 - - - N 54992
Ba-Ge-Mg BaMgGe MnAlGe,tP6,129 P4/nmm 0.464,0.464,0.792,90,90,90 - gray silver 4.56 X 7050
Ba-Ge-Mg BaMg2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.467,0.467,1.133,90,90,90 - - 4.45 X 8604
Ba-Ge-Mg BaMg4Ge3 rt BaMg4Si3,tP8,123 P4/mmm 0.46335,0.46335,0.8746,90,90,90 - black 4.00 X 35763
312 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Ge-Mg Ba2Mg12Ge7.33 Ho2Rh12As7,hP24,176 P63 /m 1.1217,1.1217,0.4402,90,90,120 - black gray 3.80 X 40869


Ba-Ge-Mg Ba5Mg18Ge13 Sc5Co19P 12 ,hP37,189 P-62m 1.4727,1.4727,0.45093,90,90,120 - - 4.06 X 35612
Ba-Ge-Mn BaMnGe PbClF,tP6,129 P4/nmm 0.45212,0.45212,0.7906,90,90,90 - gray 5.44 X 35122
Ba-Ge-Mn BaMn2Ge 2 CeAl2Ga2,tI10,139 I4/mmm 0.4473,0.4473,1.098,90,90,90 - - 5.93 X 28810
Ba-Ge-Mn Ba4MnGe 21 Na4Si23,cP54,223 Pm-3n 1.06662,1.06662,1.06662,90,90,90 clathrate - 5.83 A 52233
Ba-Ge-Mn Ba6Mn0.6 Ge24.4 K6Sn25,cP124,213 P4132 1.45557,1.45557,1.45557,90,90,90 clathrate - 5.66 A 52233
Ba-Ge-N Ba3GeN3.33 Ba3NiO4,hR48,167 R-3c 0.79399,0.79399,1.72821,90,90,120 - black 5.61 X 50025
Ba-Ge-N Ba3Ge2N2 Ba3Ge2N2 ,mP14,11 P121/m1 0.96196,0.40466,1.01337,90,113.553,90 - gray silver 5.37 X 31784
Ba-Ge-N Ba6Ge5N2 Sr6Ge5N2,oP26,59 Pmmn 0.4162,1.8841,0.96116,90,90,90 - black 5.35 X 44387
Ba-Ge-Na Na2BaGe4 *,oI56,46 Ima2 0.9667,1.8312,0.8679,90,90,90 - - - N 36525
Ba-Ge-Na Na2Ba4Ge 25 Na2Ba4Ge25,cP148,213 P4132 1.44703,1.44703,1.44703,90,90,90 clathrate gray silver 5.28 X 39604
Ba-Ge-Ni BaNi2Ge Li2BaSi,oP8,59 Pmmn 0.41571,0.66935,0.59498,90,90,90 - - 6.57 X 55467
Ba-Ge-Ni BaNi2Ge2 ht CeAl2Ga2,tI10,139 I4/mmm 0.42665,0.42665,1.12545,90,90,90 - - 6.48 A 59440
Ba-Ge-Ni BaNi2Ge2 rt *,oP20,62 Pnma 0.83852,1.13174,0.42902,90,90,90 - - 6.52 N 59440
Ba-Ge-Ni Ba2Ni5Ge4 Ba2Ni5Ge4 ,mS22,12 C12/m1 1.2523,0.4056,0.9503,90,118.65,90 - - 6.73 X 57417
Ba-Ge-Ni Ba4Ni1.75 Ge21.05 Ba4(Ni0.63 Ge0.37)2.79 Ge20,cP120,223 Pm-3n 1.06798,1.06798,1.06798,90,90,90 - gray 5.94 X 54076
Ba-Ge-Ni Ba4Ni2Ge21 Na4Si23,cP54,223 Pm-3n 1.06769,1.06769,1.06769,90,90,90 clathrate - 5.98 X 59204
Ba-Ge-Ni Ba4Ni3Ge20 Ba4Al3(Al0.25 Ge0.75)20,cP54,223 Pm-3n 1.05179,1.05179,1.05179,90,90,90 - gray 6.21 X 52800
Ba-Ge-O BaGeO3 hp 4H *,hP20,* - 0.5603,0.5603,0.911,90,90,120 - - 6.92 N 5222
Ba-Ge-O BaGeO3 hp 9H *,hP45,* - 0.5648,0.5648,2.107,90,90,120 - - 6.62 N 5222
Ba-Ge-O BaGeO3 hp1 *,oI240,* - 0.9011,1.158,3.884,90,90,90 - - 5.07 N 5222
Ba-Ge-O BaGeO3 ht BaGeO3,oP20,19 P212121 0.458,0.568,1.276,90,90,90 - brownish 5.16 X 1573
Ba-Ge-O BaGeO3 rt BaGeO3,mS84,15 C12/c1 1.31895,0.76205,1.1717,90,112.278,90 - - 4.72 X 46099
Ba-Ge-O BaGe2O5 hp-ht BaGe2O5,mP128,14 P121/c1 0.95501,1.3043,1.3214,90,94.006,90 - - 5.87 X 17746
Ba-Ge-O BaGe2O5 hp2 BaGe2O5,oS64,64 Cmce 0.55632,0.98711,1.43231,90,90,90 - - 6.12 X 17746
Ba-Ge-O BaGe2O5 rt *,mP16,* - 0.51765,0.5538,0.81889,90,94.089,90 - - 5.14 N 15376
Ba-Ge-O BaGe4O9 BaGe4O9,hP42,150 P321 1.1608,1.1608,0.4768,90,90,120 - colorless 5.12 X 17296
Ba-Ge-O Ba10Ge7O3 Ba10Ge7O3,hP24,191 P6/mmm 1.1701,1.1701,0.5095,90,90,120 - - 5.30 X 31310
Ba-Ge-O Ba2Ge5O12 *,hP228,* - 1.16864,1.16864,1.9249,90,90,120 - - 7.26 N 15376
Ba-Ge-O Ba2[GeO4 ] Mg2[SiO4],oP28,62 Pnma 1.035,0.774,0.588,90,90,90 - white 5.80 A 2628
Ba-Ge-O Ba21Ge2O5 Ba21Si2O5 ,cF224,227 Fd-3m 2.0398,2.0398,2.0398,90,90,90 - - 4.87 X 31046
Ba-Ge-O Ba3GeO GdFeO3,oP20,62 Pnma 0.7591,1.0728,0.7551,90,90,90 perovskite family black 5.41 X 35163
Ba-Ge-O Ba3[GeO4 ]O Sr3[SiO4]O,tP36,130 P4/ncc 0.7326,0.7326,1.1583,90,90,90 - - 6.03 A 5504
Ba-Ge-P BaGe2P2 BaGe2As2 ,tP20,105 P42 mc 0.7618,0.7618,0.85,90,90,90 - - 4.64 X 14805
Ba-Ge-P Ba2GeP2 Ba2GeP2,mP20,14 P121/c1 0.8553,0.9515,0.7481,90,105.95,90 - - 4.64 X 15749
Ba-Ge-P Ba4GeP4 Ba4SiAs4,cP72,218 P-43n 1.3044,1.3044,1.3044,90,90,90 - gray 4.46 X 15453
Ba-Ge-Pd BaPdGe3 BaNiSn3,tI10,107 I4mm 0.45508,0.45508,1.03649,90,90,90 - - 7.14 X 55025
Ba-Ge-Pd BaPd2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.4415,0.4415,1.0946,90,90,90 - - 7.71 A 40908
Ba-Ge-Pd Ba2Pd5Ge4 Ba2Pd5Ge4,oS44,64 Cmce 1.09296,1.41639,0.58808,90,90,90 - black 8.00 X 58037
Ba-Ge-Pd Ba4Pd3Ge20 Na4Si23,cP54,223 Pm-3n 1.0781,1.0781,1.0781,90,90,90 clathrate gray 6.15 X 24843
Ba-Ge-Pt BaPtGe NiSbS,cP12,198 P213 0.6747,0.6747,0.6747,90,90,90 pyrite-marcasite family gray silver 8.76 X 26080
Ba-Ge-Pt BaPtGe3 BaNiSn3,tI10,107 I4mm 0.45636,0.45636,1.02341,90,90,90 - - 8.57 X 47733
Ba-Ge-Pt BaPt2Ge2 BaCu2Sb2,tI30,139 I4/mmm 0.453,0.453,3.0521,90,90,90 - - 10.70 A 40908
Ba-Ge-Pt BaPt4Ge12 LaFe4P 12,cI34,204 Im-3 0.86838,0.86838,0.86838,90,90,90 - - 9.07 X 55552
Ba-Ge-Pt Ba4Pt1.5Ge 21.5 Na4Si23,cP54,223 Pm-3n 1.07344,1.07344,1.07344,90,90,90 clathrate gray 6.45 X 49379
Ba-Ge-Rh BaRhGe3 BaNiSn3,tI10,107 I4mm 0.4524,0.4524,1.0274,90,90,90 - - 7.23 X 55025
Ba-Ge-Rh BaRh2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.4189,0.4189,1.1757,90,90,90 - - 7.86 X 28125
Ba-Ge-Ru BaRu2Ge2 CaRh2B2,oF40,70 Fddd 0.6344,1.0565,1.2731,90,90,90 - - 7.55 X 28125
Ba-Ge-S BaGe2S5 BaGe2S5,cF128,227 Fd-3m 1.4899,1.4899,1.4899,90,90,90 - orange 3.56 X 7610
Ba-Ge-S Ba2GeS4 K2[SO4],oP28,62 Pnma 0.896,0.689,1.223,90,90,90 - - 4.18 A 6128
Ba-Ge-Se Ba2Ge2Se5 Ba2Ge2Se5 ,oP36,62 Pnma 1.2594,0.9174,0.916,90,90,90 - red dark 5.11 X 37010
Ba-Ge-Si BaGeSi ht-hp SrSi2,cP12,213 P4132 0.6793,0.6793,0.6793,90,90,90 - - 5.04 A 13313
Ba-Ge-Si Ba3Ge2.1 Si1.9 Ba3Si4,tP28,136 P42 /mnm 0.8563,0.8563,1.1921,90,90,90 - - 4.69 X 42406
Ba-Ge-Si Ba3Ge3.7 Si0.3 Ba3Ge4,oS56,65 Cmmm 1.1755,1.2189,1.2064,90,90,90 - - 5.30 X 42406
Ba-Ge-Si Ba3.85 Ge1.55 Si21.35 Ba4Al3(Al0.25 Ge0.75)20,cP54,223 Pm-3n 1.0325,1.0325,1.0325,90,90,90 - gray silver 3.74 X 41984
Ba-Ge-Sn Ba3Sn0.06 Ge3.94 Ba3Ge4,oS56,65 Cmmm 1.1834,1.2229,1.2112,90,90,90 - black gray 5.34 X 39497
Ba-Ge-Sn Ba3Sn2.18 Ge2.82 Pu3Pd5,oS32,63 Cmcm 1.0652,0.8743,1.0761,90,90,90 - black gray 5.80 X 39497
Ba-Ge-Sn Ba6Sn1.68 Ge23.32 Ba6(In0.36 Ge0.64)11Ge14,cP136,213 P4132 1.47073,1.47073,1.47073,90,90,90 clathrate gray silver 5.67 X 37679
Ba-Ge-Sr Ba2.37 Sr0.63 Ge4 Ba3Si4,tP28,136 P42 /mnm 0.8536,0.8536,1.1804,90,90,90 - black 5.18 X 36745
Ba-Ge-Sr Ba2.62 Sr0.38 Ge4 Ba3Ge4,oS56,65 Cmmm 1.1773,1.2126,1.195,90,90,90 - black 5.32 X 36744
Ba-Ge-Te Ba2Ge2Te 5 Ba2Ge2Te5,oP36,33 Pna21 1.3397,0.9177,0.995,90,90,90 - gray 5.74 X 17625
Ba-Ge-Tl Ba5.2 Tl3.5 Ge18.3 Na4Si23,cP54,223 Pm-3n 1.455,1.455,1.455,90,90,90 clathrate - 2.97 A 25499
Ba-Ge-Zn BaZnGe BeZrSi,hP6,194 P63 /mmc 0.4457,0.4457,0.9655,90,90,120 AlB2 family - 5.50 X 24876
Ba-Ge-Zn BaZn2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.4527,0.4527,1.0555,90,90,90 - gray 6.35 X 32910
Ba-Ge-Zn Ba4ZnGe22 Ba4Ga2.22 Ge19.57 ,cP78,223 Pm-3n 1.06827,1.06827,1.06827,90,90,90 - - 6.03 X 48755
Ba-Ge-Zn Ba4Zn3Ge 20 Na4Si23,cP54,223 Pm-3n 1.07512,1.07512,1.07512,90,90,90 clathrate gray silver 5.87 X 48755
Ba-H-I BaIH PbClF,tP6,129 P4/nmm 0.4716,0.4716,0.7752,90,90,90 - colorless 5.11 X 16679
Ba-H-I Ba2IH3 Li3LaSb2,hP6,164 P-3m1 0.45186,0.45186,0.81184,90,90,120 - colorless 4.68 X 57492
Ba-H-In Ba9In4H Ba9In4H,tI28,87 I4/m 1.3973,1.3973,0.5918,90,90,90 - - 4.88 X 55427
Ba-H-Ir Ba3Ir2H12 Ba3Ir2H12,hP17,164 P-3m1 0.54865,0.54865,0.88459,90,90,120 - white 5.82 A 28794
Ba-H-Li LiBaH3 CaTiO3,cP5,221 Pm-3m 0.40228,0.40228,0.40228,90,90,90 perovskite family green pale 3.76 X 47631
Ba-H-Mg BaMgH4 LaNiH3.7 ,oS24,63 Cmcm 0.42109,1.37672,0.56984,90,90,90 - white 3.33 A 33195
Ba-H-Mg Ba2MgH6 [NH4]2SiF6,hP9,164 P-3m1 0.57257,0.57257,0.45148,90,90,120 - - 3.95 A 28372
Ba-H-Mg Ba2Mg3H10 Ba2Ni3F10 ,mS60,12 C12/m1 1.8014,0.5876,0.7879,90,111.93,90 - - 3.07 A 28842
Ba-H-Mg Ba6Mg7H26 Ba6Mg7H26 ,oI78,71 Immm 0.58258,1.19791,1.4905,90,90,90 - white 3.26 A 33156
Ba-H-N BaN0.5 H0.5 cub NaCl,cF8,225 Fm-3m 0.586,0.586,0.586,90,90,90 rocksalt family black 4.78 X 7292
Ba-H-N Ba[NH2]2 lt Ba[NH2]2,mS24,9 C1c1 0.8951,1.267,0.7037,90,123.5,90 - - 3.38 X 9437
Ba-H-N Ba[NH3]6 rt Eu[NH3]6,cI14,229 Im-3m 0.977,0.977,0.977,90,90,90 - - 0.85 A 5418
Handbook of Inorganic Substances – Edition 2015 : Data 313

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-H-N Ba2NH rhom Ba2NH,hR18,166 R-3m 0.40262,0.40262,2.0469,90,90,120 - - 5.02 X 29471


Ba-H-O Ba[OH]2 hp *,mP48,14 P121/c1 1.15202,0.76199,1.07239,90,109.187,90 - - 5.12 N 40713
Ba-H-O Ba[OH]2 ht Ba[OH]2,oP60,62 Pnma 1.10111,1.64994,0.70954,90,90,90 - - 4.41 A 40713
Ba-H-O Ba[OH]2 rt Ba[OH]2,mP24,14 P121/c1 0.67267,0.7855,1.09636,90,122.027,90 - - 4.63 X 40713
Ba-H-O Ba[OH]2[H2O] mon Ba[OH]2[H2O],mP8,11 P121/m1 0.6333,0.4184,0.7049,90,111.45,90 - - 3.62 X 19697
Ba-H-O Ba[OH]2[H2O] orth Sr[OH]2[H2O],oP8,26 Pmc21 0.38947,0.63657,0.69523,90,90,90 - - 3.65 X 21987
Ba-H-O Ba[OH]2[H2O]3 Ba[OH]2[H2O]3,oP24,62 Pnma 0.764,1.1403,0.5965,90,90,90 - - 2.88 X 23193
Ba-H-O Ba[OH]2[H2O]8 Ba[OH]2[H2O]8,mP44,14 P121/c1 0.9274,0.926,1.38402,90,122.497,90 - colorless 2.09 X 24262
Ba-H-O Ba[O2][H2O2] Ba[O2][H2O2],mP20,14 P121/c1 0.4132,0.9464,0.8308,90,98.58,90 - - 4.20 X 1092
Ba-H-O Ba[O2][H2O2][H2O]2 *,mP4,14 P121/c1 1.039,0.836,0.658,90,95.,90 - - 2.79 P 1091
Ba-H-O Ba[O2][H2O2]2 mon1 Sr[O2][H2O2]2-a,mS28,15 C12/c1 0.8454,0.6398,0.8084,90,96.53,90 - - 3.63 X 1091
Ba-H-O Ba[O2][H2O2]2 mon2 Sr[O2][H2O2]2-b,mS28,15 C12/c1 0.818,0.903,0.635,90,95.67,90 - - 3.38 X 1091
Ba-H-O Ba[O2][H2O2]2 orth Ba[O2][H2O2]2,oP56,61 Pbca 0.6407,0.8005,1.6837,90,90,90 - - 3.65 X 1091
Ba-H-Os Ba2OsH6 *,cF12,225 Fm-3m 0.8046,0.8046,0.8046,90,90,90 fluorite family - - P 25073
Ba-H-Pt Ba2PtH6 Ba2CuF6,oS36,64 Cmce 1.4468,0.60014,0.60014,90,90,90 - green 6.07 A 28371
Ba-H-Re BaReH9 BaReH9,hP22,194 P63/mmc 0.5287,0.5287,0.9323,90,90,120 - white 4.89 X 28687
Ba-H-Ru Ba2RuH6 *,cF12,225 Fm-3m 0.80283,0.80283,0.80283,90,90,90 fluorite family - - P 25073
Ba-H-Sb Ba5Sb3H0.7 CuHf5Sn3,hP18,193 P63/mcm 0.9977,0.9977,0.7727,90,90,120 AlB2 family - 5.25 X 46240
Ba-H-Si BaSiH3.4 *,oP*,62 Pnma 1.573,0.413,1.343,90,90,90 - - 3.86 N 53429
Ba-Hf-N BaHfN2 BaNiS2,tP8,129 P4/nmm 0.41279,0.41279,0.83816,90,90,90 - orange 8.00 X 34795
Ba-Hf-O BaHfO3 CaTiO3,cP5,221 Pm-3m 0.4171,0.4171,0.4171,90,90,90 perovskite family colorless 8.33 X 46585
Ba-Hf-O Ba2HfO4 K2NiF4,tI14,139 I4/mmm 0.419,0.419,1.25,90,90,90 high-Tc family - 7.83 A 17963
Ba-Hf-S BaHfS3 GdFeO3,oP20,62 Pnma 0.7002,0.9915,0.6995,90,90,90 perovskite family - 5.64 A 13008
Ba-Hf-S Ba2HfS4 K2NiF4,tI14,139 I4/mmm 0.48344,0.48344,1.5842,90,90,90 high-Tc family brown rust 5.22 X 25184
Ba-Hf-S Ba4Hf3S10 Ba4Zr3S10,oF68,69 Fmmm 0.6989,0.7022,3.5428,90,90,90 - orange 5.37 A 27690
Ba-Hf-S Ba5Hf4S13 Ba5Hf4S13,oF88,69 Fmmm 0.6977,0.7006,4.228,90,90,90 - brown dark 5.84 X 25966
Ba-Hf-S Ba6Hf5S16 Ba6Hf5S16,oF108,69 Fmmm 0.6987,0.7002,5.5205,90,90,90 - brown 5.48 X 25966
Ba-Hg-In BaHg0.92 In1.08 KHg2,oI12,74 Imma 0.5145,0.8373,0.8715,90,90,90 AlB2 family - 7.89 X 46425
Ba-Hg-In BaHg2.3 In1.7 BaAl4,tI10,139 I4/mmm 0.4742,0.4742,1.2287,90,90,90 - - 9.54 X 59760
Ba-Hg-In BaHg4.8 In1.2 BaHg6,oP28,62 Pnma 1.3523,0.51617,1.0443,90,90,90 - - 11.28 X 59624
Ba-Hg-In Ba3Hg10In La3Al11,oI28,71 Immm 0.51396,0.9938,1.5007,90,90,90 - - 10.97 X 59760
Ba-Hg-O BaHgO2 hex BaHgO2,hP24,182 P6322 0.69038,0.69038,1.197,90,90,120 - amber 7.46 X 23562
Ba-Hg-O BaHgO2 rhom CuFeO2,hR12,166 R-3m 0.41088,0.41088,1.93812,90,90,120 - - 6.50 X 32324
Ba-Hg-Pb BaHgPb KHg2,oI12,74 Imma 0.5194,0.8402,0.8779,90,90,90 AlB2 family - 9.45 A 27411
Ba-Hg-S BaHgS2 BaHgS2,oP16,26 Pmc21 0.4215,1.4388,0.7338,90,90,90 - red 6.00 X 14733
Ba-Hg-S Ba2HgS3 K2AgI3,oP24,62 Pnma 0.8931,0.4357,1.7257,90,90,90 - red 5.65 X 14737
Ba-Hg-Sn BaHgSn BeZrSi,hP6,194 P63/mmc 0.4862,0.4862,0.9721,90,90,120 AlB2 family - 7.62 X 27411
Ba-Hg-Tl BaTl2Hg2 BaTl2Hg2,tP20,136 P42/mnm 1.0606,1.0606,0.5159,90,90,90 - - 10.84 X 52408
Ba-Hg-Tl BaTl3.2 Hg0.8 EuIn4,mS20,12 C12/m1 1.223,0.5234,1.037,90,115.272,90 - gray silver 10.53 X 56311
Ba-Hg-Zn BaZn0.6 Hg3.4 Ba(Zn0.6 Hg0.4)Hg3,cI320,220 I-43d 2.0255,2.0255,2.0255,90,90,90 - - 10.98 X 59000
Ba-Hg-Zn Ba20 Zn5Hg99 Ba20 Zn5Hg99,cF496,216 F-43m 2.33233,2.33233,2.33233,90,90,90 - gray silver 12.01 X 59576
Ba-Hg-Zn Ba3ZnHg10 Ba3ZnHg10,oP28,59 Pmmn 0.7012,1.7069,0.6273,90,90,90 - - 10.98 X 59000
Ba-Ho-O BaHo 2O4 CaV2O4,oP28,62 Pnma 1.03946,0.34517,1.211,90,90,90 - colorless 8.12 X 46770
Ba-Ho-O Ba2Ho 2O5 rt *,t*18,* - 0.43711,0.43711,1.187,90,90,90 - white - N 26415
Ba-Ho-O Ba3Ho 4O9 ht Ba3Yb4O9,hR48,146 R3 0.60975,0.60975,2.51356,90,90,120 - yellow pale 7.48 X 24229
Ba-Ho-O Ba4Ho 2O7 ht1 *,tI28,139 I4/mmm 0.43607,0.43607,2.8681,90,90,90 - tan - N 26415
Ba-Ho-S BaHo 2S4 CaV2O4,oP28,62 Pnma 1.21979,0.40177,1.44346,90,90,90 - - 5.59 A 52663
Ba-Ho-S Ba3Ho 2S6 *,oP*,59 Pmmn 1.188,1.21,1.232,90,90,90 - - - N 45099
Ba-Ho-Te BaHo 2Te4 CaV2O4,oP28,62 Pnma 1.36211,0.44322,1.60959,90,90,90 - black 6.68 X 37351
Ba-I-K KBa2I5 U2PbSe5,mP32,14 P121/c1 1.03339,0.91789,1.46862,90,90.419,90 - - 4.52 A 32489
Ba-I-La BaLaI4 SrLaI4,mS24,15 C12/c1 1.03494,1.504,0.7414,90,122.145,90 - black 5.33 X 43984
Ba-I-O Ba[IO3]2 Ba[IO3]2,mS36,15 C12/c1 1.31352,0.7979,0.9036,90,131.267,90 - - 4.55 X 12997
Ba-I-O Ba2I2O K2ZnO2,oI20,72 Ibam 0.7472,1.39202,0.67812,90,90,90 - colorless 5.13 X 51644
Ba-I-O Ba4I6O Ba4Cl6O,hP22,186 P63mc 1.0838,1.0838,0.841,90,90,120 - colorless 5.15 X 38434
Ba-I-P Ba2PI NaFeO2,hR12,166 R-3m 0.4729,0.4729,2.469,90,90,120 rocksalt family brown red 4.51 A 11060
Ba-I-P Ba3P 3I2 Ba3P 3I2,oP32,62 Pnma 1.7195,0.4624,1.4272,90,90,90 - black 4.44 X 42375
Ba-I-P Ba4P 2.545 I0.363 Th3P 4,cI28,220 I-43d 0.9863,0.9863,0.9863,90,90,90 - black gray 4.67 A 11060
Ba-I-P Ba5P 5I3 Ba5P 5I3,mS52,12 C12/m1 4.2664,0.4563,0.9431,90,92.2,90 - black 4.43 X 42375
Ba-I-Pr Ba6Pr3I19 Ba6Pr3I19,mS112,15 C12/c1 1.6062,1.2571,2.2632,90,95.09,90 - black 5.34 X 45727
Ba-I-Rb RbBa2I5 U2PbSe5,mP32,14 P121/c1 1.037,0.92577,1.47451,90,90.356,90 - - 4.67 A 32489
Ba-I-Sb Ba2SbI NaFeO2,hR12,166 R-3m 0.50161,0.50161,2.45797,90,90,120 rocksalt family - 4.87 A 8090
Ba-I-Sb Ba3SbI3 Ca3PI3,cI56,214 I4132 1.42,1.42,1.42,90,90,90 - - 4.24 A 7331
Ba-I-Si Ba3SiI2 Na2PtO3,oF96,70 Fddd 1.0057,1.4064,2.9526,90,90,90 - - 4.41 X 37649
Ba-I-Sr Ba0.19 Sr0.81 I2 SrI2,oP24,61 Pbca 0.7957,1.5369,0.832,90,90,90 - - 4.58 A 17616
Ba-I-Sr Ba0.4 Sr0.6 I2 Fe2P,hP9,189 P-62m 0.9065,0.9065,0.5076,90,90,120 Fe2P family - 4.98 A 17616
Ba-I-Sr Ba0.61 Sr0.39 I2 PbCl2,oP12,62 Pnma 0.8812,0.5259,1.0527,90,90,90 - - 5.06 A 17616
Ba-I-Th Ba0.5 Th0.5 I3 Th0.5 Pb0.5I3,oS20,63 Cmcm 0.4685,1.376,1.0015,90,90,90 - - 5.82 A 28165
Ba-I-U BaUI6 rt UEuI6,mS32,9 C1c1 0.8845,1.3834,1.55754,90,105.293,90 - - 4.11 X 31059
Ba-I-U Ba0.5 U0.5 I3 hp Th0.5 Pb0.5I3,oS20,63 Cmcm 0.4627,1.369,0.995,90,90,90 - - 5.99 A 28165
Ba-In-Ir BaIrIn2 MgCuAl2,oS16,63 Cmcm 0.4433,1.1513,0.806,90,90,90 - gray silver 9.03 X 45839
Ba-In-Ir BaIrIn4 LaCoAl4,oP12,51 Pmma 0.8642,0.4396,0.7906,90,90,90 - - 8.72 X 50481
Ba-In-Ir Ba2Ir4In13 Ba2Ir4In13,oS76,36 Cmc21 0.44856,2.9052,1.3687,90,90,90 - - 9.45 X 50481
Ba-In-Li Li1.12 BaIn0.98 CaCu0.98 Al1.12 ,hP96,191 P6/mmm 1.7469,1.7469,1.06409,90,90,120 - - 4.56 X 54932
Ba-In-Li Li16.3 Ba15.3In17.8 Li33.3 Ba13.1 Ca3,hR888,167 R-3c 1.8894,1.8894,8.5289,90,90,120 - - 4.83 X 54932
Ba-In-Li Li2.1 BaIn1.9 Li4Ba,hP30,194 P63/mmc 1.041,1.041,0.8364,90,90,120 - - 4.70 X 54932
Ba-In-Mg BaMg1.79 In2.21 CeAl2Ga2,tI10,139 I4/mmm 0.48625,0.48625,1.2515,90,90,90 - - 4.88 X 48485
Ba-In-Mg BaMg5In3 BaMg2(Mg0.9 In0.1)3In3,oP36,62 Pnma 1.4325,0.48191,1.3687,90,90,90 - - 4.24 X 48405
Ba-In-N Ba19 In9N9 Ba19 In9N9,mS148,12 C12/m1 5.7334,0.79101,1.01991,90,97.237,90 - black 5.46 X 42617
314 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-In-N Ba6In4.78 N2.72 Ba6In4.78 N2.72 ,cF136,227 Fd-3m 1.5216,1.5216,1.5216,90,90,90 - black 5.32 X 44720
Ba-In-N Ba6In5N Sr6Ga5N,hR72,167 R-3c 0.8234,0.8234,4.412,90,90,120 - gray 5.43 X 44075
Ba-In-O BaInO2.5 ht2 CaTiO3,cP5,221 Pm-3m 0.42788,0.42788,0.42788,90,90,90 perovskite family black 6.19 X 40457
Ba-In-O BaIn12O19 BaFe12O19 ,hP66,194 P63 /mmc 0.634,0.634,2.54,90,90,120 magnetoplumbite family - 6.83 A 6263
Ba-In-O BaIn2O4 mon1 BaIn2O4,mP112,14 P121/c1 2.0792,0.5833,1.4432,90,110.02,90 - yellow 6.96 X 22409
Ba-In-O BaIn2O4 mon2 *,mP56,14 P121/c1 1.0417,0.5837,1.4486,90,110.05,90 - - - N 13661
Ba-In-O Ba11In6O3 Ba11In6O3 ,tI80,140 I4/mcm 1.5558,1.5558,1.1216,90,90,90 - gray silver 5.50 X 47599
Ba-In-O Ba2In2O5 ht1 Ba2In2O5,tI40,108 I4cm 0.60348,0.60348,1.70688,90,90,90 - - 6.24 X 40733
Ba-In-O Ba2In2O5 rt orth1 Ca2(Fe0.5 Al0.5)2O5,oI36,46 Ima2 1.67112,0.60956,0.59601,90,90,90 - - 6.39 X 27773
Ba-In-O Ba2In2O5 rt orth2 Sr2Fe2O5,oI44,74 Imma 0.59697,1.67903,0.60864,90,90,90 - - 6.36 X 40733
Ba-In-O Ba2In3O6.5 Ba2In3O6.5 ,oF52,42 Fmm2 0.59409,2.05944,0.59624,90,90,90 - - 6.58 X 50161
Ba-In-O Ba3In2O6 (Sr0.33 La0.67)3Cu2O6,tI22,139 I4/mmm 0.41925,0.41925,2.1689,90,90,90 high-Tc family - 6.43 X 23822
Ba-In-O Ba4In2O7 Ba4In2O7,tI28,139 I4/mmm 0.41752,0.41752,2.9483,90,90,90 - rose light 5.76 X 22983
Ba-In-O Ba4In3O8.5 Sr4Ti3O10,tI34,139 I4/mmm 0.41725,0.41725,3.0487,90,90,90 Ruddlesden-Popper brown 6.44 X 23498
Ba-In-O Ba4In6O13 ht *,mP92,11 P121/m1 1.5187,0.41867,2.28339,90,102.529,90 - - - N 16486
Ba-In-O Ba4In6O13 rt Sr4Fe6O13 ,oI92,45 Iba2 1.146,2.095,0.5944,90,90,90 - yellow 6.73 X 26486
Ba-In-P BaIn2P 2 BaIn2P 2,mP20,11 P121/m1 0.99652,0.41789,1.29834,90,95.326,90 - black 5.29 X 51703
Ba-In-P Ba14InP 11 Ba14InP 11,tI232,142 I41/acd 1.7097,1.7097,2.294,90,90,90 - - 4.71 X 31484
Ba-In-P Ba2In5P 5 Ba2In5P 5,oP48,62 Pnma 1.7257,0.41599,1.749,90,90,90 - gray silver 5.31 X 50175
Ba-In-P Ba3In2P 4 Ca3Al2As4 ,mS36,15 C12/c1 1.3974,1.0869,0.7064,90,89.73,90 - - 4.74 X 35302
Ba-In-Pb Ba3In0.6 Pb4.4 Pu3Pd5,oS32,63 Cmcm 1.1186,0.9044,1.1339,90,90,90 - gray silver 8.06 X 47577
Ba-In-Pd BaPdIn2 MgCuAl2,oS16,63 Cmcm 0.45739,1.1534,0.8034,90,90,90 - gray light 7.42 A 38519
Ba-In-Pt BaPtIn2 MgCuAl2,oS16,63 Cmcm 0.45206,1.1624,0.8015,90,90,90 - gray light 8.86 X 38519
Ba-In-Pt BaPtIn3 BaAl4,tI10,139 I4/mmm 0.4813,0.4813,1.1669,90,90,90 - - 8.32 X 49610
Ba-In-Rh BaRhIn2 MgCuAl2,oS16,63 Cmcm 0.44768,1.1311,0.8056,90,90,90 - gray light 7.65 X 38519
Ba-In-S BaIn2S4 EuGa2S4,oF224,70 Fddd 1.3125,2.167,2.1824,90,90,90 - red brown 4.24 X 16533
Ba-In-S Ba12In4S19 Ba12In4S19 ,hR216,148 R-3 0.96182,0.96182,7.5393,90,90,120 - yellow 4.48 X 56355
Ba-In-S Ba2InS4 Ba2InS4,aP28,2 P-1 0.6236,1.0014,1.3033,104.236,90.412,91.052 - yellow 4.36 X 56355
Ba-In-S Ba2In2S5 Ga2Pb2S5,oP72,61 Pbca 1.1784,1.3167,1.2723,90,90,90 - yellow 4.47 X 24138
Ba-In-Sb BaIn2Sb4 rt BaIn2Sb4,oP28,62 Pnma 1.0166,0.45239,1.9495,90,90,90 - black 6.33 X 35649
Ba-In-Sb Ba0.875 InSb Eu0.875 GaSb,hP24,194 P63 /mmc 0.48274,0.48274,1.8421,90,90,120 - gray 6.37 X 54111
Ba-In-Sb Ba5In2Sb6 Ca5Ga2As6,oP26,55 Pbam 1.3358,1.5307,0.4786,90,90,90 - gray light 5.59 X 22028
Ba-In-Se BaIn2Se4 EuGa2S4,oF224,70 Fddd 1.3576,2.2479,2.271,90,90,90 - orange 5.24 X 12705
Ba-In-Se Ba2In2Se5 Ga2Pb2S5,oP72,61 Pbca 1.2225,1.3657,1.3182,90,90,90 - yellow 5.43 X 24138
Ba-In-Si Ba3In0.1 Si4.9 Pu3Pd5,oS32,63 Cmcm 1.0178,0.8525,1.0201,90,90,90 - - 4.21 X 54542
Ba-In-Sn BaIn0.2 Sn2.8 Mg3Cd,hP8,194 P63 /mmc 0.72604,0.72604,0.5382,90,90,120 close-packed structure gray silver 6.66 X 56021
Ba-In-Sn Ba3In0.9 Sn4.1 Pu3Pd5,oS32,63 Cmcm 1.1105,0.9,1.1207,90,90,90 - - 5.94 X 54542
Ba-In-Te BaIn2 Te4 SrAl2Se4,oS28,66 Cccm 0.7127,1.2044,1.2112,90,90,90 - red garnet 5.61 X 15552
Ba-In-Te Ba0.5 InTe2 Sr0.5 AlTe2 ,tI16,140 I4/mcm 0.844,0.844,0.72,90,90,90 - gray silver 5.68 X 7074
Ba-In-Tl BaTl0.63 In3.33 BaAl4,tI10,139 I4/mmm 0.50196,0.50196,1.19,90,90,90 - - 7.18 X 49610
Ba-In-Zn BaZn0.79 In3.21 CeAl2Ga2,tI10,139 I4/mmm 0.47827,0.47827,1.2007,90,90,90 - - 6.74 X 48485
Ba-Ir-O BaIrO3 cub CaTiO3,cP5,221 Pm-3m 0.40611,0.40611,0.40611,90,90,90 perovskite family - 9.36 X 52402
Ba-Ir-O BaIrO3 ht1 BaRuO3,hR45,166 R-3m 0.5777,0.5777,2.2,90,90,120 perovskite family - 8.87 A 24878
Ba-Ir-O BaIrO3 ht2 BaNiO3,hP10,194 P63 /mmc 0.5732,0.5732,0.5246,90,90,120 perovskite family - 8.40 A 17133
Ba-Ir-O BaIrO3 rt BaIrO3,mS60,15 C12/c1 0.57483,0.9939,1.43582,90,91.319,90 perovskite family black 9.17 X 52402
Ba-Ir-O Ba2IrO4 K2NiF4,tI14,139 I4/mmm 0.403,0.403,1.3333,90,90,90 high-Tc family black 8.14 X 57153
Ba-Ir-O Ba2Ir3O9 Ba2Ir3O9,cI56,197 I23 0.942,0.942,0.942,90,90,90 - black 7.91 X 43191
Ba-Ir-O Ba4Ir3O10 mon Ba4Ir3O10,mP34,14 P121/c1 0.7242,1.3222,0.5788,90,112.98,90 - black 8.37 X 25488
Ba-Ir-O Ba4Ir3O10 orth Cs4Mg3F10 ,oS68,64 Cmce 0.578,1.3339,1.3216,90,90,90 - - 8.38 X 40179
Ba-Ir-O Ba7Ir6O19 Ba7Ir6O19,mS64,12 C12/m1 1.4913,0.5778,1.0979,90,99.58,90 - black 8.61 X 22659
Ba-Ir-P BaIrP ZrSO,cP12,198 P213 0.6531,0.6531,0.6531,90,90,90 - gray 8.60 X 27444
Ba-Ir-P BaIr2P 2 Cu2TlSe2,tI10,139 I4/mmm 0.3946,0.3946,1.2572,90,90,90 - - 9.90 X 40853
Ba-Ir-Si BaIr2Si2 BaRh2Si2,mP20,14 P121/c1 0.79247,0.66428,0.77222,90,91.181,90 - gray 9.45 X 33761
Ba-K-P KBa4P 5 KBa4P 5,tP60,92 P41212 0.8559,0.8559,1.6102,90,90,90 - - 4.19 X 42331
Ba-K-Sb K2Ba3Sb4 Sm5Ge4,oP36,62 Pnma 0.8705,1.7702,0.9236,90,90,90 - black 4.56 X 36566
Ba-K-Si K1.45 Ba2.45 Si23 Na4Si23,cP54,223 Pm-3n 1.0273,1.0273,1.0273,90,90,90 clathrate - 3.18 X 30037
Ba-La-O BaLa2O4 CaV2O4,oP28,62 Pnma 1.0675,0.3705,1.2662,90,90,90 - colorless 6.36 A 7413
Ba-La-O Ba0.075La1.925 O2.9625 La2O3,hP5,164 P-3m1 0.3965,0.3965,0.6185,90,90,120 - - 6.41 A 1418
Ba-La-S Ba0.86 La0.09 S NaCl,cF8,225 Fm-3m 0.638,0.638,0.638,90,90,90 rocksalt family - 4.16 X 25330
Ba-La-S Ba0.87 La2.13 S4 ht Th3P 4,cI28,220 I-43d 0.89,0.89,0.89,90,90,90 - - 5.12 A 25330
Ba-La-Se BaLa2Se4 Th3P 4,cI28,220 I-43d 0.9258,0.9258,0.9258,90,90,90 - - 6.12 A 2169
Ba-Li-N LiBaN *,hP15,* - 0.6797,0.6797,0.805,90,90,120 - black 4.08 N 5185
Ba-Li-N LiBa2N LiBa2N,tP32,137 P42 /nmc 0.798,0.798,1.4263,90,90,90 - - 4.32 X 48976
Ba-Li-N LiBa3N BaNiO3,hP10,194 P63 /mmc 0.8182,0.8182,0.6922,90,90,120 perovskite family - 3.58 A 48976
Ba-Li-N Li80Ba39N9 Li80Ba39N9,tI256,121 I-42m 1.60673,1.60673,3.2267,90,90,90 - - 2.41 X 46407
Ba-Li-Na Na29Li13Ba19 rt Na29Li13Ba19,cF488,216 F-43m 2.7335,2.7335,2.7335,90,90,90 - gray silver 2.19 X 45901
Ba-Li-Na Na8.3 Li18.9 Ba15.3 Na8.3 Li18.9 Ba15.3 ,hP842,147 P-3 2.042,2.042,9.2914,90,90,120 - - 2.16 X 49067
Ba-Li-P LiBaP BeZrSi,hP6,194 P63 /mmc 0.45003,0.45003,0.86049,90,90,120 AlB2 family red 3.86 X 49088
Ba-Li-Sb LiBaSb BeZrSi,hP6,194 P63 /mmc 0.48982,0.48982,0.9014,90,90,120 AlB2 family gray light 4.72 X 38423
Ba-Li-Sb Li4Ba3Sb4 Cu4Gd3Ge4,oI22,71 Immm 0.491,0.77,1.718,90,90,90 - gray 4.74 A 5613
Ba-Li-Si LiBaSi LiBaSi,hP3,187 P-6m2 0.438,0.438,0.485,90,90,120 AlB2 family gray 3.55 X 4321
Ba-Li-Si LiBa2Si3 LiSr2Si3,oF96,70 Fddd 0.8726,1.5174,1.9322,90,90,90 - - 3.80 X 31310
Ba-Li-Si Li2BaSi Li2BaSi,oP8,59 Pmmn 0.474,0.675,0.625,90,90,90 - - 2.98 X 3776
Ba-Li-Sn Li4Ba3Sn8 Li4Ba3Sn8 ,mS30,12 C12/m1 1.8549,0.6685,0.6792,90,98.34,90 - - 5.54 X 40195
Ba-Lu-O Ba3Lu4O9 Ba3Yb4O9 ,hR48,146 R3 0.603,0.603,2.4753,90,90,120 - colorless 8.03 X 17592
Ba-Lu-S BaLu2S4 CaV2O4,oP28,62 Pnma 1.21143,0.39556,1.42781,90,90,90 - colorless 5.98 X 56030
Ba-Lu-S BaLu8S13 ht *,oP*,34 Pnn2 1.033,1.196,1.4,90,90,90 - - - N 35074
Ba-Lu-S Ba3Lu2S6 *,oP*,59 Pmmn 1.183,1.204,1.228,90,90,90 - - - N 45099
Handbook of Inorganic Substances – Edition 2015 : Data 315

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Lu-Se BaLu2Se4 CaV2O4,oP28,62 Pnma 1.26132,0.41089,1.48774,90,90,90 - red dark 6.92 X 56030


Ba-Lu-Te BaLu2 Te4 CaV2O4,oP28,62 Pnma 1.35358,0.43847,1.59362,90,90,90 - black 7.01 X 56030
Ba-Mg-P BaMg2P 2 Ce2SO2,hP5,164 P-3m1 0.4367,0.4367,0.758,90,90,120 - - 3.29 X 17679
Ba-Mg-Pb BaMgPb MnAlGe,tP6,129 P4/nmm 0.49,0.49,0.826,90,90,90 - gray silver 6.18 A 7050
Ba-Mg-Pb BaMg2Pb2 CaBe2Ge2,tP10,129 P4/nmm 0.5,0.5,1.211,90,90,90 - - 6.59 X 8604
Ba-Mg-Sb BaMg2Sb2 Ce2SO2,hP5,164 P-3m1 0.477,0.477,0.81,90,90,120 - gray silver 4.47 X 11115
Ba-Mg-Si BaMgSi MnAlGe,tP6,129 P4/nmm 0.461,0.461,0.787,90,90,90 - gray silver 3.77 X 7050
Ba-Mg-Si BaMg2Si2 CeAl2Ga2,tI10,139 I4/mmm 0.465,0.465,1.109,90,90,90 - - 3.35 X 8604
Ba-Mg-Si BaMg4Si3 rt BaMg4Si3,tP8,123 P4/mmm 0.46115,0.46115,0.8615,90,90,90 - black 2.89 X 35763
Ba-Mg-Si Ba2Mg3Si4 rt Ba2Mg3Si4,mS36,12 C12/m1 1.2063,0.4619,1.5616,90,94.95,90 - - 3.52 X 35165
Ba-Mg-Si Ba5Mg18Si13 Ho5Ni19P 12,hP36,189 P-62m 1.4606,1.4606,0.44818,90,90,120 - - 2.99 X 35612
Ba-Mg-Sn BaMgSn MnAlGe,tP6,129 P4/nmm 0.487,0.487,0.814,90,90,90 - gray silver 4.82 A 7050
Ba-Mg-Sn BaMg2Sn2 BaMg2Sn2,tP20,129 P4/nmm 0.489,0.489,2.42,90,90,90 - - 4.86 X 8604
Ba-Mn-N Ba3MnN3 Ba3FeN3,hP14,176 P63/m 0.805,0.805,0.5586,90,90,120 - black 5.39 X 28363
Ba-Mn-O BaMnO2 BaMnO2,oP64,62 Pnma 1.0375,0.9466,1.1276,90,90,90 - - 5.38 X 52366
Ba-Mn-O BaMnO2.65 ht5 BaMnO3,hP20,194 P63/mmc 0.56833,0.56833,0.93556,90,90,120 perovskite family black 5.96 X 47117
Ba-Mn-O BaMnO2.91 ht4 BaMnO3,hP50,194 P63/mmc 0.56547,0.56547,2.31936,90,90,120 perovskite family black 6.17 X 48240
Ba-Mn-O BaMnO2.92 BaMnO2.85 ,hP30,187 P-6m2 0.56623,0.56623,1.39993,90,90,120 perovskite family - 6.13 X 48240
Ba-Mn-O BaMnO2.984 ht3 BaTiO3,hP30,194 P63/mmc 0.5674,0.5674,1.4056,90,90,120 perovskite family black 6.10 A 7549
Ba-Mn-O BaMnO2.99 ht1 BaMnO3,hR75,166 R-3m 0.56662,0.56662,3.5276,90,90,120 perovskite family black 6.10 X 56626
Ba-Mn-O BaMnO3 hp-ht BaRuO3,hR45,166 R-3m 0.5663,0.5663,2.0955,90,90,120 perovskite family black 6.17 X 33595
Ba-Mn-O BaMnO3 ht2 BaMnO3,hP40,194 P63/mmc 0.5667,0.5667,1.8738,90,90,120 perovskite family black 6.12 X 7613
Ba-Mn-O BaMnO3 lt KNiCl3,hP30,185 P63cm 0.98467,0.98467,0.48075,90,90,120 perovskite family - 5.93 X 37072
Ba-Mn-O BaMnO3 rt BaNiO3,hP10,194 P63/mmc 0.56991,0.56991,0.48148,90,90,120 perovskite family green 5.89 X 37072
Ba-Mn-O BaMn2O3 lt BaMn2O3,mS12,12 C12/m1 0.56206,1.09615,0.35379,90,128.82,90 - blackish 5.77 X 57125
Ba-Mn-O BaMn2O3 rt BaMn2O3,oI12,71 Immm 0.35549,0.43834,1.09751,90,90,90 - blackish 5.73 X 57125
Ba-Mn-O BaMn3O6 BaMn3O5[OH],mS40,12 C12/m1 1.9537,0.4529,0.5583,90,98.19,90 - black 5.41 X 38798
Ba-Mn-O BaMn4O8 rt *,mS26,12 C12/m1 1.38616,0.29,0.98,90,132.436,90 hollandite black - N 29050
Ba-Mn-O Ba[MnO4] Ba[SO4],oP24,62 Pnma 0.9065,0.5472,0.7304,90,90,90 - - 4.70 A 1252
Ba-Mn-O Ba[MnO4]2 Ba[MnO4]2,oF88,70 Fddd 0.7414,1.1896,1.4749,90,90,90 - violet 3.83 X 5869
Ba-Mn-O Ba0.3 Mn2O4 Ba0.3 (Ti0.7 Ga0.3)2O4,mS28,12 C12/m1 1.40077,0.28579,0.97627,90,134.143,90 - - 5.09 X 46771
Ba-Mn-O Ba2MnO3 Ba2MnO3,mS48,9 C1c1 0.5846,1.1579,1.2707,90,93.74,90 - red dark 5.84 X 14706
Ba-Mn-O Ba3MnO5 Cs3CoCl5,tI36,140 I4/mcm 0.725,0.725,1.189,90,90,90 - - 5.81 A 2847
Ba-Mn-O Ba3Mn12O24 Ba3Mn12O24,tI82,87 I4/m 1.8173,1.8173,0.2836,90,90,90 - - 5.16 X 33477
Ba-Mn-O Ba3[MnO4]2 Ba3[PO4]2,hR39,166 R-3m 0.57107,0.57107,2.14438,90,90,120 - green dark 5.35 X 35443
Ba-Mn-O Ba4Mn3O10 Cs4Mg3F10,oS68,64 Cmce 0.5685,1.31284,1.27327,90,90,90 - - 6.11 X 40537
Ba-Mn-O Ba6Mn5O16 Cs6Ni5F16,oS108,64 Cmce 0.5723,1.32223,1.99733,90,90,90 - - 5.95 X 43740
Ba-Mn-P BaMn2P 2 CeAl2Ga2,tI10,139 I4/mmm 0.4037,0.4037,1.3052,90,90,90 - gray steel 4.83 X 29178
Ba-Mn-S BaMnS2 SrZnO2,oP16,62 Pnma 0.7,0.4144,1.4,90,90,90 - orange 4.19 X 7824
Ba-Mn-S Ba2MnS3 K2AgI3,oP24,62 Pnma 0.8814,0.4302,1.7048,90,90,90 - orange red 4.38 X 5945
Ba-Mn-Sb BaMnSb2 SrZnBi2,tI16,139 I4/mmm 0.453,0.453,2.434,90,90,90 - gray steel 5.80 X 11112
Ba-Mn-Sb BaMn2Sb2 Cu2TlSe 2,tI10,139 I4/mmm 0.4412,0.4412,1.4414,90,90,90 - gray 5.81 X 50280
Ba-Mn-Sb Ba14 MnSb11 Ca14 AlSb11,tI208,142 I41/acd 1.8394,1.8394,2.4069,90,90,90 - - 5.41 A 28583
Ba-Mn-Se Ba2MnSe 3 K2AgI3,oP24,62 Pnma 0.9135,0.4471,1.7736,90,90,90 - orange red 5.19 X 5945
Ba-Mn-Sn BaMn2Sn2 CeAl2Ga2,tI10,139 I4/mmm 0.474,0.474,1.184,90,90,90 - - 6.05 X 10313
Ba-Mn-Te Ba2MnTe 3 K2AgI3,oP24,62 Pnma 0.972,0.473,1.898,90,90,90 - orange red 5.42 X 11121
Ba-Mo-N Ba3MoN4 ht Ba3MoN4,hP144,159 P31c 1.8441,1.8441,1.0401,90,90,120 - yellow 5.50 X 38310
Ba-Mo-N Ba3MoN4 rt Ba3MoN4,oP64,61 Pbca 1.0303,1.2029,1.0839,90,90,90 - reddish 5.58 X 25714
Ba-Mo-O BaMoO3 CaTiO3,cP5,221 Pm-3m 0.40416,0.40416,0.40416,90,90,90 perovskite family red 7.07 X 52501
Ba-Mo-O BaMoO4 hp1 LaNbO4,mS24,15 C12/c1 0.75873,1.2397,0.526,90,134.357,90 - - 5.58 X 46773
Ba-Mo-O BaMoO4 hp2 *,mP*,13 P12/c1 0.6396,0.6727,0.3098,90,100.176,90 - - - N 46773
Ba-Mo-O BaMo 3O10 BaMo 3O10,mP56,4 P1211 0.69618,0.75704,1.4695,90,100.381,90 - - 5.10 X 33877
Ba-Mo-O BaMo 6O10 BaMo 6O10,oP68,62 Pnma 1.0154,0.8641,0.9184,90,90,90 - black 7.20 X 21572
Ba-Mo-O Ba[MoO4] rt Ca[WO4],tI24,88 I41/a 0.55479,0.55479,1.2743,90,90,90 - - 5.03 X 36239
Ba-Mo-O Ba0.57 Mo4O8 Ba0.57 Mo4O8,tI190,79 I4 1.0216,1.0216,2.02449,90,90,90 - black 6.49 X 38799
Ba-Mo-O Ba0.62 Mo4O6 Ba0.62 Mo4O6,oP174,55 Pbam 0.9517,0.9822,2.2813,90,90,90 - - 7.04 X 19070
Ba-Mo-O Ba1.13 Mo8O16 *,aP*,2 P-1 0.5726,0.7311,0.7453,89.31,78.51,80.4 - - 6.49 N 14392
Ba-Mo-O Ba2MoO5 *,oP32,62 Pnma 0.7412,0.5769,1.138,90,90,90 - - - N 8522
Ba-Mo-O Ba3MoO6 [NH4]3FeF6,cF40,225 Fm-3m 0.86,0.86,0.86,90,90,90 perovskite family - 6.31 X 5175
Ba-Mo-O Ba3Mo 18O28 Ba3Mo 18O28,mP100,14 P121/c1 1.3057,0.9377,0.9939,90,100.92,90 - black 7.19 X 28657
Ba-Mo-S BaMo 6S8 lt rhom Mo6PbS8,hR45,148 R-3 0.92775,0.92775,1.17932,90,90,120 Chevrel phase - 5.49 X 23156
Ba-Mo-S BaMo 6S8 lt tricl BaMo 6S8,aP15,2 P-1 0.65896,0.665,0.66899,88.731,88.818,88.059 Chevrel phase - 5.50 X 23156
Ba-Mo-S Ba2Mo 6S9 ht Ba2Mo 6S9,hP70,194 P63/mmc 1.06985,1.06985,1.42264,90,90,120 Chevrel phase black 5.36 X 44159
Ba-Mo-Se BaMo 3Se3 TlFe 3Te3,hP14,176 P63/m 0.906,0.906,0.429,90,90,120 Chevrel phase - 7.21 A 18228
Ba-Mo-Se Ba2Mo 15Se19 Mo15 In2Se19,hR216,167 R-3c 0.98109,0.98109,5.75715,90,90,120 Chevrel phase - 6.67 X 22055
Ba-Mo-Te BaMo 3Te3 TlFe 3Te3,hP14,176 P63/m 0.941,0.941,0.457,90,90,120 Chevrel phase - 7.66 A 18228
Ba-N-Na NaBa3N BaNiO3,hP10,194 P63/mmc 0.84414,0.84414,0.69817,90,90,120 perovskite family black 3.46 X 25839
Ba-N-Na Na16 Ba6N Dy6Fe16O,cI46,229 Im-3m 1.25266,1.25266,1.25266,90,90,90 - - 2.04 X 28500
Ba-N-Nb Ba16 Nb5N19 Ba16 Nb5N19,aP80,2 P-1 1.09933,1.14041,1.43307,104.036,101.555,97.757 - orange 5.80 X 39678
Ba-N-Nb Ba2NbN3 Ba2ZnO3,mS48,15 C12/c1 0.6132,1.1768,1.3229,90,91.65,90 - - 5.70 X 29552
Ba-N-Nb Ba5NbN5 Ba5NbN5,mS48,12 C12/m1 1.2317,1.0946,0.8538,90,113.65,90 - orange 5.35 X 43209
Ba-N-Nb Ba9Nb2N9[N3] Ba9Ta2N9[N3],aP46,2 P-1 0.7998,0.9627,1.2644,75.867,85.69,87.87 - red 5.61 X 33917
Ba-N-Ni BaNiN BaNiN,oP36,62 Pnma 0.9639,1.3674,0.5432,90,90,90 - - 5.85 X 23530
Ba-N-Ni Ba2Ni3N2 Ba2Ni3N2,oS32,64 Cmce 0.71527,1.03299,0.74012,90,90,90 - black 5.82 X 46161
Ba-N-Ni Ba8Ni6N7 Ba8Ni6N7,mS84,15 C12/c1 0.9487,1.6578,1.2137,90,107.05,90 - brown 5.64 X 24832
Ba-N-O Ba[NO2]2 rt Ba[NO2]2,oP28,19 P212121 0.67336,0.76331,0.83671,90,90,90 - - 3.54 X 19733
Ba-N-O Ba[NO3]2 Ba[NO3]2,cP36,198 P213 0.811,0.811,0.811,90,90,90 nitrobarite - 3.25 X 3781
Ba-N-Os Ba9Os3N10 *,o*132,* - 0.808,1.088,2.98,90,90,90 - - - N 3062
316 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-N-P BaP 2N4 ht-hp CaB2O4,cP84,205 Pa-3 1.02299,1.02299,1.02299,90,90,90 - colorless 4.75 X 45122
Ba-N-Pb Ba3PbN0.826 CaTiO3,cP5,221 Pm-3m 0.5544,0.5544,0.5544,90,90,90 perovskite family - 6.15 X 45728
Ba-N-Rb RbBa2[N3 ]5 RbBa2[N3]5,mP36,13 P12/c1 0.86681,0.56287,1.45634,90,126.327,90 - colorless 3.31 X 45941
Ba-N-Re Ba9Re3N10 *,o*132,* - 0.809,1.094,3.04,90,90,90 - - - N 3062
Ba-N-Sb Ba3SbN BaNiO3,hP10,194 P63 /mmc 0.75336,0.75336,0.66431,90,90,120 perovskite family black 5.57 X 43975
Ba-N-Si BaSiN2 BaSiN2,oS32,64 Cmce 0.56046,1.13605,0.75851,90,90,90 - colorless 5.32 X 42985
Ba-N-Si BaSi6N8 SrSi6N8,oI30,44 Imm2 0.79316,0.93437,0.48357,90,90,90 - - 3.87 X 49642
Ba-N-Si BaSi7N10 rt BaSi7N10,mP36,7 P1c1 0.68729,0.67129,0.96328,90,106.269,90 - colorless 3.69 X 32896
Ba-N-Si Ba2Si5N8 Sr2Si5N8,oP30,31 Pmn21 0.5783,0.6959,0.9391,90,90,90 - colorless 4.63 X 31040
Ba-N-Si Ba5Si2N6 Ba5Si2N6,oP52,19 P212121 0.6159,1.0305,1.5292,90,90,90 - brown 5.66 X 31769
Ba-N-Sn Ba3SnN0.64 CaTiO3,cP5,221 Pm-3m 0.55292,0.55292,0.55292,90,90,90 perovskite family - 5.30 X 45728
Ba-N-Sr Ba1.04 Sr0.96 N CdCl2,hR9,166 R-3m 0.3934,0.3934,2.1415,90,90,120 - black 4.18 X 40790
Ba-N-Ta Ba2TaN3 Ba2ZnO3,mS48,15 C12/c1 0.613,1.1815,1.3263,90,91.1,90 - yellow 6.88 X 28331
Ba-N-Ta Ba9Ta2N9 [N3] Ba9Ta2N9[N3],aP46,2 P-1 0.8012,0.9647,1.2655,75.86,85.78,87.55 - black 6.20 X 27096
Ba-N-Th BaThN2 Cr2AlC,hP8,194 P63 /mmc 0.37523,0.37523,1.2858,90,90,120 - black 8.42 X 34809
Ba-N-Ti Ba5Ti2N6 Ba5Ti2N6,aP26,2 P-1 0.6443,0.9429,0.9669,106.37,102.22,108.56 - orange red 5.71 X 31106
Ba-N-V Ba2VN3 Rb2TiO3,oS48,64 Cmce 0.58614,1.14682,1.29121,90,90,90 - brown 5.63 X 30086
Ba-N-W Ba3WN4 ht Ba3MoN4,hP144,159 P31c 1.8473,1.8473,1.0427,90,90,120 - orange 6.32 X 38311
Ba-N-W Ba3WN4 rt Ba3MoN4,oP64,61 Pbca 1.0375,1.2092,1.0918,90,90,90 - yellow pale 6.32 X 25714
Ba-N-Zn Ba2ZnN2 Na2HgO2,tI10,139 I4/mmm 0.4152,0.4152,1.3055,90,90,90 - - 5.43 X 30693
Ba-N-Zr BaZrN2 BaNiS2,tP8,129 P4/nmm 0.4161,0.4161,0.8392,90,90,90 - red deep 5.86 X 29552
Ba-Na-O NaBa2O NaBa2O,oS16,67 Cmme 0.65907,1.5327,0.69385,90,90,90 - - 2.97 X 38364
Ba-Na-P NaBaP Fe2P,hP9,189 P-62m 0.794,0.794,0.4676,90,90,120 Fe2P family black 3.73 X 32516
Ba-Na-Pb Na8BaPb6 Na8BaPb6 ,mP34,11 P121/m1 1.3116,0.5351,1.6166,90,108.07,90 - black 4.82 X 43012
Ba-Na-Sb Na2Ba3Sb4 Na2Sr3P4,oP36,62 Pnma 0.822,1.7136,0.914,90,90,90 - black 4.88 X 39222
Ba-Na-Si NaBa3Si23 K3Eu(Ga0.22 Ge0.78)23,cP54,223 Pm-3n 1.0275,1.0275,1.0275,90,90,90 clathrate gray silver 3.31 X 49720
Ba-Na-Si Na2BaSi4 Na2BaSi4,oI56,46 Ima2 0.9524,1.798,0.857,90,90,90 - black 2.68 X 36525
Ba-Na-Sn Na51Ba4Sn77.5 Na51Ba4Sn77.5 ,cF732,216 F-43m 2.52041,2.52041,2.52041,90,90,90 - - 4.53 X 40109
Ba-Na-Sn Na8BaSn6 Na8BaPb6 ,mP34,11 P121/m1 1.2897,0.5362,1.5826,90,108.19,90 - black 3.30 X 43012
Ba-Nb-O BaNbO3 CaTiO3,cP5,221 Pm-3m 0.40899,0.40899,0.40899,90,90,90 perovskite family purple red 6.75 X 30781
Ba-Nb-O BaNb2O6 ht orth BaNb2O6,oS72,20 C222 1 0.788,1.2215,1.0292,90,90,90 - - 5.62 X 23991
Ba-Nb-O BaNb2O6 rt mon BaNb2O6,mP18,14 P121/c1 0.3952,0.6049,1.0434,90,90.35,90 - - 5.58 X 24038
Ba-Nb-O BaNb2O6 rt orth BaNb2O6,oP18,51 Pmma 1.0461,0.3946,0.603,90,90,90 - yellow 5.59 X 4195
Ba-Nb-O BaNb3O6 BaNb3O6,hR30,160 R3m 1.14333,1.14333,0.34949,90,90,120 - black 6.45 X 29735
Ba-Nb-O BaNb4O11 *,oP*,59 Pmmn 1.7592,1.7676,0.39824,90,90,90 - - - N 40257
Ba-Nb-O BaNb4O6 BaNb4O6,tP11,123 P4/mmm 0.4182,0.4182,0.8212,90,90,90 - - 6.99 X 24752
Ba-Nb-O BaNb5O8 BaNb5O8,tP14,83 P4/m 0.6608,0.6608,0.4107,90,90,90 - - 6.76 X 24055
Ba-Nb-O BaNb6O16 *,oP*,32 Pba2 1.2479,3.7399,0.39778,90,90,90 - - - N 40257
Ba-Nb-O BaNb7O9 BaNb7O9,tP17,123 P4/mmm 0.4195,0.4195,1.2426,90,90,90 - black 7.08 X 25843
Ba-Nb-O BaNb8O14 orth1 BaNb8O14 ,oP184,61 Pbca 0.94222,2.3716,1.03649,90,90,90 - blue 6.34 X 24564
Ba-Nb-O BaNb8O14 orth2 SrNb8O14,oP46,55 Pbam 0.93451,1.02689,0.5947,90,90,90 - - 6.43 X 30268
Ba-Nb-O BaNb8O14 orth3 BaNb8O14 ,oS192,64 Cmce 2.38,1.033,0.9325,90,90,90 - - 6.40 X 22413
Ba-Nb-O Ba0.9 Nb2O5.9 ht hex BaTa2O6,hP108,191 P6/mmm 2.1044,2.1044,0.39787,90,90,120 - - 5.27 A 40257
Ba-Nb-O Ba0.93 Nb2.03 O6 Ba0.93 Nb2.03 O6,hP154,191 P6/mmm 2.10174,2.10174,0.39732,90,90,120 - colorless 5.41 X 49017
Ba-Nb-O Ba1.5 Nb0.5 O3 GdFeO3,oP20,62 Pnma 0.6273,0.85,0.6094,90,90,90 perovskite family - 6.14 A 15532
Ba-Nb-O Ba14.67 Nb7.33 O33 rhom *,hR165,* - 0.5922,0.5922,9.325,90,90,120 - white - N 14692
Ba-Nb-O Ba2Nb15O32 Ba2Nb15O32,hR147,148 R-3 0.7777,0.7777,3.5518,90,90,120 - golden 5.84 X 24564
Ba-Nb-O Ba2Nb5O9 Ba2Nb5O9 ,tP16,123 P4/mmm 0.4172,0.4172,1.2224,90,90,90 - black 6.89 X 24752
Ba-Nb-O Ba3NbO5.5 [NH4]3FeF6,cF40,225 Fm-3m 0.871,0.871,0.871,90,90,90 perovskite family - 5.96 A 15532
Ba-Nb-O Ba3Nb16O23 Ba3Nb16O23,oS84,65 Cmmm 1.24785,2.09301,0.41619,90,90,90 - - 6.93 X 28739
Ba-Nb-O Ba3Nb2O8 Ba3[PO4]2 ,hR39,166 R-3m 0.60477,0.60477,2.1289,90,90,120 - white 5.36 X 40257
Ba-Nb-O Ba3Nb5O15 K2.4 W5O15 ,tP46,127 P4/mbm 1.2598,1.2598,0.39774,90,90,90 tetragonal bronze - 5.87 X 24564
Ba-Nb-O Ba4Nb14O23 Ba4Nb14O23,oS82,65 Cmmm 1.2453,2.0787,0.4149,90,90,90 - black 6.86 X 27135
Ba-Nb-O Ba4Nb2O9 hex Ba4Nb2O9 ,hP56,190 P-62c 1.03829,1.03829,0.85722,90,90,120 - - 5.47 X 52020
Ba-Nb-O Ba4Nb2O9 orth *,o**,* - 0.6117,1.0598,1.2542,90,90,90 - - - N 52020
Ba-Nb-O Ba4Nb2O9 trig Ba3SrTa2O9,hP15,164 P-3m1 0.61,0.61,0.8,90,90,120 - white 5.66 A 2701
Ba-Nb-O Ba5Nb12O35 *,o*208,* - 0.3878,2.086,3.627,90,90,90 - - - N 3388
Ba-Nb-O Ba5Nb2O9 [O2] Ba5Nb2O9 [O2],hP44,194 P63 /mmc 0.6045,0.6045,1.8316,90,90,120 - - 6.01 X 35873
Ba-Nb-O Ba5Nb4O15 Ba5Ta4O15 ,hP24,164 P-3m1 0.5796,0.5796,1.1788,90,90,120 perovskite family white 6.29 X 40257
Ba-Nb-S BaNb0.9 S3 lt BaNiO3,hP10,194 P63 /mmc 0.6839,0.6839,0.5745,90,90,120 perovskite family black 4.53 X 39251
Ba-Nb-S BaNb2S5 *,hP*,190 P-62c 0.3333,0.3333,2.5201,90,90,120 - - - N 38802
Ba-Nb-S BaNb2.85 S6.23 *,hP*,* - 0.33341,0.33341,6.3714,90,90,120 - - - N 33241
Ba-Nb-S BaNb5.33 S11.0 *,hP*,* - 0.33339,0.33339,10.045,90,90,120 - - - N 33241
Ba-Nb-S Ba2NbS5 Ba2NbS5,hP110,194 P63 /mmc 0.6909,0.6909,4.925,90,90,120 - black 4.31 X 18209
Ba-Nb-S Ba4.5 Nb2S10.5 Ba4.5 Nb2S10.5 ,hP52,194 P63 /mmc 0.69743,0.69743,2.1599,90,90,120 - - 4.16 X 24533
Ba-Nb-S Ba5.5 Nb3S14 Ba5.5 Nb3S14,hR93,166 R-3m 0.6877,0.6877,4.184,90,90,120 - black 4.31 X 16258
Ba-Nb-Se BaNb0.80 Se 3 BaNiO3,hP10,194 P63 /mmc 0.7116,0.7116,0.5972,90,90,120 perovskite family - 5.69 X 33473
Ba-Nb-Se BaNb2Se5 *,h**,* - 0.34501,0.34501,2.5795,90,90,120 - - - N 33473
Ba-Nb-Te Ba0.12 Nb3 Te4 Tl0.35 Nb3Se4,hP16,176 P63 /m 1.0668,1.0668,0.3649,90,90,120 - - 7.44 A 31982
Ba-Nd-O BaNd2O4 CaV2O4,oP28,62 Pnma 1.05885,0.36047,1.24449,90,90,90 - colorless 6.85 X 41943
Ba-Nd-O Ba0.1 Nd1.9 O2.95 La2O3,hP5,164 P-3m1 0.3827,0.3827,0.5991,90,90,120 - - 7.32 A 56867
Ba-Nd-S BaNd2S4 rt CaV2O4,oP28,62 Pnma 1.23,0.414,1.481,90,90,90 - - 4.88 A 25330
Ba-Nd-S Ba0.86 Nd0.09 S NaCl,cF8,225 Fm-3m 0.63792,0.63792,0.63792,90,90,90 rocksalt family - 4.17 X 25330
Ba-Nd-S Ba0.87 Nd2.13 S4 ht Th3P 4,cI28,220 I-43d 0.879,0.879,0.879,90,90,90 - - 5.43 A 25330
Ba-Nd-Se BaNd2Se4 Th3P 4,cI28,220 I-43d 0.912,0.912,0.912,90,90,90 - - 6.49 A 2169
Ba-Ni-O BaNiO2 BaNiO2,oS16,63 Cmcm 0.5735,0.919,0.4755,90,90,90 - black 6.04 X 6110
Ba-Ni-O BaNiO2.55 BaNiO2.55 ,hR126,167 R-3c 0.985,0.985,1.3,90,90,120 - black gray 6.48 X 6110
Ba-Ni-O BaNiO3 BaNiO3,hP10,194 P63 /mmc 0.5629,0.5629,0.4811,90,90,120 perovskite family black 6.14 X 9601
Handbook of Inorganic Substances – Edition 2015 : Data 317

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Ni-O BaNi4O8 BaNi4O8,hR39,166 R-3m 0.567,0.567,1.875,90,90,120 - - 4.77 X 17498


Ba-Ni-O Ba3NiO4 Ba3NiO4,hR48,167 R-3c 0.785,0.785,1.65,90,90,120 - gray green 6.05 X 366
Ba-Ni-O Ba6Ni5O15 Ba6Ni5O15,hR78,155 R32 0.9889,0.9889,1.2867,90,90,120 - black 6.21 X 29022
Ba-Ni-P BaNi10P6 BaNi10P6,oS68,64 Cmce 0.6449,1.6191,0.8784,90,90,90 - - 6.59 X 28302
Ba-Ni-P BaNi2P 2 CeAl2Ga2,tI10,139 I4/mmm 0.3947,0.3947,1.182,90,90,90 - yellow 5.71 X 33772
Ba-Ni-P BaNi2P 4 ht BaPd2P4,tI14,139 I4/mmm 0.6553,0.6553,0.5769,90,90,90 - gray 5.08 X 31108
Ba-Ni-P BaNi2P 4 rt BaNi2P 4,oI14,71 Immm 0.5785,0.647,0.662,90,90,90 - gray 5.08 X 31108
Ba-Ni-P BaNi9P 5 BaNi9P 5,hP30,194 P63/mmc 0.6534,0.6534,1.0847,90,90,120 - gray silver 6.79 X 25516
Ba-Ni-S BaNiS2 BaNiS2,tP8,129 P4/nmm 0.44373,0.44373,0.89099,90,90,90 - black 4.93 X 30734
Ba-Ni-S Ba6Ni25S27 Ba6Co 25S27,cP58,221 Pm-3m 1.00565,1.00565,1.00565,90,90,90 - purple 5.15 X 32894
Ba-Ni-Si BaNi2Si2 BaNi2Si2,oS20,63 Cmcm 0.65,0.535,1.133,90,90,90 - - 5.24 X 13881
Ba-Ni-Si Ba2NiSi3 Ba2NiSi3,hP18,189 P-62m 1.1392,1.1392,0.3938,90,90,120 - gray silver 4.70 X 37250
Ba-Ni-Si Ba4Ni1.5 Si21.5 Na4Si23,cP54,223 Pm-3n 1.02947,1.02947,1.02947,90,90,90 clathrate gray 3.78 X 58079
Ba-Ni-Si Ba4Ni1.75 Si21 Sr4(Ga0.35 Ge0.65)23-a,cP72,223 Pm-3n 1.02813,1.02813,1.02813,90,90,90 clathrate gray 3.80 X 58932
Ba-Ni-Sn BaNiSn3 BaNiSn3,tI10,107 I4mm 0.482,0.482,1.093,90,90,90 - - 7.22 X 11607
Ba-Np-O BaNpO4 BaUO4,oP24,57 Pbcm 0.5726,0.8072,0.8165,90,90,90 - - 7.72 A 19131
Ba-O-Os BaOsO3 cub *,cI*,197 I23 0.937,0.937,0.937,90,90,90 - - - N 7681
Ba-O-Os BaOsO3 rhom BaRuO3,hR45,166 R-3m 0.62,0.62,2.202,90,90,120 perovskite family black 7.66 A 11829
Ba-O-Os BaOsO4 Ca[WO4],tI24,88 I41/a 0.566,0.566,1.274,90,90,90 - black 6.37 A 19521
Ba-O-Os Ba0.5 OsO3 *,cI*,197 I23 0.933,0.933,0.933,90,90,90 - black - N 8428
Ba-O-Os Ba11 Os4O24 Sr3(Sr0.5 La0.5)4La4Nb4O24,tI156,88 I41/a 1.22414,1.22414,1.66685,90,90,90 - - 7.06 X 45546
Ba-O-Os Ba3OsO6 *,t**,* - 0.866,0.866,0.834,90,90,90 - - - N 1669
Ba-O-P BaP 2O6 mon BaP 2O6,mP36,14 P121/c1 0.7522,0.6906,1.17684,90,124.816,90 - - 3.91 X 11247
Ba-O-P BaP 2O6 orth BaP 2O6,oP36,19 P212121 0.451,0.836,1.344,90,90,90 - - 3.87 X 3467
Ba-O-P Ba2[P 2O7] ht Ba2[P 2O7],hP39,189 P-62m 0.9415,0.9415,0.7078,90,90,120 - colorless 4.11 X 29768
Ba-O-P Ba2[P 2O7] rt BaPb[P 2O7],oP44,62 Pnma 0.92875,0.56139,1.38064,90,90,90 - colorless 4.14 X 53731
Ba-O-P Ba3P 4O13 tricl1 Ba3P 4O13,aP25,2 P-1 0.5691,0.7238,0.8006,83.65,75.95,70.49 - colorless 4.10 X 24406
Ba-O-P Ba3P 4O13 tricl2 Ba3P 4O13,aP40,2 P-1 0.7557,0.8618,1.0582,108.26,104.5,102.37 - colorless 4.11 X 39751
Ba-O-P Ba3[PO4]2 ht Ba3[PO4]2,hR39,166 R-3m 0.56038,0.56038,2.1,90,90,120 - white 5.25 X 23834
Ba-O-P Ba4P 2O CuLa2O4,oS28,64 Cmce 0.7164,1.6732,0.7335,90,90,90 high-Tc family black gray 4.74 X 25524
Ba-O-P Ba4P 2O9 ht *,o**,* - 0.793,1.042,1.36,90,90,90 - - - N 2849
Ba-O-Pa BaPaO3 CaTiO3,cP5,221 Pm-3m 0.445,0.445,0.445,90,90,90 perovskite family - 7.85 X 2697
Ba-O-Pa Ba3PaO5.5 [NH4]3FeF6,cF40,225 Fm-3m 0.8932,0.8932,0.8932,90,90,90 perovskite family - 6.81 A 2697
Ba-O-Pb BaPbO3 ht1 SrZrO3,tI20,140 I4/mcm 0.60522,0.60522,0.85795,90,90,90 perovskite family - 8.30 X 48944
Ba-O-Pb BaPbO3 ht2 CaTiO3,cP5,221 Pm-3m 0.4261,0.4261,0.4261,90,90,90 perovskite family black 8.43 X 26581
Ba-O-Pb BaPbO3 rt mon BaPbO3,mS20,12 C12/m1 0.85439,0.85057,0.60251,90,134.774,90 - - 8.39 X 45536
Ba-O-Pb BaPbO3 rt orth Ba(Pb0.5 Bi0.5 )O3,oI20,74 Imma 0.60251,0.88056,0.60652,90,90,90 - - 8.10 X 45536
Ba-O-Pb Ba1.2 Pb2.8O4 Ba(Ba0.07Pb0.93 )3O4,hP16,190 P-62c 0.7808,0.7808,0.6217,90,90,120 - - 8.19 X 36710
Ba-O-Pb Ba2PbO4 K2NiF4,tI14,139 I4/mmm 0.43008,0.43008,1.32563,90,90,90 high-Tc family brass 7.39 X 20800
Ba-O-Pb Ba3PbO CaTiO3,cP5,221 Pm-3m 0.5459,0.5459,0.5459,90,90,90 perovskite family - 6.48 X 13568
Ba-O-Pb Ba3Pb2O7 orth *,o**,* - 0.6019,0.6029,2.5663,90,90,90 - - - N 27554
Ba-O-Pb Ba3Pb2O7 tet *,t*48,* - 0.6071,0.6071,2.1732,90,90,90 - - 7.78 N 26607
Ba-O-Pb Ba4Pb3O10 Sr4Ti3O10,tI34,139 I4/mmm 0.428,0.428,3.017,90,90,90 Ruddlesden-Popper - 8.00 A 22923
Ba-O-Pd Ba17 Pd8O3.376 Ba17 Pd8O3.376 ,cF124,216 F-43m 1.5878,1.5878,1.5878,90,90,90 - gray light 5.38 X 38443
Ba-O-Pd Ba2PdO3 Sr2CuO3,oI12,71 Immm 0.38362,0.40804,1.3335,90,90,90 high-Tc family brown dark 6.83 X 21135
Ba-O-Pr BaPrO3 ht1 Ba(Pb0.5 Bi0.5 )O3,oI20,74 Imma 0.62289,0.8751,0.61983,90,90,90 - - 6.41 X 52703
Ba-O-Pr BaPrO3 ht2 LaAlO3,hR30,167 R-3c 0.62335,0.62335,1.5227,90,90,120 perovskite family - 6.34 X 52703
Ba-O-Pr BaPrO3 ht3 CaTiO3,cP5,221 Pm-3m 0.44213,0.44213,0.44213,90,90,90 perovskite family - 6.27 X 52703
Ba-O-Pr BaPrO3 rt GdFeO3,oP20,62 Pnma 0.62068,0.87258,0.61798,90,90,90 perovskite family brown dark 6.47 X 52703
Ba-O-Pr BaPr2O4 CaV2O4,oP28,62 Pnma 1.0613,0.36299,1.2485,90,90,90 - green 6.67 A 46770
Ba-O-Pt BaPtO3 BaCrO3,hP70,194 P63/mmc 0.564,0.564,2.744,90,90,120 perovskite family - 11.70 A 10810
Ba-O-Pt BaPt3O4 NaPt3O4,cP16,223 Pm-3n 0.5715,0.5715,0.5715,90,90,90 - - 14.00 X 11829
Ba-O-Pt Ba15 Pt6O27 Ba15 Pt6O27,hP48,150 P321 1.0156,1.0156,0.88308,90,90,120 - red brown 7.71 X 34846
Ba-O-Pt Ba4PtO6 K4CdCl6,hR66,167 R-3c 1.02101,1.02101,1.26172,90,90,120 - green 7.35 X 22067
Ba-O-Pt Ba4.04Pt2.96 O9 Ba4.04Pt2.96 O9,mS108,5 C121 1.746,1.0085,0.8554,90,90.,90 - - 8.44 X 34848
Ba-O-Pu BaPuO3 cub CaTiO3,cP5,221 Pm-3m 0.4357,0.4357,0.4357,90,90,90 perovskite family - 8.62 X 1722
Ba-O-Pu BaPuO3 ht *,oP10,* - 0.5795,0.5861,0.5983,90,90,90 - - - N 1804
Ba-O-Pu BaPuO3 rt GdFeO3,oP20,62 Pnma 0.6193,0.8744,0.6219,90,90,90 perovskite family brown dark 8.47 X 21078
Ba-O-Pu Ba3PuO6 [NH4]3FeF6,cF40,225 Fm-3m 0.8844,0.8844,0.8844,90,90,90 perovskite family brown dark 7.22 A 1722
Ba-O-Re BaRe 0.653 O3 BaRuO3,hR45,166 R-3m 0.57699,0.57699,2.0799,90,90,120 perovskite family black 7.65 X 11519
Ba-O-Re Ba[ReO4] *,oP24,* - 0.5224,0.588,1.25,90,90,90 - - 6.70 N 21728
Ba-O-Re Ba[ReO4]2 *,m**,* - 0.733,1.244,1.219,90,90.,90 - - 3.81 N 142
Ba-O-Re Ba16 Re6O37 Ba16 Re6O37,mS118,12 C12/m1 2.0577,0.58897,1.5438,90,92.355,90 - yellow 6.94 X 55377
Ba-O-Re Ba2ReO5 Cs2DyCl5,oP32,62 Pnma 0.73233,0.57745,1.14124,90,90,90 - gray dark 7.44 X 20457
Ba-O-Re Ba3ReO6 *,tP*,* - 0.865,0.865,0.833,90,90,90 - - - N 20457
Ba-O-Re Ba3Re 2O10 *,hP45,192 P6/mcc 1.0935,1.0935,0.7795,90,90,120 - yellow - N 11650
Ba-O-Re Ba5Re 2O12 hex1 *,hP38,194 P63/mmc 0.52,0.52,1.947,90,90,120 - - - N 2547
Ba-O-Re Ba5Re 2O12 hex2 *,hP456,186 P63mc 1.04,1.04,5.84,90,90,120 - green dark - N 2613
Ba-O-Re Ba5Re 2O12 orth *,oP76,62 Pnma 1.96728,0.58491,1.04648,90,90,90 - - 6.90 N 55377
Ba-O-Re Ba5Re 3O15[O2] Ba5Re3BrO15,hP48,185 P63cm 1.0912,1.0912,0.7774,90,90,120 apatite family - 6.29 X 13560
Ba-O-Rh BaRhO3 hp 18R BaRhO3,mS60,12 C12/m1 1.0005,0.5764,1.4937,90,102.99,90 perovskite family - 6.84 X 28804
Ba-O-Rh BaRhO3 hp 4H BaMnO3,hP20,194 P63/mmc 0.5744,0.5744,0.9642,90,90,120 perovskite family black 6.95 X 14409
Ba-O-Rh Ba0.86 Rh4O8 hp KCr4O8,mS26,12 C12/m1 1.45727,0.31041,0.9435,90,134.647,90 - black 7.19 X 28804
Ba-O-Rh Ba9Rh8O24 Ba9Rh8O24,hR246,167 R-3c 1.00899,1.00899,4.1462,90,90,120 - - 6.66 X 38525
Ba-O-Ru BaRuO3 hex BaMnO3,hP50,194 P63/mmc 0.5756,0.5756,2.3727,90,90,120 perovskite family black 6.99 X 43196
Ba-O-Ru BaRuO3 hp1 BaMnO3,hP20,194 P63/mmc 0.5729,0.5729,0.95,90,90,120 perovskite family black 7.05 X 33390
Ba-O-Ru BaRuO3 ht-hp BaTiO3,hP30,194 P63/mmc 0.57127,0.57127,1.40499,90,90,120 perovskite family black 7.19 X 52862
Ba-O-Ru BaRuO3 rt BaRuO3,hR45,166 R-3m 0.57506,0.57506,2.16011,90,90,120 perovskite family black 6.92 X 53234
318 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-O-Ru BaRu6O12 BaRu6O12 ,tP76,85 P4/n 0.9838,0.9838,0.9368,90,90,90 - black 6.86 X 18354


Ba-O-Ru Ba2RuO4 hp K2NiF4,tI14,139 I4/mmm 0.399,0.399,1.34,90,90,90 high-Tc family - 6.85 A 6827
Ba-O-Ru Ba2Ru7O18 Ba2Ni7F18 ,aP27,2 P-1 0.671,0.71,0.746,93.2,94.6,115.7 - black 6.64 X 43196
Ba-O-Ru Ba4Ru3O10 mon Ba4Ir3O10,mP34,14 P121/c1 0.7234,1.3076,0.5776,90,113.53,90 - blue dark 6.71 X 31709
Ba-O-Ru Ba4Ru3O10 orth Cs4Mg3F10 ,oS68,64 Cmce 0.57762,1.3271,1.3083,90,90,90 - - 6.71 X 37546
Ba-O-Ru Ba5Ru2O10 Ba5Ru2O10 ,hP34,194 P63 /mmc 0.5958,0.5958,1.8045,90,90,120 - brown 6.28 X 28624
Ba-O-Ru Ba5Ru2O9 [O2] Ba5Ru2O9 [O2],hP56,194 P63 /mmc 0.5947,0.5947,1.8043,90,90,120 - black 6.40 X 33345
Ba-O-S Ba[SO3] *,mP10,11 P121/m1 0.4647,0.549,0.6649,90,106.25,90 - - - N 16636
Ba-O-S Ba[SO4] hp Ba[SO4],oP24,19 P212121 0.587,0.633,0.655,90,90,90 - - 6.37 X 57175
Ba-O-S Ba[SO4] ht K[ClO4],cF24,216 F-43m 0.7415,0.7415,0.7415,90,90,90 - - 3.80 X 20891
Ba-O-S Ba[SO4] rt Ba[SO4],oP24,62 Pnma 0.8879,0.5454,0.7154,90,90,90 baryte colorless 4.47 X 34166
Ba-O-Sb BaSb2O6 PbSb2O6,hP9,162 P-31m 0.53036,0.53036,0.57602,90,90,120 - colorless 5.64 X 28439
Ba-O-Sb Ba2Sb2O5 orth1 Sr2Bi2O5,oP36,62 Pnma 1.4506,0.6366,0.802,90,90,90 - yellowish 5.36 X 44108
Ba-O-Sb Ba2Sb2O5 orth2 Sr2Bi2O5,oS20,63 Cmcm 0.401,1.4506,0.6366,90,90,90 - yellowish 5.36 X 44108
Ba-O-Sb Ba3Sb2O Ba3Sb2O,oP24,55 Pbam 1.24228,1.263,0.5101,90,90,90 - black 5.57 X 38398
Ba-O-Sb Ba3Sb2O6 Ba3Sb2O6,aP33,2 P-1 0.6152,0.97865,1.2154,105.172,90.29,108.049 - yellowish 5.60 X 44108
Ba-O-Sb Ba3Sb4O Ba3Sb4O,mP32,14 P121/c1 0.6964,1.2807,1.2941,90,112.385,90 - gray silver 5.69 X 45651
Ba-O-Sb Ba4Sb2O K2NiF4,tI14,139 I4/mmm 0.512,0.512,1.795,90,90,90 high-Tc family - 5.71 X 32552
Ba-O-Sb Ba4Sb2O9 Ba3(W0.5 Fe0.5)2FeO9,hP30,194 P63 /mmc 0.61812,0.61812,1.599,90,90,120 perovskite family white 5.88 X 48087
Ba-O-Sc BaScO2.5 CaTiO3,cP5,221 Pm-3m 0.4125,0.4125,0.4125,90,90,90 perovskite family - 5.26 X 58050
Ba-O-Sc BaSc2O4 BaSc2O4,mS84,15 C12/c1 0.984,0.581,2.056,90,90.,90 - - 4.94 X 16393
Ba-O-Sc Ba2Sc2O5 ht *,tI*,* - 0.41932,0.41932,2.462,90,90,90 - - - N 8446
Ba-O-Sc Ba2Sc2O5 rt *,tP*,* - 0.41517,0.41517,0.39857,90,90,90 - - - N 8446
Ba-O-Sc Ba3Sc4O9 Ba3Sc4O9,hR48,166 R-3m 0.5783,0.5783,2.369,90,90,120 - colorless 5.34 X 5496
Ba-O-Se BaSe2O5 BaSe2O5,mP32,14 P121/c1 0.4553,1.1724,0.9758,90,92.66,90 - - 4.79 X 34961
Ba-O-Se Ba[SeO3] K[ClO3],mP10,11 P121/m1 0.4677,0.5645,0.6851,90,107.16,90 - yellow 5.08 X 34961
Ba-O-Se Ba[SeO4] Ba[SO4],oP24,62 Pnma 0.8993,0.5675,0.7349,90,90,90 - colorless 4.96 X 45824
Ba-O-Si BaSiO3 hp1 BaRuO3,hR45,166 R-3m 0.53002,0.53002,1.92351,90,90,120 perovskite family - 6.82 X 48047
Ba-O-Si BaSiO3 hp2 BaTiO3,hP30,194 P63 /mmc 0.51125,0.51125,1.23871,90,90,120 perovskite family - 7.58 X 48047
Ba-O-Si BaSiO3 ht1 BaGeO3,oP20,19 P212121 0.458,0.5611,1.2431,90,90,90 - colorless 4.44 X 8152
Ba-O-Si BaSiO3 rt *,h*30,* - 0.747,0.747,1.047,90,90,120 - - 4.20 N 9865
Ba-O-Si BaSi2O5 ht BaSi2O5,mS96,15 C12/c1 2.3195,0.4658,1.3613,90,97.57,90 - - 3.74 X 13847
Ba-O-Si BaSi2O5 rt BaSi2O5,oP32,62 Pnma 1.3523,0.7688,0.4629,90,90,90 sanbornite - 3.77 X 13847
Ba-O-Si BaSi4O9 hp BaGe4O9,hP42,143 P3 1.12469,1.12469,0.44851,90,90,120 - - 3.99 X 35540
Ba-O-Si BaSi4O9 rt BaSi4O9,hP28,188 P-6c2 0.64953,0.64953,0.93465,90,90,120 - - 3.83 X 30481
Ba-O-Si Ba2Si3O8 Ba2Si3O8,mP52,14 P121/c1 1.2477,0.4685,1.3944,90,93.54,90 - - 3.98 X 13845
Ba-O-Si Ba2[SiO4] K2[SO4],oP28,62 Pnma 0.7499,0.5805,1.02,90,90,90 - - 5.49 X 8151
Ba-O-Si Ba21Si2O5 Ba21Si2O5 ,cF224,227 Fd-3m 2.0383,2.0383,2.0383,90,90,90 - - 4.74 X 31046
Ba-O-Si Ba3SiO GdFeO3,oP20,62 Pnma 0.7585,1.0724,0.7532,90,90,90 perovskite family black 4.94 A 35163
Ba-O-Si Ba3SiO5 Cs3CoCl5,tI36,140 I4/mcm 0.73023,0.73023,1.12178,90,90,90 - - 5.78 X 11326
Ba-O-Si Ba3Si5O13 ht Ba3Si5O13 ,mP84,14 P121/c1 2.0196,0.4707,1.3842,90,98.61,90 - - 3.88 X 13845
Ba-O-Si Ba5Si8O21 Ba5Si8O21 ,mS136,15 C12/c1 3.2675,0.4695,1.3894,90,98.1,90 - - 3.93 X 13845
Ba-O-Sm BaSm2O4 CaV2O4,oP28,62 Pnma 1.0515,0.35609,1.2333,90,90,90 - white 7.22 A 46770
Ba-O-Sm Ba0.1 Sm1.9 O2.95 Sm2O3,mS30,12 C12/m1 1.418,0.3626,0.8855,90,99.99,90 - - 7.70 A 56867
Ba-O-Sm Ba3Sm4O9 *,hR48,166 R-3m 0.6215,0.6215,2.571,90,90,120 - colorless - N 7413
Ba-O-Sn BaSnO3 rt CaTiO3,cP5,221 Pm-3m 0.41152,0.41152,0.41152,90,90,90 perovskite family yellow 7.24 X 49528
Ba-O-Sn Ba2SnO4 K2NiF4,tI14,139 I4/mmm 0.41411,0.41411,1.32834,90,90,90 high-Tc family - 6.67 X 31834
Ba-O-Sn Ba3SnO CaTiO3,cP5,221 Pm-3m 0.5448,0.5448,0.5448,90,90,90 perovskite family - 5.61 X 13568
Ba-O-Sr Ba0.5 Sr0.5 O NaCl,cF8,225 Fm-3m 0.536,0.536,0.536,90,90,90 rocksalt family - 5.54 X 30372
Ba-O-Ta BaTa2O6 hex BaTa2O6,hP33,189 P-62m 0.896,0.896,0.779,90,90,120 - - 5.47 X 1281
Ba-O-Ta BaTa2O6 ht1 *,tP45,127 P4/mbm 1.255,1.255,0.3939,90,90,90 - colorless - N 28069
Ba-O-Ta BaTa2O6 ht2 BaTa2O6,hP108,191 P6/mmm 2.114,2.114,0.3917,90,90,120 - colorless 7.82 X 4194
Ba-O-Ta BaTa2O6 ht3 BaTa2O6,hP124,191 P6/mmm 2.1116,2.1116,0.39157,90,90,120 - colorless 7.84 X 49017
Ba-O-Ta BaTa2O6 rt *,o*120,* - 0.767,1.026,1.233,90,90,90 - - - N 3678
Ba-O-Ta Ba0.275 Ta1.45 O3.9 *,oP*,55 Pbam 1.2517,3.7482,0.39124,90,90,90 - - - N 42258
Ba-O-Ta Ba14.67 Ta7.33 O33 *,hR165,* - 0.5922,0.5922,9.34,90,90,120 - white - N 14692
Ba-O-Ta Ba2Ta15O32 Ba2Nb15O32,hR147,148 R-3 0.7773,0.7773,3.5414,90,90,120 - golden 9.41 X 33606
Ba-O-Ta Ba2.725 Ta10.9 O30 Ba2.725 Ta10.9 O30,tP98,83 P4/m 1.76,1.76,0.3905,90,90,90 - - 7.76 X 3466
Ba-O-Ta Ba3Ta2O8 *,mS26,12 C12/m1 1.014,0.5815,0.7449,90,117.72,90 - - - N 10919
Ba-O-Ta Ba3Ta5O15 K2.4 W5O15 ,tP46,127 P4/mbm 1.259,1.259,0.3967,90,90,90 tetragonal bronze blue dark 8.22 X 29964
Ba-O-Ta Ba4Ta2O9 ht Ba3SrTa2O9,hP15,164 P-3m1 0.61,0.61,0.805,90,90,120 - - 6.75 A 2701
Ba-O-Ta Ba4Ta2O9 rt *,oS240,20 C222 1 1.215,2.116,1.607,90,90,90 - - - N 10919
Ba-O-Ta Ba5Ta4O15 Ba5Ta4O15 ,hP24,164 P-3m1 0.5776,0.5776,1.182,90,90,120 perovskite family tan 8.03 X 4955
Ba-O-Tb BaTbO3 ht CaTiO3,cP5,221 Pm-3m 0.42969,0.42969,0.42969,90,90,90 perovskite family - 7.21 X 43367
Ba-O-Tb BaTbO3 lt Ba(Pb0.5 Bi0.5 )O3,oI20,74 Imma 0.60552,0.85453,0.6072,90,90,90 - - 7.28 X 43367
Ba-O-Tb BaTbO3 orth GdFeO3,oP20,62 Pnma 0.60543,0.85465,0.60712,90,90,90 perovskite family - 7.28 X 34642
Ba-O-Tb BaTbO3 rhom LaAlO3,hR30,167 R-3c 0.60798,0.60798,1.47681,90,90,120 perovskite family yellow 7.26 X 6495
Ba-O-Tb BaTbO3 tet SrZrO3,tI20,140 I4/mcm 0.60528,0.60528,0.85957,90,90,90 perovskite family - 7.26 X 43367
Ba-O-Tb BaTb2O4 CaV2O4,oP28,62 Pnma 1.0439,0.3492,1.2187,90,90,90 - colorless 7.76 A 46770
Ba-O-Tb Ba3Tb4O9 *,hR48,166 R-3m 0.6159,0.6159,2.538,90,90,120 - colorless - N 7413
Ba-O-Tc BaTcO3 BaTiO3,hP30,194 P63 /mmc 0.5758,0.5758,1.4046,90,90,120 perovskite family - 7.00 A 2262
Ba-O-Te BaTeO3 mon K[ClO3],mP10,11 P121/m1 0.4633,0.5943,0.7104,90,106.4,90 - colorless 5.54 X 12809
Ba-O-Te BaTe2O5 *,m**,* - 0.739,0.438,1.985,90,95.39,90 - - - N 12698
Ba-O-Te BaTe2O6 BaTe2O6,oS36,63 Cmcm 0.5569,1.2796,0.732,90,90,90 - - 6.22 X 12088
Ba-O-Te BaTe3O7 BaTe3O7,mP44,14 P121/c1 1.02765,0.5251,1.5676,90,121.375,90 - - 5.81 X 40113
Ba-O-Te BaTe4O9 BaTe4O9,mS112,15 C12/c1 1.95354,0.45099,2.33021,90,112.961,90 - - 5.56 X 40113
Ba-O-Te Ba[TeO3] orth Ba[TeO3],oP60,62 Pnma 1.4784,0.6129,1.235,90,90,90 - - 5.57 X 12809
Ba-O-Te Ba[TeO4] *,mP24,14 P121/c1 0.59225,0.50229,1.44197,90,110.723,90 - white 5.45 N 6652
Handbook of Inorganic Substances – Edition 2015 : Data 319

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-O-Te Ba2TeO5 *,tP64,92 P41212 1.152,1.152,0.741,90,90,90 - - 6.51 N 7510


Ba-O-Te Ba2Te 3O8 *,oP*,* - 0.481,1.291,1.537,90,90,90 - - - N 12698
Ba-O-Te Ba3Te 2O9 Ba3Te2O9,hP28,194 P63/mmc 0.58603,0.58603,1.43037,90,90,120 - - 6.33 X 14486
Ba-O-Te Ba3Te 4O11 Ba3Te4O11,aP36,2 P-1 0.78877,0.94245,0.99759,97.8,110.58,103.27 - - 5.56 X 15854
Ba-O-Te Ba3[TeO6] Ba3[TeO6],tI800,88 I41/a 1.93878,1.93878,3.4909,90,90,90 - colorless 6.43 X 55531
Ba-O-Th BaThO3 CaTiO3,cP5,221 Pm-3m 0.448,0.448,0.448,90,90,90 perovskite family - 7.71 X 108
Ba-O-Ti BaTiO2.67 BaTiO2.67 ,hP15,156 P3m1 0.57,0.57,0.7,90,90,120 perovskite family - 5.77 X 42704
Ba-O-Ti BaTiO3 6H lt1 BaTiO3,oS60,20 C222 1 0.5727,0.989,1.3942,90,90,90 - - 5.89 X 42549
Ba-O-Ti BaTiO3 6H BaTiO3,hP30,194 P63/mmc 0.57238,0.57238,1.39649,90,90,120 perovskite family colorless 5.86 X 28408
Ba-O-Ti BaTiO3 hp BaTiO3,tP8,99 P4mm 0.39913,0.39913,0.4032,90,90,90 - - 6.03 X 55800
Ba-O-Ti BaTiO3 ht CaTiO3,cP5,221 Pm-3m 0.40191,0.40191,0.40191,90,90,90 perovskite family - 5.97 X 52691
Ba-O-Ti BaTiO3 lt1 BaTiO3,oS10,38 Amm2 0.39874,0.56751,0.56901,90,90,90 barioperovskite - 6.02 X 27613
Ba-O-Ti BaTiO3 lt2 K[BrO3],hR15,160 R3m 0.56561,0.56561,0.69509,90,90,120 perovskite family - 6.03 X 14748
Ba-O-Ti BaTiO3 mon (Nb0.5 Fe0.5 )PbO3,mS10,8 C1m1 0.58255,0.5734,0.39705,90,88.91,90 - - 5.84 X 59175
Ba-O-Ti BaTiO3 rt BaTiO3,tP5,99 P4mm 0.39946,0.39946,0.40388,90,90,90 perovskite family colorless 6.01 X 47359
Ba-O-Ti BaTi2O5 hex *,hP*,* - 0.66,0.66,1.11,90,90,120 - - - N 52009
Ba-O-Ti BaTi2O5 ht BaTi2O5,mS48,12 C12/m1 1.6907,0.3932,0.9409,90,103.08,90 - - 5.12 X 7988
Ba-O-Ti BaTi2O5 orth BaTi2O5,oP32,62 Pnma 1.02378,0.39272,1.09276,90,90,90 - - 4.73 X 52009
Ba-O-Ti BaTi2O5 rt BaTi2O5,mS48,5 C121 1.6899,0.3935,0.94105,90,103.103,90 - colorless 5.12 X 41150
Ba-O-Ti BaTi4O9 BaTi4O9,oP28,59 Pmmn 0.3794,1.4527,0.6293,90,90,90 - - 4.53 X 16822
Ba-O-Ti BaTi5O11 BaTi5O11,mP68,14 P121/c1 0.752,1.402,0.99331,90,130.18,90 perovskite family colorless 4.59 X 4371
Ba-O-Ti BaTi6O13 BaTi6O13,aP40,2 P-1 0.7461,0.751,0.9852,72.35,74.77,61.46 - - 4.59 X 6630
Ba-O-Ti BaTi7O14 *,oP*,* - 0.7147,0.7255,0.9984,90,90,90 - - - N 24666
Ba-O-Ti Ba0.4 Ti4O8 K0.5 Mn4O8,tI26,87 I4/m 1.012,1.012,0.296,90,90,90 mannardite - 4.10 X 23107
Ba-O-Ti Ba0.54 Ti4O8 ht Ba(Ti0.67 Al0.33 )4O8,tI28,87 I4/m 1.01361,1.01361,0.29639,90,90,90 redledgeite - 4.29 X 23264
Ba-O-Ti Ba0.54 Ti4O8 rt Ba0.54 Ti4O8,mS28,12 C12/m1 1.42836,0.29643,1.00707,90,134.433,90 - black 4.29 X 23264
Ba-O-Ti Ba2TiO4 mon Ca2[SiO4],mP28,14 P121/c1 0.6096,0.7681,1.19018,90,117.773,90 - white 5.21 X 7138
Ba-O-Ti Ba2TiO4 orth1 K2[SO4],oP28,62 Pnma 0.76514,0.61069,1.05502,90,90,90 - colorless 5.21 A 20580
Ba-O-Ti Ba2TiO4 orth2 K2CoCl4,oP84,33 Pna21 2.2952,1.054,0.6107,90,90,90 - - 5.21 X 16847
Ba-O-Ti Ba2Ti13O22 Ba2Ti13O22,oS148,64 Cmce 1.1655,1.00535,1.41062,90,90,90 - black 5.02 X 29186
Ba-O-Ti Ba2Ti5.5 O13 Na2Ti6O13,mS42,12 C12/m1 1.516,0.3893,0.9093,90,98.6,90 - colorless 4.67 X 12111
Ba-O-Ti Ba2Ti9O20 Ba2Ti9O20,aP124,2 P-1 0.7477,1.4095,1.4358,89.95,79.45,84.47 - - 4.60 X 16312
Ba-O-Ti Ba2.68 Ti18O36 Ba2.68 Ti18O36,mS130,12 C12/m1 1.42167,1.47851,0.99942,90,133.781,90 - - 3.96 X 42154
Ba-O-Ti Ba3TiO5 Cs3CoCl5,tI36,140 I4/mcm 0.7355,0.7355,1.1855,90,90,90 - - 5.59 A 2847
Ba-O-Ti Ba4Ti12O27 Ba4(Ti0.83 Al0.17 )12O27 ,mS172,12 C12/m1 1.98165,1.14468,0.99208,90,109.185,90 - gray dark 4.86 X 35468
Ba-O-Ti Ba4Ti13O30 Ba4Ti13O30,oS188,64 Cmce 1.7062,0.9862,1.4051,90,90,90 - - 4.64 X 15074
Ba-O-Ti Ba6Ti17O40 Ba6Ti17O40,mS252,15 C12/c1 0.9887,1.7097,1.8918,90,98.72,90 - - 4.79 X 16822
Ba-O-Tl BaTl2O4 CaV2O4,oP28,62 Pnma 1.046,0.3476,1.193,90,90,90 - - 9.34 A 26149
Ba-O-Tl Ba0.18 Tl1.82 O2.91 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.0531,1.0531,1.0531,90,90,90 - - 10.08 A 26149
Ba-O-Tl Ba2Tl10O17 *,o**,* - 1.011,1.7676,2.4167,90,90,90 - - - N 25026
Ba-O-Tl Ba2Tl2O5 mon *,mP*,* - 0.5836,1.7342,0.6226,90,91.34,90 - black - N 23770
Ba-O-Tl Ba2Tl2O5 rt Ca2Fe2O5,oP36,62 Pnma 0.605,1.7258,0.6264,90,90,90 - black 7.75 X 8614
Ba-O-Tl Ba4Tl2O7 Sr4Tl2O7,tP30,102 P42nm 0.533,0.533,2.304,90,90,90 - - 5.43 A 26149
Ba-O-Tl Ba4Tl6O13 *,o**,* - 0.5748,0.7221,0.9361,90,90,90 - - - N 23770
Ba-O-Tl Ba6Tl14O27 *,o**,* - 0.689,1.0235,1.7724,90,90,90 - - - N 25026
Ba-O-Tm Ba2Tm2O5 rt *,t**,* - 0.43587,0.43587,1.1857,90,90,90 - beige - N 23706
Ba-O-Tm Ba3Tm4O9 Ba3Yb4O9,hR48,146 R3 0.60556,0.60556,2.49572,90,90,120 - colorless 7.74 X 24229
Ba-O-Tm Ba4Tm2O7 ht *,tI28,139 I4/mmm 0.43203,0.43203,2.8834,90,90,90 - gray - N 23706
Ba-O-U BaUO3 CaTiO3,cP5,221 Pm-3m 0.437,0.437,0.437,90,90,90 perovskite family - 8.42 X 3572
Ba-O-U BaUO4 BaUO4,oP24,57 Pbcm 0.5744,0.8136,0.8237,90,90,90 - golden 7.58 X 9944
Ba-O-U BaU2O7 BaU2O7,tI40,141 I41/amd 0.7128,0.7128,1.195,90,90,90 - yellow 7.94 X 2692
Ba-O-U Ba0.006U0.994 O2 CaF2 ,cF12,225 Fm-3m 0.547,0.547,0.547,90,90,90 fluorite family - 10.93 X 27607
Ba-O-U Ba0.99 U0.99O3 GdFeO3,oP20,62 Pnma 0.62397,0.88123,0.6259,90,90,90 perovskite family brown dark 8.10 X 33457
Ba-O-U Ba2U2O7 Ca2Sb2O7,oI44,74 Imma 0.8161,1.1317,0.8185,90,90,90 - - 7.58 X 49091
Ba-O-U Ba2.414 U1.554 O6 Ba2YbBiO6,hR30,148 R-3 0.62869,0.62869,1.53423,90,90,120 perovskite family - 7.56 X 33457
Ba-O-U Ba23 U8O47 Ba23 U8O47,tI158,139 I4/mmm 1.2624,1.2624,1.7534,90,90,90 - brown red 6.91 X 14677
Ba-O-U Ba3UO6 Ba2CaWO6,cF40,225 Fm-3m 0.889,0.889,0.889,90,90,90 perovskite family - 7.05 A 1670
Ba-O-V BaVO2.5 BaVO2.5 ,hP25,156 P3m1 0.5718,0.5718,1.1613,90,90,120 perovskite family - 5.76 X 15427
Ba-O-V BaVO3 hex BaCrO3,hP70,194 P63/mmc 0.5696,0.5696,3.2122,90,90,120 perovskite family - 6.09 A 6105
Ba-O-V BaVO3 rhom *,hR*,* - 0.5726,0.5726,2.7821,90,90,120 - - - N 6105
Ba-O-V BaV10O15 lt BaV10O15,oP104,61 Pbca 0.94178,1.16155,0.98735,90,90,90 - black 5.45 X 43335
Ba-O-V BaV10O15 rt BaV10O15,oS104,64 Cmce 1.16015,0.99186,0.9394,90,90,90 - black 5.45 X 43335
Ba-O-V BaV13O18 BaV13O18,hR96,148 R-3 1.2621,1.2621,0.702,90,90,120 - black 5.59 X 39131
Ba-O-V BaV2O6 BaV2O6,oS54,21 C222 0.8482,1.261,0.7916,90,90,90 - colorless 3.94 X 30062
Ba-O-V BaV3O8 BaV3O8,mP24,11 P121/m1 0.74347,0.55512,0.82012,90,107.179,90 - black 4.29 X 32011
Ba-O-V BaV4O9 BaV4O9,mP28,13 P12/c1 0.76396,0.49447,0.93596,90,111.427,90 - blue dark 4.90 X 48074
Ba-O-V BaV6O11 lt NaV6O11,hP36,186 P63mc 0.5775,0.5775,1.3238,90,90,120 - - 5.38 X 51866
Ba-O-V BaV6O11 rt Ba(Ti0.33 Fe0.67)6O11,hP36,194 P63/mmc 0.5797,0.5797,1.3301,90,90,120 - - 5.31 X 51866
Ba-O-V Ba0.04 V1.96 O3 Al2O3,hR30,167 R-3c 0.4943,0.4943,1.3952,90,90,120 - - 5.18 A 17965
Ba-O-V Ba0.2 VO2 *,mS32,12 C12/m1 1.217,0.391,0.628,90,102.,90 - black blue - N 9860
Ba-O-V Ba0.5 V4.95 O8.5 K0.36 V5O8,mS30,12 C12/m1 1.40662,0.29034,0.9464,90,129.822,90 - black 5.11 X 29167
Ba-O-V Ba0.545 V4O8 rt K0.75 (Ti0.81 Al0.19 )4O8 ,tI30,87 I4/m 0.99805,0.99805,0.28755,90,90,90 - black 4.71 X 30586
Ba-O-V Ba1.13 V8O21 Ba1.13 V8O21,mS62,12 C12/m1 1.5144,0.3596,1.4972,90,90.08,90 - brown 3.66 X 37601
Ba-O-V Ba2[VO][VO4]2 Ba2[VO][VO4]2,mP28,4 P1211 0.81174,0.59699,0.92903,90,113.94,90 - orange red 4.61 X 32683
Ba-O-V Ba2[VO4] mon Ca2[SiO4],mP28,14 P121/c1 0.6,0.763,1.18235,90,118.107,90 - black gray 5.42 X 27664
Ba-O-V Ba2[VO4] orth K2[SO4],oP28,62 Pnma 0.7702,0.6056,1.0387,90,90,90 - black gray 5.34 A 27664
Ba-O-V Ba2[V2O7] Ba2[V2O7],aP44,2 P-1 0.7306,0.732,1.3571,87.32,80.52,89.91 - colorless 4.54 X 11732
Ba-O-V Ba3VO5 Cs3CoCl5,tI36,140 I4/mcm 0.72987,0.72987,1.18306,90,90,90 - - 5.72 A 27746
320 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-O-V Ba3V4O13 Ba3V4O13,mS80,15 C12/c1 1.61,0.8947,1.0173,90,114.39,90 - yellow 4.10 X 20446


Ba-O-V Ba3[VO4]2 Ba3[PO4]2 ,hR39,166 R-3m 0.57733,0.57733,2.1339,90,90,120 gurimite white 5.19 X 51408
Ba-O-V Ba5V5O14 Ba5V5O14,hP24,164 P-3m1 0.578,0.578,1.18969,90,90,120 - black 5.62 X 29087
Ba-O-V Ba8V7O22 Ba8V7O22,hR111,166 R-3m 0.57841,0.57841,5.7074,90,90,120 - black gray 5.44 X 29035
Ba-O-W BaWO4 hp BaWO4,mP48,14 P121/c1 0.7499,0.7161,1.47123,90,116.811,90 - white 7.26 X 7944
Ba-O-W Ba[WO4] hp m LaNbO4,mS24,15 C12/c1 0.76244,1.2163,0.53197,90,134.553,90 - - 7.28 X 57960
Ba-O-W Ba[WO4] rt Ca[WO4],tI24,88 I41/a 0.54559,0.54559,1.2158,90,90,90 - - 7.07 X 57960
Ba-O-W Ba0.04 WO3 *,oP*,* - 0.388,0.732,2.853,90,90,90 - - - N 12521
Ba-O-W Ba0.45 W3O9 Ba0.45 W3O9,oP26,51 Pmma 1.0039,0.3808,0.8859,90,90,90 - blue dark 7.43 X 17221
Ba-O-W Ba0.63 W3O9 Tl0.9 W3O9 ,hP34,193 P63 /mcm 0.73211,0.73211,0.74959,90,90,120 - black blue 7.46 X 33722
Ba-O-W Ba0.9 W2.7O9 rt Ba0.9 W2.7O9,hP26,194 P63 /mmc 0.732,0.732,0.74188,90,90,120 - - 7.37 X 24123
Ba-O-W Ba1.05 W5O15 K2.4 W5O15 ,tP46,127 P4/mbm 1.2248,1.2248,0.3819,90,90,90 tetragonal bronze red violet 7.56 A 12521
Ba-O-W Ba11W4O23 Ba11W4O23 ,cF504,227 Fd-3m 1.71823,1.71823,1.71823,90,90,90 - - 6.85 X 49051
Ba-O-W Ba2WO5 Rb2CrF5,oP32,62 Pnma 0.7408,0.5735,1.147,90,90,90 - - 7.34 X 18307
Ba-O-W Ba3WO6 Ba3WO6,aP22,1 P1 0.61071,0.61072,0.8671,89.98,89.98,89.96 - - 7.10 X 25345
Ba-O-W Ba3W2O9 Cs3Tl2Cl9,hR84,167 R-3c 1.0136,1.0136,1.3968,90,90,120 - - 7.41 X 13571
Ba-O-Y BaY2O4 ht CaV2O4,oP28,62 Pnma 1.03955,0.34503,1.21157,90,90,90 - colorless 5.80 X 36685
Ba-O-Y Ba2Y2O5 rt *,tP18,123 P4/mmm 0.4386,0.4386,1.1856,90,90,90 - - 7.75 N 16493
Ba-O-Y Ba3Y4O9 ht Ba3Yb4O9 ,hR48,146 R3 0.611,0.611,2.5187,90,90,120 - colorless 5.58 X 35095
Ba-O-Y Ba4Y2O7 ht *,tI14,139 I4/mmm 0.43613,0.43613,2.868,90,90,90 - - 5.11 P 16493
Ba-O-Yb Ba2Yb2O5 rt *,tP18,123 P4/mmm 0.43263,0.43263,1.1908,90,90,90 - gray - N 23706
Ba-O-Yb Ba3Yb4O9 ht Ba3Yb4O9 ,hR48,146 R3 0.6042,0.6042,2.4859,90,90,120 - colorless 7.91 X 16542
Ba-O-Yb Ba4Yb2O7 ht *,tI28,139 I4/mmm 0.43051,0.43051,2.8937,90,90,90 - gray - N 23706
Ba-O-Zn BaZnO2 BaZnO2,hP12,152 P3121 0.5886,0.5886,0.6734,90,90,120 - colorless 5.79 X 1330
Ba-O-Zn Ba2ZnO3 Ba2ZnO3,mS48,15 C12/c1 0.5833,1.1376,1.2585,90,93.63,90 - colorless 6.19 X 26814
Ba-O-Zr BaZrO3 rt CaTiO3,cP5,221 Pm-3m 0.41943,0.41943,0.41943,90,90,90 perovskite family white 6.22 X 41978
Ba-O-Zr Ba2ZrO4 K2NiF4,tI14,139 I4/mmm 0.4182,0.4182,1.3447,90,90,90 high-Tc family - 6.07 X 28059
Ba-Os-P BaOs2P2 CeAl2Ga2,tI10,139 I4/mmm 0.4028,0.4028,1.2193,90,90,90 - - 9.73 A 20401
Ba-Os-Sb BaOs4Sb12 LaFe4P 12,cI34,204 Im-3 0.9351,0.9351,0.9351,90,90,90 - gray 9.58 A 47144
Ba-P-Pd BaPdP BaPdP,oS32,64 Cmce 0.9642,0.7884,0.7884,90,90,90 - gray 6.09 X 28762
Ba-P-Pd BaPd2P2 Mg2CeSi2 ,tP5,123 P4/mmm 0.4256,0.4256,0.5647,90,90,90 - gray steel 6.69 X 17724
Ba-P-Pd BaPd2P4 BaPd2P4,tI14,139 I4/mmm 0.6831,0.6831,0.5936,90,90,90 - gray 5.68 X 28762
Ba-P-Pd Ba2PdP3 Ba2PdP3,mP24,14 P121/c1 0.6425,0.7222,1.2836,90,91.97,90 - gray 5.29 X 28762
Ba-P-Pt BaPtP NiSbS,cP12,198 P213 0.6533,0.6533,0.6533,90,90,90 pyrite-marcasite family brown dark 8.66 X 19673
Ba-P-Pt BaPt2P 3 BaPt2P 3,mP24,14 P121/c1 0.8352,0.5776,1.1574,90,106.73,90 - gray 7.71 X 20919
Ba-P-Rh BaRh2P 2 CeAl2Ga2,tI10,139 I4/mmm 0.3939,0.3939,1.2576,90,90,90 - gray 6.89 X 33754
Ba-P-Ru BaRu2P 2 CeAl2Ga2,tI10,139 I4/mmm 0.4031,0.4031,1.2062,90,90,90 - - 6.80 A 20401
Ba-P-S BaPS3 PbPSe3,mP20,14 P121/c1 0.6737,0.758,1.1915,90,123.254,90 - colorless 3.45 X 42380
Ba-P-S Ba3P 2S8 mon1 Ba3P 2S8,mP52,14 P121/c1 1.7299,0.661,1.1649,90,90.26,90 - rose light 3.64 X 49641
Ba-P-S Ba3P 2S8 mon2 Ba3P 2S8,mS26,12 C12/m1 1.1597,0.6727,0.8704,90,90.,90 - rose light 3.57 X 49641
Ba-P-Se BaPSe3 PbPSe3,mP20,14 P121/c1 0.7046,0.7862,1.24402,90,123.665,90 - colorless 4.69 X 42380
Ba-P-Se Ba3P 2Se8 Ba3P 2S8,mP52,14 P121/c1 1.8061,0.6906,1.2282,90,90.23,90 - yellow 4.79 X 49641
Ba-P-Si Ba3Si4P6 Ba3Si4P6,mP26,11 P121/m1 0.7527,0.7281,1.1537,90,99.41,90 - black 3.78 X 17730
Ba-P-Si Ba4SiP 4 Ba4SiAs4,cP72,218 P-43n 1.3023,1.3023,1.3023,90,90,90 - gray 4.22 X 15453
Ba-P-Sn Ba3SnP 3 K3SnTe3,mP28,14 P121/c1 0.8837,1.2688,0.8623,90,114.42,90 - - 4.71 X 16764
Ba-P-Sn Ba3Sn2P 4 mon1 Ba3Sn2P 4,mP36,14 P121/c1 0.78669,1.92378,0.78472,90,112.77,90 - black 4.69 X 48586
Ba-P-Sn Ba3Sn2P 4 mon2 Ca3Si2As4 ,mP36,14 P121/c1 0.78771,1.94099,0.7704,90,112.44,90 - black 4.72 X 48586
Ba-P-Te BaP 4Te2 BaP 4Te2,oP28,62 Pnma 1.6486,0.6484,0.7076,90,90,90 - black 4.54 X 41331
Ba-P-Ti Ba4TiP 4 Ba4SiAs4,cP72,218 P-43n 1.3166,1.3166,1.3166,90,90,90 - gray silver 4.20 X 32424
Ba-P-Zn BaZn2P 2 (Li0.25 Bi0.75 )2ClO2,tI10,139 I4/mmm 0.4019,0.4019,1.3228,90,90,90 - gray 5.13 X 12014
Ba-Pb-Rh BaRh3Pb6 BaRh3Pb6 ,oS40,63 Cmcm 0.8179,2.7028,0.4499,90,90,90 - - 11.28 X 20536
Ba-Pb-Sr Ba0.44 Sr0.56Pb3 PuAl3,hP24,194 P63 /mmc 0.71582,0.71582,1.71791,90,90,120 close-packed structure - 9.56 X 51634
Ba-Pb-Sr Ba0.89 Sr0.11Pb3 Mg3In,hR48,166 R-3m 0.7273,0.7273,3.421,90,90,120 close-packed structure - 9.58 X 51634
Ba-Pb-Tl BaTl0.6Pb2.4 Ba(Tl0.2 Pb0.8 )3,hP56,194 P63 /mmc 0.7342,0.7342,3.945,90,90,120 close-packed structure - 9.56 X 5019
Ba-Pb-Tl BaTl1.5Pb1.5 Mg3Cd,hP8,194 P63 /mmc 0.7392,0.7392,0.5475,90,90,120 close-packed structure - 9.67 A 3144
Ba-Pb-Zn BaZnPb BeZrSi,hP6,194 P63 /mmc 0.4801,0.4801,0.9722,90,90,120 AlB2 family - 7.02 X 24876
Ba-Pd-S BaPdS2 BaNiO2,oS16,63 Cmcm 0.6783,1.0634,0.5627,90,90,90 - bluish 5.04 X 19104
Ba-Pd-S BaPd2S4 BaPd2S4,mP14,11 P121/m1 0.6687,0.6764,0.7252,90,110.45,90 - black 5.17 X 30234
Ba-Pd-Sb BaPdSb2 CeNiSi2,oS16,63 Cmcm 0.4877,1.8583,0.4889,90,90,90 - gray silver 7.30 X 32630
Ba-Pd-Sb BaPd2Sb2 CeAl2Ga2,tI10,139 I4/mmm 0.4725,0.4725,1.0772,90,90,90 - brass 8.20 X 19686
Ba-Pd-Si BaPdSi ZrSO,cP12,198 P213 0.6662,0.6662,0.6662,90,90,90 - - 6.11 X 25022
Ba-Pd-Si BaPdSi3 BaNiSn3,tI10,107 I4mm 0.43963,0.43963,1.0186,90,90,90 - - 5.53 X 55025
Ba-Pd-Si BaPd0.34 Si1.66 AlB2,hP3,191 P6/mmm 0.4195,0.4195,0.49594,90,90,120 AlB2 family - 4.84 X 55025
Ba-Pd-Si Ba4Pd1.25 Si21.75 Na4Si23,cP54,223 Pm-3n 1.0345,1.0345,1.0345,90,90,90 clathrate gray 3.88 X 24843
Ba-Pd-Sn BaPdSn3 BaNiSn3,tI10,107 I4mm 0.487,0.487,1.117,90,90,90 - - 7.52 X 13317
Ba-Pr-S BaPr2S4 Th3P 4,cI28,220 I-43d 0.882,0.882,0.882,90,90,90 - - 5.30 A 4496
Ba-Pr-Se BaPr2Se4 Th3P 4,cI28,220 I-43d 0.915,0.915,0.915,90,90,90 - - 6.37 A 2169
Ba-Pt-S BaPt2S3 hp BaPt2S3,tP72,92 P41212 1.10577,1.10577,1.31251,90,90,90 - red 7.74 X 44020
Ba-Pt-S BaPt2S3 rt BaPt2S3,tP24,92 P41212 0.67648,0.67648,1.23489,90,90,90 - red wine 7.33 X 15249
Ba-Pt-Sb BaPtSb LiBaSi,hP3,187 P-6m2 0.4535,0.4535,0.4884,90,90,120 AlB2 family yellowish 8.67 X 19673
Ba-Pt-Si BaPtSi ZrSO,cP12,198 P213 0.6633,0.6633,0.6633,90,90,90 - - 8.21 A 19251
Ba-Pt-Si BaPtSi3 BaNiSn3,tI10,107 I4mm 0.44079,0.44079,1.0017,90,90,90 - - 7.11 X 55025
Ba-Pt-Si BaPt0.3 Si1.7 AlB2,hP3,191 P6/mmm 0.41606,0.41606,0.5015,90,90,120 AlB2 family - 5.38 X 55025
Ba-Pt-Si BaPt5Si12 BaPt5Si12,mS72,12 C12/m1 0.61327,3.23481,0.6118,90,90.13,90 - - 7.93 X 54235
Ba-Pt-Si Ba4Pt1.35Si21.65 Na4Si23,cP54,223 Pm-3n 1.0354,1.0354,1.0354,90,90,90 clathrate gray 4.25 X 24843
Ba-Pt-Sn BaPtSn3 BaNiSn3,tI10,107 I4mm 0.485,0.485,1.107,90,90,90 - - 8.78 X 11607
Ba-Re-S Ba2Re6S11 Ba2Re6S11 ,hR114,167 R-3c 0.9157,0.9157,3.2081,90,90,120 Chevrel phase - 7.46 X 16179
Ba-Rh-Si BaRh2Si2 BaRh2Si2,mP20,14 P121/c1 0.7926,0.6645,0.7679,90,91.2,90 - gray 6.56 X 33761
Handbook of Inorganic Substances – Edition 2015 : Data 321

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Rh-Si BaRh2Si9 *,mS*,15 C12/c1 0.6219,2.1395,0.6226,90,90.32,90 - - - N 58040


Ba-Rh-Si Ba4Rh1.37 Si21.31 ht Sr4(Ga0.35 Ge0.65)23-b,cP72,223 Pm-3n 1.0347,1.0347,1.0347,90,90,90 clathrate gray 3.86 X 58040
Ba-Ru-Sb BaRu4Sb12 LaFe 4P 12,cI34,204 Im-3 0.9306,0.9306,0.9306,90,90,90 - gray 8.25 X 29486
Ba-S-Sb BaSb2S4 BaSb2S4,mP56,14 P121/c1 0.8985,0.8203,2.0602,90,101.36,90 - red 4.54 X 17270
Ba-S-Sb Ba3Sb4.66 S10 Ba3Sb4.66 S10,mP76,14 P121/c1 0.8955,0.8225,2.67565,90,100.29,90 - red 4.45 X 37225
Ba-S-Sb Ba8Sb6S17 Ba8Sb6S17,mP124,13 P12/c1 1.141,1.373,2.253,90,90.94,90 - red dark 4.47 X 14804
Ba-S-Si Ba2SiS4 K2[SO4],oP28,62 Pnma 0.89304,0.67821,1.20106,90,90,90 - amber 3.94 X 8003
Ba-S-Si Ba3SiS5 Ba3FeS5,oP36,62 Pnma 1.2121,0.9527,0.8553,90,90,90 - yellow pale 4.04 X 14030
Ba-S-Sm BaSm2S4 cub Th3P 4,cI28,220 I-43d 0.872,0.872,0.872,90,90,90 - - 5.67 A 5866
Ba-S-Sm Ba0.22 Sm2.52 S4 ht Th3P 4,cI28,220 I-43d 0.8514,0.8514,0.8514,90,90,90 - - 5.78 A 35075
Ba-S-Sm Ba0.90 Sm2S3.90 orth CaV2O4,oP28,62 Pnma 1.2262,0.4121,1.4713,90,90,90 - red 4.91 X 25739
Ba-S-Sm Ba0.94 Sm0.04 S NaCl,cF8,225 Fm-3m 0.6376,0.6376,0.6376,90,90,90 rocksalt family - 4.28 X 35075
Ba-S-Sn BaSnS2 BaSnS2,mP16,14 P121/c1 0.60848,1.21396,0.62356,90,97.058,90 - orange 4.65 X 7112
Ba-S-Sn BaSnS3 hp [NH4]CdCl3,oP20,62 Pnma 0.8527,0.3933,1.4515,90,90,90 - - 4.81 A 5483
Ba-S-Sn BaSnS3 *,mS120,15 C12/c1 2.449,0.636,2.311,90,90.15,90 - - - N 5839
Ba-S-Sn BaSn2S3 ht *,oP24,56 Pccn 0.7038,1.1583,0.7589,90,90,90 - - - N 3444
Ba-S-Sn BaSn2S3 rt BaSn2S3,mP36,11 P121/m1 0.6139,1.3493,1.18212,90,101.016,90 - red dark 4.88 X 13057
Ba-S-Sn Ba0.245 Sn0.755 S rt GeS,oP8,62 Pnma 1.127,0.409,0.444,90,90,90 - - 5.04 A 3444
Ba-S-Sn Ba2SnS4 ht Ba2SnS4,oP56,33 Pna21 1.7823,0.7359,1.2613,90,90,90 - brown 4.19 X 6128
Ba-S-Sn Ba2SnS4 rt Ba2SnS4,mP28,14 P121/c1 0.8481,0.8526,1.228,90,112.97,90 - - 4.24 X 9170
Ba-S-Sn Ba3Sn2S7 Ba3Sn2S7,mP48,14 P121/c1 1.1073,0.6771,1.8703,90,100.77,90 - - 4.21 X 8535
Ba-S-Sr Ba0.5 Sr0.5 S NaCl,cF8,225 Fm-3m 0.62,0.62,0.62,90,90,90 rocksalt family - 4.03 X 444
Ba-S-Ta BaTaS3 lt BaNiO3,hP10,194 P63/mmc 0.6846,0.6846,0.5744,90,90,120 perovskite family black 5.90 X 4636
Ba-S-Ta BaTa2S5 *,hP*,190 P-62c 0.3314,0.3314,2.521,90,90,120 - - - N 38802
Ba-S-Ta Ba2TaS5 Ba2NbS5,hP110,194 P63/mmc 0.6926,0.6926,4.943,90,90,120 - - 4.98 X 23870
Ba-S-Ta Ba3Ta2S8 Ba3Ta2S8,mP39,10 P12/m1 1.19571,0.68501,1.26156,90,108.94,90 - - 5.25 X 22679
Ba-S-Ta Ba5.5 Ta3S13 Ba5.5 Nb3S14,hR93,166 R-3m 0.6883,0.6883,4.183,90,90,120 - - 4.98 X 22669
Ba-S-Tb BaTb2S4 CaV2O4,oP28,62 Pnma 1.2231,0.40569,1.4537,90,90,90 - - 5.37 A 52663
Ba-S-Tb Ba3Tb2S6 *,oP*,* - 1.194,1.216,1.238,90,90,90 - - - N 33694
Ba-S-Te BaTeS3 BaTeS3,oP20,62 Pnma 0.749,0.6898,1.0942,90,90,90 - yellow 4.24 X 9653
Ba-S-Te Ba2TeS4 *,tP168,91 P4122 1.1356,1.1356,3.5822,90,90,90 - - - N 8950
Ba-S-Te Ba3Te 2S7 *,hP24,182 P6322 0.6906,0.6906,1.72,90,90,120 - - - N 8950
Ba-S-Th Ba2ThS6 Ba2US6,tP18,137 P42/nmc 0.5481,0.5481,1.5986,90,90,90 - green 4.83 X 58260
Ba-S-Ti BaTiS3 BaNiO3,hP10,194 P63/mmc 0.6731,0.6731,0.5829,90,90,120 perovskite family black 4.09 X 825
Ba-S-Ti Ba2TiS4 K2[SO4],oP28,62 Pnma 0.90556,0.6854,1.2304,90,90,90 - - 3.92 X 22667
Ba-S-Ti Ba3TiS5 Cs3CoCl5,tI36,140 I4/mcm 0.84646,0.84646,1.37668,90,90,90 - - 4.18 X 22667
Ba-S-Tm BaTm2S4 CaV2O4,oP28,62 Pnma 1.21537,0.39859,1.43414,90,90,90 - - 5.77 A 52663
Ba-S-U BaUS3 GdFeO3,oP20,62 Pnma 0.74791,1.0326,0.71722,90,90,90 perovskite family black 5.65 X 59690
Ba-S-U BaU2S5 mon U2PbSe5,mP32,14 P121/c1 0.84335,0.75037,1.17695,90,90.613,90 - black 6.90 X 59690
Ba-S-U BaU2S5 orth Y2HfS5,oP32,62 Pnma 1.182,0.849,0.753,90,90,90 - black 6.80 A 5150
Ba-S-U Ba2US6 Ba2US6,tP18,137 P42/nmc 0.54145,0.54145,1.57322,90,90,90 - black 5.08 X 58260
Ba-S-U Ba3.69 US6 K4CdCl6,hR66,167 R-3c 1.21193,1.21193,1.48934,90,90,120 - black 4.93 X 59690
Ba-S-V BaVS3 lt1 BaVS3,oS20,20 C222 1 0.67572,1.14866,0.55994,90,90,90 - - 4.35 X 19231
Ba-S-V BaVS3 lt2 BaVS3,oS20,36 Cmc21 0.6751,1.1485,0.5597,90,90,90 - - 4.35 X 45598
Ba-S-V BaVS3 lt3 BaVS3,oS20,63 Cmcm 0.67572,1.14866,0.55994,90,90,90 - - 4.35 X 19231
Ba-S-V BaVS3 lt4 BaNiO3,hP10,194 P63/mmc 0.67283,0.67283,0.56263,90,90,120 perovskite family golden 4.28 X 13978
Ba-S-V BaVS3 lt5 BaVS3,mS40,8 C1m1 1.60094,0.6764,1.119,90,134.299,90 - - 4.36 X 45598
Ba-S-V Ba0.22 V3S4 Tl0.39 V3S4,hP16,176 P63/m 0.9208,0.9208,0.33169,90,90,120 - - 4.24 X 38546
Ba-S-V Ba0.50 V5S8 Tl0.83 V5S8,mS28,12 C12/m1 1.747,0.3292,0.846,90,104.04,90 - - 4.08 X 31005
Ba-S-Y BaY2S4 CaV2O4,oP28,62 Pnma 1.22134,0.40263,1.4484,90,90,90 - yellow 4.13 X 30632
Ba-S-Y Ba3Y2S6 *,oP*,59 Pmmn 1.19,1.212,1.233,90,90,90 - - - N 45099
Ba-S-Yb BaYb2S4 CaV2O4,oP28,62 Pnma 1.21319,0.39718,1.42979,90,90,90 - - 5.90 A 52663
Ba-S-Yb BaYb8S13 *,oP*,34 Pnn2 1.032,1.197,1.401,90,90,90 - - - N 35074
Ba-S-Yb Ba3Yb2S6 *,oP*,* - 1.185,1.205,1.227,90,90,90 - - - N 33694
Ba-S-Zn Ba2ZnS3 hp K2AgI3,oP24,62 Pnma 0.8785,0.4249,1.7013,90,90,90 - black 4.56 X 58300
Ba-S-Zn Ba2ZnS3 K2CuCl3,oP24,62 Pnma 1.205,0.421,1.265,90,90,90 - colorless 4.52 X 1556
Ba-S-Zr BaZrS3 lt ZnMn3C,tP5,123 P4/mmm 0.499,0.499,0.5088,90,90,90 - - 4.26 X 825
Ba-S-Zr BaZrS3 rt GdFeO3,oP20,62 Pnma 0.70599,0.99813,0.70251,90,90,90 perovskite family black blue 4.36 X 13008
Ba-S-Zr Ba2ZrS4 K2NiF4,tI14,139 I4/mmm 0.47852,0.47852,1.59641,90,90,90 high-Tc family brown 4.49 X 25045
Ba-S-Zr Ba3Zr2S7 orth Ba3Zr2S7,oS48,66 Cccm 0.70697,2.54923,0.70269,90,90,90 - black 4.29 X 25045
Ba-S-Zr Ba3Zr2S7 tet Sr3Ti2O7,tI24,139 I4/mmm 0.49983,0.49983,2.5502,90,90,90 Ruddlesden-Popper brown dark 4.27 X 28409
Ba-S-Zr Ba4Zr3S10 Ba4Zr3S10,oF68,69 Fmmm 0.70314,0.70552,3.5544,90,90,90 - brown 4.31 X 27690
Ba-Sb-Se BaSb2Se4 BaSb2Se4,mP56,14 P121/c1 0.8551,2.076,1.24553,90,132.145,90 - gray dark 5.65 X 12854
Ba-Sb-Se Ba4Sb4Se11 Ba4Sb4Se11,oP76,58 Pnnm 0.8917,2.7976,0.9276,90,90,90 - - 5.47 X 13687
Ba-Sb-Sn Ba2Sn3Sb6 Ba2Sn3Sb6,oP44,62 Pnma 1.3351,0.441,2.4449,90,90,90 - gray silver 6.28 X 31645
Ba-Sb-Sr Ba6Sr5Sb10 Ho11 Ge10,tI84,139 I4/mmm 1.2748,1.2748,1.8761,90,90,90 - gray silver 5.40 X 40462
Ba-Sb-Te BaSbTe 3 BaBiSe 3,oP40,19 P212121 0.4635,1.694,1.809,90,90,90 - gray dark 6.00 X 13869
Ba-Sb-Ti Ba5Ti12Sb19.10 Ba5Ti12Sb19.1 ,cP76,215 P-43m 1.24223,1.24223,1.24223,90,90,90 - black 6.21 X 52941
Ba-Sb-Zn BaZnSb2 SrZnBi2,tI16,139 I4/mmm 0.4584,0.4584,2.305,90,90,90 - - 6.12 X 14270
Ba-Sb-Zn BaZn2Sb2 BaCu2S2,oP20,62 Pnma 1.0539,0.4502,1.1639,90,90,90 - gray 6.15 X 12909
Ba-Sb-Zn Ba2ZnSb2 K2ZnO2,oI20,72 Ibam 0.71919,1.4133,0.69597,90,90,90 - black 5.48 X 54346
Ba-Sc-Te BaSc 2Te4 CaV2O4,oP28,62 Pnma 1.3292,0.42694,1.5523,90,90,90 - - 5.56 X 48370
Ba-Se-Si Ba2SiSe 4 Sr2GeS4,mP14,11 P121/m1 0.6872,0.7033,0.9184,90,109.2,90 - brown 4.90 X 18618
Ba-Se-Sm BaSm2Se4 CaV2O4,oP28,62 Pnma 1.275,0.426,1.532,90,90,90 - - 6.02 A 2166
Ba-Se-Sn Ba2SnSe 5 m Ba2SnSe5,mP136,14 P121/c1 2.11719,0.90915,2.47141,90,125.621,90 - reddish 5.42 X 55462
Ba-Se-Sn Ba2SnSe 5 β Ba2SnSe5,mP32,14 P121/c1 0.93949,0.88656,1.25745,90,113.299,90 - red 5.44 X 54281
Ba-Se-Sn Ba2SnSe 5 Ba2SnSe5,oP128,19 P212121 1.23572,1.7235,1.8134,90,90,90 - brown dark 5.42 X 45108
Ba-Se-Ta BaTa0.8 Se3 BaNiO3,hP10,194 P63/mmc 0.7108,0.7108,0.603,90,90,120 perovskite family - 6.53 A 8352
322 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ba-Se-Ti BaTiSe3 BaNiO3,hP10,194 P63 /mmc 0.7054,0.7054,0.6033,90,90,120 perovskite family - 5.39 A 2337
Ba-Se-Tm BaTm2Se4 CaV2O4,oP28,62 Pnma 1.2605,0.41311,1.4919,90,90,90 - orange 6.76 X 51700
Ba-Se-U BaU2Se5 Y2HfS5,oP32,62 Pnma 1.233,0.8805,0.786,90,90,90 - - 7.85 A 6610
Ba-Se-V BaVSe3 BaNiO3,hP10,194 P63 /mmc 0.6999,0.6999,0.58621,90,90,120 perovskite family gray dark 5.68 X 12549
Ba-Se-Y BaY2Se4 CaV2O4,oP28,62 Pnma 1.272,0.422,1.51,90,90,90 - - 5.17 A 2166
Ba-Se-Yb BaYb2Se4 CaV2O4,oP28,62 Pnma 1.258,0.4115,1.486,90,90,90 - red 6.90 X 51700
Ba-Se-Zr BaZrSe3 BaNiO3,hP10,194 P63 /mmc 0.7188,0.7188,0.6025,90,90,120 perovskite family - 5.73 A 2337
Ba-Se-Zr Ba15Zr14Se 42 Ba15Zr14Se42,hR426,167 R-3c 1.24366,1.24366,9.15069,90,90,120 - black 5.41 X 34393
Ba-Si-Sn Ba8SnSi6 Ba8SnSi6,oP60,60 Pbcn 0.87739,0.87599,2.7162,90,90,90 - gray dark 4.41 X 54221
Ba-Si-Sr Ba0.5 Sr0.5 Si2 ht SrSi2,cP12,213 P4132 0.6622,0.6622,0.6622,90,90,90 - - 3.86 X 12037
Ba-Si-Sr Ba0.80 Sr0.20 Si2 rt BaSi2,oP24,62 Pnma 0.88258,0.66736,1.14364,90,90,90 - gray 3.62 X 54246
Ba-Si-Sr Ba3SrSi23 Na4Si23,cP54,223 Pm-3n 1.03086,1.03086,1.03086,90,90,90 clathrate - 3.47 X 45458
Ba-Si-Te Ba2SiTe4 Sr2GeS4,mP14,11 P121/m1 0.7466,0.7626,0.965,90,108.9,90 - - 5.20 X 18618
Ba-Si-Zn BaZnSi BeZrSi,hP6,194 P63 /mmc 0.4387,0.4387,0.9683,90,90,120 AlB2 family - 4.75 X 24876
Ba-Si-Zn BaZn2Si2 CeAl2Ga2,tI10,139 I4/mmm 0.4497,0.4497,1.02049,90,90,90 - - 5.22 X 55025
Ba-Si-Zn Ba4Zn3.5 Si19.5 Ba4Al3(Al0.25 Ge0.75)20,cP54,223 Pm-3n 1.04412,1.04412,1.04412,90,90,90 - - 3.87 X 52637
Ba-Sm-Te BaSm2Te4 CaV2O4,oP28,62 Pnma 1.36883,0.45148,1.63427,90,90,90 - black 6.24 X 37351
Ba-Sn-Sr Ba0.06 Sr0.94 Sn5 (Ba0.06 Sr0.94)Sn5,mS84,12 C12/m1 1.7628,0.7041,1.986,90,100.31,90 - gray silver 6.56 X 57508
Ba-Sn-Sr Ba0.09 Sr0.91 Sn3 BaPb3,hR36,166 R-3m 0.6989,0.6989,2.472,90,90,120 close-packed structure - 6.41 X 57376
Ba-Sn-Sr Ba0.11 Sr0.89 Sn5 (Ba0.11 Sr0.89)Sn5,oS120,63 Cmcm 0.7081,1.7704,2.7816,90,90,90 - gray silver 6.54 X 57508
Ba-Sn-Sr Ba0.26 Sr0.74 Sn3 (Ba0.26 Sr0.74)Sn3,hP32,194 P63 /mmc 0.7042,0.7042,2.1976,90,90,120 - - 6.43 X 57376
Ba-Sn-Sr Ba0.63 Sr0.37 Sn5 BaSn5,hP6,191 P6/mmm 0.5368,0.5368,0.6952,90,90,120 - gray silver 6.82 X 57508
Ba-Sn-Sr Ba0.78 Sr0.22 Sn3 Mg3Cd,hP8,194 P63 /mmc 0.7179,0.7179,0.5482,90,90,120 close-packed structure - 6.55 X 57376
Ba-Sn-Te Ba2SnTe5 mon Ba2SnTe5,mP96,14 P121/c1 0.96791,1.31696,2.75957,90,91.585,90 - black 5.84 X 42821
Ba-Sn-Te Ba2SnTe5 orth Ba2SnTe5,oP32,62 Pnma 0.6825,2.4476,0.6889,90,90,90 - bronze 5.95 X 31503
Ba-Sn-Yb BaYbSn3 BaYbSn3,oS80,64 Cmce 1.5871,0.9387,1.7212,90,90,90 - - 6.91 X 48428
Ba-Sn-Zn BaZnSn BeZrSi,hP6,194 P63 /mmc 0.4699,0.4699,0.9843,90,90,120 AlB2 family - 5.67 X 24876
Ba-Sn-Zn BaZn2Sn2 CaBe2Ge2 ,tP10,129 P4/nmm 0.469,0.469,1.133,90,90,90 - - 6.74 X 7071
Ba-Tb-Te BaTb2 Te4 CaV2O4,oP28,62 Pnma 1.36611,0.44611,1.61817,90,90,90 - black 6.50 X 37351
Ba-Te-Tm BaTm2Te4 CaV2O4,oP28,62 Pnma 1.35992,0.44177,1.60487,90,90,90 - black 6.79 X 37351
Ba-Te-Y BaY2Te4 CaV2O4,oP28,62 Pnma 1.3646,0.4443,1.6141,90,90,90 - black 5.60 X 37351
Be-Br-Zr BeZr6Br12 *,hR*,148 R-3 1.37094,1.37094,0.93242,90,90,120 - - - N 34840
Be-C-N Be[CN]2 rt Zn[CN]2,cP10,224 Pn-3m 0.5339,0.5339,0.5339,90,90,90 - colorless 1.33 X 39149
Be-C-U Be0.18 U0.82 C0.91 NaCl,cF8,225 Fm-3m 0.4974,0.4974,0.4974,90,90,90 rocksalt family - 11.21 X 696
Be-Ca-F CaBeF4 Zr[SiO4],tI24,141 I41/amd 0.664,0.664,0.622,90,90,90 - - 3.03 A 516
Be-Ca-Ge CaBe0.75 Ge1.25 AlB2,hP3,191 P6/mmm 0.4,0.4,0.434,90,90,120 AlB2 family gray silver 3.80 X 8675
Be-Ca-Ge CaBe2Ge2 CaBe2Ge2 ,tP10,129 P4/nmm 0.402,0.402,0.992,90,90,90 - - 4.21 X 7071
Be-Ca-N CaBe2N2 CaB2C2,tI20,140 I4/mcm 0.55615,0.55615,0.68796,90,90,90 - yellowish 2.69 X 42550
Be-Ca-O Ca12Be17O29 m Ca12Be17O29,cF232,216 F-43m 1.4023,1.4023,1.4023,90,90,90 - - 2.65 X 2894
Be-Ca-Si CaBe0.75 Si1.25 CaBe0.75 Si1.25 ,hP19,191 P6/mmm 0.39342,0.39342,0.43757,90,90,120 - gray 2.32 X 46097
Be-Ce-Co BeCe2Co17 Pr2Mn17C1.77 ,hR66,166 R-3m 0.832,0.832,1.213,90,90,120 CaCu5-Zr4Al3 - 8.85 A 30399
Be-Cl-Cs CsBe2Cl5 *,cF128,227 Fd-3m 1.5169,1.5169,1.5169,90,90,90 - - 2.50 N 25683
Be-Cl-Cs Cs2BeCl4 K2[SO4],oP28,62 Pnma 0.9642,0.7178,1.2468,90,90,90 - - 3.21 X 17605
Be-Cl-K KBe2Cl5 *,cF128,227 Fd-3m 1.45,1.45,1.45,90,90,90 - - 2.04 N 25683
Be-Cl-K K2BeCl4 K2[SO4],oP28,62 Pnma 0.88,0.686,1.194,90,90,90 - - 2.11 A 2772
Be-Cl-Li Li2BeCl4 Mg2[SiO4],oP28,62 Pnma 1.2512,0.73361,0.5808,90,90,90 - - 2.05 A 26320
Be-Cl-Na Na2BeCl4 Mg2[SiO4],oP28,62 Pnma 1.334,0.8093,0.6091,90,90,90 - - 1.99 A 26320
Be-Cl-Rb RbBe2Cl5 *,cF128,227 Fd-3m 1.4767,1.4767,1.4767,90,90,90 - - 2.32 N 25683
Be-Cl-Te Be2Te7Cl6 Be2Te7Cl6 ,oP30,58 Pnnm 0.5416,0.97479,1.6644,90,90,90 - black 4.25 X 40922
Be-Cl-Tl Be2TlCl5 *,cF128,227 Fd-3m 1.4593,1.4593,1.4593,90,90,90 - - 3.42 N 25683
Be-Cl-Zr BeZr6Cl12 *,hR*,148 R-3 1.31608,1.31608,0.884,90,90,120 - - - N 22583
Be-Co-Dy BeDy2Co17 Tb2Mn17C2.5 ,hP44,194 P63 /mmc 0.83,0.83,0.805,90,90,120 CaCu5-Zr4Al3 - 9.24 A 30399
Be-Co-Er BeEr2Co17 Tb2Mn17C2.5 ,hP44,194 P63 /mmc 0.825,0.825,0.806,90,90,120 CaCu5-Zr4Al3 - 9.41 A 30399
Be-Co-Fe Be2Fe0.7 Co 0.3 MgZn2,hP12,194 P63 /mmc 0.4218,0.4218,0.6857,90,90,120 Friauf-Laves phase - 4.70 A 37338
Be-Co-Gd BeGd2Co17 Pr2Mn17C1.77 ,hR66,166 R-3m 0.834,0.834,1.208,90,90,120 CaCu5-Zr4Al3 - 9.07 A 30399
Be-Co-Ge BeCo 2Ge Cu2MnAl,cF16,225 Fm-3m 0.546,0.546,0.546,90,90,90 b.c.c. family - 8.14 X 3666
Be-Co-Hf Be15Hf6Co 8 Be15Cu8Ta6,cF116,225 Fm-3m 1.1,1.1,1.1,90,90,90 - - 8.37 A 3198
Be-Co-Ho BeHo2Co17 Pr2Mn17C1.77 ,hR66,166 R-3m 0.826,0.826,1.21,90,90,120 CaCu5-Zr4Al3 - 9.34 A 30399
Be-Co-Mn Be1.2 MnCo 0.8 MgCu2,cF24,227 Fd-3m 0.62,0.62,0.62,90,90,90 Friauf-Laves phase - 6.29 X 1435
Be-Co-Mn Be2Mn0.8 Co0.2 MgZn2,hP12,194 P63 /mmc 0.4238,0.4238,0.6916,90,90,120 Friauf-Laves phase - 4.55 A 40234
Be-Co-Nd BeNd2Co17 Pr2Mn17C1.77 ,hR66,166 R-3m 0.838,0.838,1.216,90,90,120 CaCu5-Zr4Al3 - 8.75 A 30399
Be-Co-Pr BePr2Co17 Pr2Mn17C1.77 ,hR66,166 R-3m 0.844,0.844,1.221,90,90,120 CaCu5-Zr4Al3 - 8.55 A 30399
Be-Co-Si BeCo 0.5Si0.5 NaTl,cF16,227 Fd-3m 0.524,0.524,0.524,90,90,90 b.c.c. family - 4.85 X 3667
Be-Co-Si BeCo 2Si Cu2MnAl,cF16,225 Fm-3m 0.537,0.537,0.537,90,90,90 b.c.c. family - 6.65 X 3666
Be-Co-Sm BeSm2Co17 Pr2Mn17C1.77,hR66,166 R-3m 0.835,0.835,1.215,90,90,120 CaCu5-Zr4Al3 - 8.91 A 30399
Be-Co-Tb BeTb2Co17 Pr2Mn17C1.77 ,hR66,166 R-3m 0.83,0.83,1.21,90,90,120 CaCu5-Zr4Al3 - 9.17 A 30399
Be-Co-Y BeY2Co17 Pr2Mn17C1.77 ,hR66,166 R-3m 0.832,0.832,1.216,90,90,120 CaCu5-Zr4Al3 - 8.12 A 30399
Be-Co-Zr Be15Zr6Co 8 Be15Cu8Ta6,cF116,225 Fm-3m 1.11,1.11,1.11,90,90,90 - - 5.60 A 3198
Be-Cr-Mo Be2Cr0.5Mo0.5 MgZn2,hP12,194 P63 /mmc 0.4359,0.4359,0.7136,90,90,120 Friauf-Laves phase - 5.20 A 9440
Be-Cr-Nb Be2Nb0.2 Cr0.8 MgZn2,hP12,194 P63 /mmc 0.4338,0.4338,0.7083,90,90,120 Friauf-Laves phase - 4.50 A 9440
Be-Cr-O BeCr2O4 Mg2[SiO4],oP28,62 Pnma 0.9792,0.5663,0.4555,90,90,90 - - 4.65 X 4681
Be-Cs-F CsBeF3 ht CsBeF3,oP20,62 Pnma 0.4828,0.6004,1.2794,90,90,90 - - 3.56 X 3855
Be-Cs-F CsBeF3 rt BaGeO3,oP20,19 P212121 0.484,0.606,1.282,90,90,90 - - 3.51 A 1287
Be-Cs-F CsBe2F5 ht *,hP8,191 P6/mmm 0.4784,0.4784,0.6555,90,90,120 - - - N 1136
Be-Cs-F CsBe2F5 rt CsBe2F5,cP32,213 P4132 0.7936,0.7936,0.7936,90,90,90 - - 3.27 X 6420
Be-Cs-F Cs2BeF4 rt K2[SO4],oP28,62 Pnma 0.8155,0.61675,1.07499,90,90,90 - - 4.31 X 45138
Be-Cs-F Cs3BeF5 rt Sr3[SiO4]O,tP36,130 P4/ncc 0.7983,0.7983,1.1775,90,90,90 - - 4.45 A 6183
Be-Cu-Dy BeCu4Dy CaCu5,hP6,191 P6/mmm 0.4955,0.4955,0.4008,90,90,120 - - 8.30 X 56562
Handbook of Inorganic Substances – Edition 2015 : Data 323

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Be-Cu-Gd BeCu4Gd CaCu5,hP6,191 P6/mmm 0.5008,0.5008,0.4009,90,90,120 - - 8.02 X 56562


Be-Cu-Ge Be2Cu0.5 Ge0.5 MgCu2,cF24,227 Fd-3m 0.6018,0.6018,0.6018,90,90,90 Friauf-Laves phase - 5.25 X 3667
Be-Cu-Hf Be15 Cu8Hf6 Be15 Cu8Ta6,cF116,225 Fm-3m 1.208,1.208,1.208,90,90,90 - - 6.46 A 3206
Be-Cu-Ho BeCu4Ho CaCu5,hP6,191 P6/mmm 0.4935,0.4935,0.4005,90,90,120 - - 8.42 X 56562
Be-Cu-In Be2Cu0.5 In0.5 MgCu2,cF24,227 Fd-3m 0.6028,0.6028,0.6028,90,90,90 Friauf-Laves phase - 6.50 X 3667
Be-Cu-Mg Mg0.5 Be2Cu0.5 MgCu2,cF24,227 Fd-3m 0.6004,0.6004,0.6004,90,90,90 Friauf-Laves phase - 3.80 X 3667
Be-Cu-Nb Be15 Cu8Nb6 Be15 Cu8Ta6,cF116,225 Fm-3m 1.0833,1.0833,1.0833,90,90,90 - - 6.28 A 2735
Be-Cu-Nd BeCu4Nd CaCu5,hP6,191 P6/mmm 0.5085,0.5085,0.4039,90,90,120 - - 7.48 X 56562
Be-Cu-Si Be2Cu0.5 Si0.5 MgCu2,cF24,227 Fd-3m 0.605,0.605,0.605,90,90,90 Friauf-Laves phase - 3.83 X 3667
Be-Cu-Sm BeCu4Sm CaCu5,hP6,191 P6/mmm 0.5034,0.5034,0.4006,90,90,120 - - 7.81 X 56562
Be-Cu-Ta Be15 Cu8Ta6 Be15 Cu8Ta6,cF116,225 Fm-3m 1.0775,1.0775,1.0775,90,90,90 - - 9.18 X 2735
Be-Cu-Tb BeCu4Tb CaCu5,hP6,191 P6/mmm 0.4977,0.4977,0.4,90,90,120 - - 8.17 X 56562
Be-Cu-Ti Be1.5 Cu0.5 Ti MgCu2,cF24,227 Fd-3m 0.6554,0.6554,0.6554,90,90,90 Friauf-Laves phase - 4.40 X 12771
Be-Cu-Ti Be15 Cu8Ti6 Be15 Cu8Ta6,cF116,225 Fm-3m 1.0784,1.0784,1.0784,90,90,90 - - 4.93 A 2735
Be-Cu-Tm BeCu4Tm MgCu4Sn,cF24,216 F-43m 0.6928,0.6928,0.6928,90,90,90 Friauf-Laves phase - 8.63 A 56562
Be-Cu-Y BeCu4Y CaCu5,hP6,191 P6/mmm 0.4959,0.4959,0.4014,90,90,120 - - 6.84 X 56562
Be-Cu-Zn Be2Cu0.5 Zn0.5 MgCu2,cF24,227 Fd-3m 0.6031,0.6031,0.6031,90,90,90 Friauf-Laves phase - 5.00 X 3667
Be-Cu-Zr Be15 Cu8Zr6 Be15 Cu8Ta6,cF116,225 Fm-3m 1.1185,1.1185,1.1185,90,90,90 - - 5.65 A 2735
Be-D-Li Li2BeD4 Li2BeH4,mP56,14 P121/c1 0.70623,0.83378,0.83465,90,93.577,90 - white 0.84 X 43010
Be-D-O Be[OD]2 Zn[OH]2,oP12,19 P212121 0.45356,0.46317,0.70379,90,90,90 - - 2.02 X 45657
Be-D-Zr Be2ZrD1.5 rt Be2ZrH1.5 ,hP5,191 P6/mmm 0.37139,0.37139,0.34704,90,90,120 - - 4.50 X 16134
Be-Dy-Ge BeDyGe BeZrSi,hP6,194 P63/mmc 0.392,0.392,0.804,90,90,120 AlB2 family - 7.58 X 56568
Be-Dy-Si BeDySi BeZrSi,hP6,194 P63/mmc 0.386,0.386,0.801,90,90,120 AlB2 family - 6.41 X 56568
Be-Er-Ge BeErGe BeZrSi,hP6,194 P63/mmc 0.389,0.389,0.801,90,90,120 AlB2 family - 7.87 X 56568
Be-Er-Si BeErSi BeZrSi,hP6,194 P63/mmc 0.382,0.382,0.789,90,90,120 AlB2 family - 6.81 X 56568
Be-Eu-Ge BeEuGe BeZrSi,hP6,194 P63/mmc 0.407,0.407,0.91,90,90,120 AlB2 family - 5.94 X 56568
Be-Eu-O BeEu3O5 BeEu3O5,mP36,14 P121/c1 0.71749,0.65061,0.94708,90,90.37,90 - black 8.19 X 21953
Be-Eu-Si BeEuSi BeZrSi,hP6,194 P63/mmc 0.396,0.396,0.88,90,90,120 AlB2 family - 5.25 X 56568
Be-F-K KBeF3 BaGeO3,oP20,19 P212121 0.453,0.553,1.222,90,90,90 - - 2.28 A 1287
Be-F-K KBe 2F5 *,hP8,191 P6/mmm 0.4582,0.4582,0.6061,90,90,120 - - - N 1135
Be-F-K K2BeF4 ht K2[SO4],oP28,62 Pnma 0.73005,0.56886,0.98817,90,90,90 - - 2.64 X 45138
Be-F-K K2BeF4 rt K2BeF4,oP28,33 Pna21 0.73067,0.98856,0.5691,90,90,90 - - 2.64 X 35053
Be-F-K K3BeF5 Sr3[SiO4]O,tP36,130 P4/ncc 0.71785,0.71785,1.0742,90,90,90 - - 2.66 X 6183
Be-F-Li Li2BeF4 ht2 *,c**,* - 0.608,0.608,0.608,90,90,90 - - - N 475
Be-F-Li Li2BeF4 rt Be2[SiO4],hR126,148 R-3 1.3281,1.3281,0.8888,90,90,120 - - 2.18 X 27118
Be-F-Na Na2BeF4 ht1 Na2BeF4,mP28,14 P121/c1 0.5559,0.80703,0.88983,90,118.706,90 - - 2.48 X 7162
Be-F-Na Na2BeF4 rt Mg2 [SiO4],oP28,62 Pnma 1.0925,0.6572,0.4896,90,90,90 - - 2.48 X 4216
Be-F-Na Na3Be 2F7 *,o*96,* - 0.489,1.109,2.149,90,90,90 - colorless 2.51 N 3286
Be-F-Pb BePbF4 Ba[SO4],oP24,62 Pnma 0.831,0.535,0.637,90,90,90 - - 6.85 X 4249
Be-F-Rb RbBeF3 BaGeO3,oP20,19 P212121 0.455,0.58,1.255,90,90,90 - - 3.04 A 6197
Be-F-Rb RbBe2F5 rt RbBe2F5,aP8,1 P1 0.46122,0.46439,0.612,88.974,89.303,60.886 - - 2.88 X 1746
Be-F-Rb Rb2BeF4 rt K2[SO4],oP28,62 Pnma 0.769,0.58892,1.02437,90,90,90 - colorless 3.66 X 45138
Be-F-Rb Rb3BeF5 Sr3[SiO4]O,tP36,130 P4/ncc 0.7536,0.7536,1.1196,90,90,90 - - 3.77 A 6183
Be-F-Sm BeSmF4 [NH4][ClO4],oP24,33 Pna21 0.8461,0.6769,0.5241,90,90,90 - orange 5.21 X 32416
Be-F-Sr SrBeF4 ht Ba[SO4],oP24,62 Pnma 0.8307,0.5291,0.6787,90,90,90 - - 3.84 A 1137
Be-F-Sr SrBeF4 rt SrBeF4,mP24,14 P121/c1 0.5295,0.8309,0.86089,90,127.956,90 - colorless 3.84 X 32416
Be-F-Tl BeTl2F4 K2[SO4],oP28,62 Pnma 0.77238,0.59023,1.04499,90,90,90 - white 6.88 X 44188
Be-F-Tl Be2TlF5 rt Be2TlF5,mP32,13 P12/c1 0.8066,0.4657,1.2638,90,90.,90 - - 4.44 X 6376
Be-F-Yb BeYbF4 Ce[PO4],mP24,14 P121/c1 0.6402,0.6911,0.80649,90,126.543,90 - green light 5.98 X 36523
Be-Ga-O BeGa2O4 Si3N4,hP14,176 P63/m 0.775,0.775,0.298,90,90,120 - colorless 4.55 X 12856
Be-Ga-Ti Be1.8 TiGa0.2 MgCu2,cF24,227 Fd-3m 0.6529,0.6529,0.6529,90,90,90 Friauf-Laves phase - 3.73 X 15601
Be-Gd-Ge BeGdGe BeZrSi,hP6,194 P63/mmc 0.395,0.395,0.818,90,90,120 AlB2 family - 7.18 X 56568
Be-Gd-Si BeGdSi BeZrSi,hP6,194 P63/mmc 0.387,0.387,0.812,90,90,120 AlB2 family - 6.13 X 56568
Be-Ge-Ho BeHoGe BeZrSi,hP6,194 P63/mmc 0.39,0.39,0.801,90,90,120 AlB2 family - 7.76 X 56568
Be-Ge-La BeLaGe BeZrSi,hP6,194 P63/mmc 0.405,0.405,0.879,90,90,120 AlB2 family - 5.87 X 56568
Be-Ge-Lu BeLuGe BeZrSi,hP6,194 P63/mmc 0.388,0.388,0.783,90,90,120 AlB2 family - 8.35 X 56568
Be-Ge-Nd BeNdGe BeZrSi,hP6,194 P63/mmc 0.397,0.397,0.846,90,90,120 AlB2 family - 6.50 X 56568
Be-Ge-O Be2[GeO4] Be2[SiO4],hR126,148 R-3 1.2756,1.2756,0.8425,90,90,120 - - 3.89 A 7553
Be-Ge-Pr BePrGe BeZrSi,hP6,194 P63/mmc 0.404,0.404,0.854,90,90,120 AlB2 family - 6.12 X 56568
Be-Ge-Sm BeSmGe BeZrSi,hP6,194 P63/mmc 0.398,0.398,0.832,90,90,120 AlB2 family - 6.75 X 56568
Be-Ge-Sr SrBe 0.75 Ge1.25 LiBaSi,hP3,187 P-6m2 0.408,0.408,0.466,90,90,120 AlB2 family gray silver 4.58 X 8675
Be-Ge-Tb BeTbGe BeZrSi,hP6,194 P63/mmc 0.394,0.394,0.815,90,90,120 AlB2 family - 7.29 X 56568
Be-H-Li LiBeH3 rhom TiFeO3,hR30,148 R-3 0.52097,0.52097,1.56095,90,90,120 - - 0.52 A 24892
Be-H-Li Li0.5 Be0.5 H1.5 CaC2,cF36,225 Fm-3m 0.509,0.509,0.509,90,90,90 - - 0.48 X 22738
Be-H-N Be[NH2]2 Mg[NH2]2,tI96,142 I41/acd 1.017,1.017,1.6137,90,90,90 - - 1.31 X 10254
Be-H-O Be[OH]2 mon Be[OH]2,mP36,4 P1211 0.8646,0.4746,1.102,90,98.94,90 clinobehoite colorless 1.92 X 22207
Be-H-O Be[OH]2 orth Zn[OH]2,oP12,19 P212121 0.453,0.4621,0.7048,90,90,90 behoite colorless 1.94 X 35117
Be-H-Zr Be2ZrH0.56 ht Be2ZrH1.5 ,hP5,191 P6/mmm 0.3814,0.3814,0.32755,90,90,120 - - 4.42 X 47339
Be-Hf-Ni Be15 Hf6Ni8 Be15 Cu8Ta6,cF116,225 Fm-3m 1.099,1.099,1.099,90,90,90 - - 8.39 A 3198
Be-Hf-Pd Be15 Hf6Pd8 Be15 Cu8Ta6,cF116,225 Fm-3m 1.12,1.12,1.12,90,90,90 - - 9.73 A 3206
Be-Hf-Si BeHfSi BeZrSi,hP6,194 P63/mmc 0.3693,0.3693,0.7135,90,90,120 AlB2 family - 8.50 X 1481
Be-Ho-Si BeHoSi BeZrSi,hP6,194 P63/mmc 0.383,0.383,0.794,90,90,120 AlB2 family - 6.65 X 56568
Be-K-O K2BeO2 K2BeO2,mP20,14 P121/c1 0.7098,0.5708,1.0577,90,131.3,90 - colorless 2.46 X 8479
Be-K-O K4Be 3O5 K4Be3O5,mS48,15 C12/c1 1.0381,0.7228,1.0788,90,118.36,90 - colorless 2.46 X 24231
Be-K-P K4BeP 2 K4CdP 2,hR21,166 R-3m 0.5588,0.5588,2.5132,90,90,120 - red dark 1.67 X 24267
Be-La-O Be2La2O5 Be2La2O5,mS36,15 C12/c1 0.75356,0.73476,0.74387,90,91.55,90 - - 6.06 X 3849
Be-La-Si BeLaSi BeZrSi,hP6,194 P63/mmc 0.398,0.398,0.874,90,90,120 AlB2 family - 4.88 X 56568
Be-Li-N LiBeN LiBeN,mP12,14 P121/c1 0.454,0.476,0.5807,90,124.9,90 - colorless 1.93 X 32577
324 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Be-Li-P LiBeP MnAlGe,tP6,129 P4/nmm 0.3617,0.3617,0.6032,90,90,90 - - 1.97 X 9179


Be-Li-Sb LiBeSb LiGaGe,hP6,186 P63 mc 0.4152,0.4152,0.6738,90,90,120 AlB2 family black 4.55 A 10561
Be-Lu-Si BeLuSi BeZrSi,hP6,194 P63 /mmc 0.38,0.38,0.774,90,90,120 AlB2 family - 7.28 X 56568
Be-Mg-N MgBe2N2 Ce2SO2,hP5,164 P-3m1 0.29553,0.29553,0.5088,90,90,120 - white 3.04 X 42550
Be-Mo-Nb Be2Nb0.5 Mo 0.5 hex MgZn2,hP12,194 P63 /mmc 0.4539,0.4539,0.7415,90,90,120 Friauf-Laves phase - 5.65 A 9440
Be-Mo-Nb Be2Nb0.9 Mo 0.1 cub MgCu2,cF24,227 Fd-3m 0.6517,0.6517,0.6517,90,90,90 Friauf-Laves phase - 5.34 X 9440
Be-Mo-Ta Be2Ta0.5 Mo0.5 MgZn2,hP12,194 P63 /mmc 0.4522,0.4522,0.7392,90,90,120 Friauf-Laves phase - 7.94 A 9440
Be-N-O Be4[NO3]6O cub Be4[NO3]6 O,cP232,205 Pa-3 1.4025,1.4025,1.4025,90,90,90 - colorless 2.04 X 32815
Be-N-O Be4[NO3]6O trig Be4[NO3]6 O,hP87,143 P3 1.3638,1.3638,0.6475,90,90,120 - - 2.03 X 38012
Be-N-O [NO]2Be[NO3]4 [NO]2Be[NO3]4,oF168,43 Fdd2 1.3471,2.391,0.6229,90,90,90 - - 2.10 X 38012
Be-N-P BeP2N4 Be2[SiO4],hR126,148 R-3 1.26897,1.26897,0.83469,90,90,120 - - 3.26 X 53911
Be-N-Si BeSiN2 orth NaFeO2,oP16,33 Pna21 0.4977,0.5747,0.4674,90,90,90 adamantane structure - 3.24 X 3760
Be-N-Si Be0.5 Si0.5 N hex ZnO,hP4,186 P63 mc 0.28629,0.28629,0.46535,90,90,120 adamantane structure gray 3.27 A 20577
Be-N-Sr SrBe2N2 CaB2C2,tI20,140 I4/mcm 0.56213,0.56213,0.75512,90,90,90 - yellow 3.72 X 42550
Be-Na-O Na2BeO2 Na2BeO2,mP40,4 P1211 0.7882,0.5308,1.152,90,99.3,90 - colorless 2.43 X 23018
Be-Na-O Na6Be8O11 Na6Be8O11 ,aP25,2 P-1 0.5321,0.6424,0.8391,101.7,96.4,105.8 - colorless 2.41 X 21961
Be-Na-Sb NaBeSb BeZrSi,hP6,194 P63 /mmc 0.4144,0.4144,0.932,90,90,120 AlB2 family black gray 3.68 X 11096
Be-Nb-Ni Be15Nb6Ni8 Be15Cu8Ta6,cF116,225 Fm-3m 1.073,1.073,1.073,90,90,90 - - 6.25 A 3198
Be-Nb-Ti Be2Ti0.5 Nb0.5 MgCu2,cF24,227 Fd-3m 0.6498,0.6498,0.6498,90,90,90 Friauf-Laves phase - 4.28 X 9440
Be-Nd-Si BeNdSi BeZrSi,hP6,194 P63 /mmc 0.393,0.393,0.843,90,90,120 AlB2 family - 5.34 X 56568
Be-Ni-Si BeNi2Si Cu2MnAl,cF16,225 Fm-3m 0.543,0.543,0.543,90,90,90 b.c.c. family - 6.41 X 3666
Be-Ni-Ta Be15Ta6Ni8 Be15Cu8Ta6,cF116,225 Fm-3m 1.068,1.068,1.068,90,90,90 - - 9.22 A 3198
Be-Ni-Zr Be15Zr6Ni8 Be15Cu8Ta6,cF116,225 Fm-3m 1.106,1.106,1.106,90,90,90 - - 5.66 A 3198
Be-O-P BeP2O6 ht BeP2O6,oS72,20 C222 1 0.9968,1.008,0.8692,90,90,90 - colorless 2.54 X 14740
Be-O-P BeP2O6 rt BeP2O6,mP36,14 P121/c1 0.4839,1.2853,0.7238,90,113.006,90 - colorless 2.68 X 10456
Be-O-Pr BePr2.25 O5 m BePr2.25 O5 ,oP36,33 Pna21 0.9541,0.6557,0.7227,90,90,90 - brown red 5.97 X 14725
Be-O-Rh BeRh2O4 cub MgAl2O4,cF56,227 Fd-3m 0.8384,0.8384,0.8384,90,90,90 spinel family - 6.29 A 11829
Be-O-Rh BeRh2O4 tet CuCr2O4,tI28,141 I41/amd 0.59256,0.59256,0.8389,90,90,90 spinel family - 6.29 A 19518
Be-O-S Be[SO4] B[PO4],tI12,82 I-4 0.4485,0.4485,0.69,90,90,90 - colorless 2.51 X 792
Be-O-Si Be2[SiO4] Be2[SiO4],hR126,148 R-3 1.2466,1.2466,0.8244,90,90,120 phenakite colorless 2.97 X 30367
Be-O-Sr SrBe3O4 SrBe3O4,hP16,190 P-62c 0.45961,0.45961,0.893,90,90,120 - colorless 3.63 X 4379
Be-O-Sr Sr2Be3O5 *,o**,* - 0.713,0.901,1.85,90,90,90 - - - N 1607
Be-O-Te Be4TeO7 Be4TeO7,cF48,216 F-43m 0.7577,0.7577,0.7577,90,90,90 - white 4.21 X 10481
Be-O-Y BeY2O4 BeY2O4,oP28,62 Pnma 1.04,0.35315,0.98989,90,90,90 - colorless 4.58 X 3326
Be-Pd-Zr Be15Zr6Pd8 Be15Cu8Ta6,cF116,225 Fm-3m 1.125,1.125,1.125,90,90,90 - - 7.15 A 3206
Be-Pr-Si BePrSi BeZrSi,hP6,194 P63 /mmc 0.394,0.394,0.845,90,90,120 AlB2 family - 5.20 X 56568
Be-Se-Zn Be0.06 Zn0.94 Se hp NaCl,cF8,225 Fm-3m 0.4998,0.4998,0.4998,90,90,90 rocksalt family - 7.50 X 54642
Be-Se-Zn Be0.06 Zn0.94 Se ZnS,cF8,216 F-43m 0.5648,0.5648,0.5648,90,90,90 adamantane structure - 5.20 X 54642
Be-Si-Sm BeSmSi BeZrSi,hP6,194 P63 /mmc 0.39,0.39,0.826,90,90,120 AlB2 family - 5.72 X 56568
Be-Si-Sr SrBe0.75 Si1.25 AlB2,hP3,191 P6/mmm 0.403,0.403,0.468,90,90,120 AlB2 family gray 3.27 X 8675
Be-Si-Tb BeTbSi BeZrSi,hP6,194 P63 /mmc 0.386,0.386,0.802,90,90,120 AlB2 family - 6.29 X 56568
Be-Si-Zr BeZrSi BeZrSi,hP6,194 P63 /mmc 0.371,0.371,0.719,90,90,120 AlB2 family - 4.97 X 551
Be-Ta-Ti Be2Ti0.35 Ta0.65 MgCu2,cF24,227 Fd-3m 0.6487,0.6487,0.6487,90,90,90 Friauf-Laves phase - 7.42 X 9440
Be-Th-U Be13Th0.02 U0.98 NaZn13,cF112,226 Fm-3c 1.02575,1.02575,1.02575,90,90,90 - - 4.37 A 18399
Bi-Br-Cs Cs3Bi2Br9 lt Cs3Bi2Br9 ,mS56,15 C12/c1 1.3675,0.78593,1.96321,90,90.47,90 - - 4.84 X 40665
Bi-Br-Cs Cs3Bi2Br9 rt Cs3Fe2Cl9 ,hP14,164 P-3m1 0.7972,0.7972,0.9867,90,90,120 - yellow 4.70 X 10428
Bi-Br-Ga GaBi4Br4 GaSb4Cl4,oP72,33 Pna21 1.83014,1.03391,1.35763,90,90,90 - black 6.34 X 44559
Bi-Br-Ga Ga3Bi5Br12 Ga3Bi5Br12 ,cF600,226 Fm-3c 1.76263,1.76263,1.76263,90,90,90 - brown dark 5.37 X 44559
Bi-Br-Hf Hf3Bi10Br18 *,hP62,176 P63 /m 1.4436,1.4436,1.1088,90,90,120 - - - N 32334
Bi-Br-I BiI0.25 Br0.75 Bi(I0.75 Br0.25 ),oS32,36 Cmc21 0.43558,1.3453,1.9327,90,90,90 - black 7.05 X 39351
Bi-Br-I BiI0.75 Br0.25 Bi(I0.75 Br0.25 ),oS32,36 Cmc21 0.4382,1.3993,1.9636,90,90,90 - black 7.15 X 39351
Bi-Br-I Bi2IBr Bi2IBr,mS48,12 C12/m1 1.3617,0.43795,2.9507,90,96.72,90 - black 7.12 X 39351
Bi-Br-In InBi2.778 Br4 rt InBi2.778 I4 ,cF3256,226 Fm-3c 1.932,1.932,1.932,90,90,90 - black 5.61 A 53410
Bi-Br-In InBi37Br48 InBi37Br48 ,hP172,173 P63 2.2626,2.2626,1.3056,90,90,120 - black 6.70 X 42374
Bi-Br-Ir Ir3Bi34Br37 Ir3Bi34Br37 ,aP74,1 P1 1.3034,1.3034,1.6474,90.,90.,120. - black 7.29 X 35203
Bi-Br-La La5Bi3Br CuHf5Sn3,hP18,193 P63 /mcm 0.9742,0.9742,0.6795,90,90,120 AlB2 family - 8.33 X 40288
Bi-Br-Ni Ni2Bi6.9Br5 rt Ni2Bi6.9Br5,oS76,63 Cmcm 0.40673,2.3292,1.7123,90,90,90 - black 8.02 X 45734
Bi-Br-Ni Ni4Bi12.86 Br6 Ni4Bi12.86 Br6,oI60,71 Immm 0.40569,0.874,3.7447,90,90,90 - black 8.51 X 36646
Bi-Br-O BiBrO PbClF,tP6,129 P4/nmm 0.39233,0.39233,0.8105,90,90,90 - yellowish 8.12 X 18769
Bi-Br-O Bi12Br5O15.5 Bi12Br5O15.5 ,mS80,12 C12/m1 2.9977,0.4005,1.0141,90,90.197,90 - brown 8.61 X 36942
Bi-Br-O Bi3BrO4 Bi3BrO4,oP32,52 Pnna 0.57051,1.8949,0.56935,90,90,90 - - 8.32 X 16943
Bi-Br-O Bi4Br2O5 Bi4Br2O5,mP44,4 P1211 1.0782,0.5605,1.4539,90,97.75,90 - yellow 8.21 X 39590
Bi-Br-O Bi5BrO7 Bi5BrO7,oS104,64 Cmce 1.6087,0.52965,2.3022,90,90,90 - colorless 8.38 X 47841
Bi-Br-Pb Pb9Bi39Br47 Pb6(Pb0.75 Bi0.25)4Bi38Br47,mS392,12 C12/m1 1.8832,1.8961,3.6355,90,97.51,90 - black 7.11 X 57461
Bi-Br-Pd PdBi14Br16 PdBi14Br16 ,aP31,2 P-1 1.0848,1.103,1.1157,118.15,108.82,91.94 - gray 6.59 X 41124
Bi-Br-Pr Pr5Bi3Br CuHf5Sn3,hP18,193 P63 /mcm 0.9528,0.9528,0.6618,90,90,120 AlB2 family - 9.01 A 36169
Bi-Br-Pt PtBi6Br10 PtBi6Cl10,oP136,62 Pnma 1.68239,2.7311,0.9783,90,90,90 - - 6.64 X 51571
Bi-Br-Pt Pt3Bi20Br36 Pt3Bi20Br36 ,mS118,12 C12/m1 1.6176,1.4885,1.7524,90,110.85,90 - black 6.44 X 51548
Bi-Br-Rb Rb3BiBr6 Rb3BiBr6,oP80,62 Pnma 1.3311,2.663,0.8603,90,90,90 - yellow 4.12 X 11223
Bi-Br-Rh RhBi11.3 Br12.3 IrBi11.23 Cl12.23 ,hR87,146 R3 1.2961,1.2961,1.6416,90,90,120 - - 7.19 X 40678
Bi-Br-Rh RhBi7Br8 RhBi7Br8,mP64,14 P121/c1 0.9131,1.4726,1.80684,90,118.569,90 - black 6.86 X 32742
Bi-Br-Rh Rh2Bi9Br3 Rh2Bi9Br3 ,mP84,11 P121/m1 0.92798,1.3721,1.9927,90,100.77,90 - black 9.30 X 38210
Bi-Br-Rh Rh3Bi12Br2 Rh3Bi12Br2,oF136,70 Fddd 0.71712,1.68037,3.1871,90,90,90 - black 10.30 X 39372
Bi-Br-Ru RuBi4Br2 RuBi4Br2,mS28,12 C12/m1 1.59538,0.6639,1.0726,90,130.595,90 - gray dark 8.45 X 33762
Bi-Br-Ru Ru3Bi24Br20 Ru3Bi24Br20,oP188,33 Pna21 3.2223,1.3778,1.3778,90,90,90 - black 7.51 X 33763
Bi-Br-S BiSBr BiSCl,oP12,62 Pnma 0.81666,0.40492,0.98532,90,90,90 demicheleite-(Br) red dark 6.54 X 17647
Bi-Br-S Bi6.33 S9Br Bi6.33 S9I,hP34,173 P63 1.5545,1.5545,0.4019,90,90,120 - black 6.68 X 9574
Bi-Br-Se BiSeBr BiSCl,oP12,62 Pnma 0.818,0.411,1.047,90,90,90 - - 6.94 X 354
Handbook of Inorganic Substances – Edition 2015 : Data 325

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Br-Se Bi3Se 4Br Bi3Se4Br,mS32,12 C12/m1 2.0529,0.40625,1.2024,90,115.334,90 - black 7.49 X 38338


Bi-Br-Sn Sn7Bi18Br24 Sn7Bi18Br24,tI132,108 I4cm 1.3237,1.3237,1.81686,90,90,90 - black 6.79 X 55496
Bi-Br-Te BiTeBr CdI2 ,hP3,164 P-3m1 0.42662,0.42662,0.6487,90,90,120 CdI2-PbI2 polytype - 6.76 X 30516
Bi-Br-Te BiTe 2Br4 BiTe 2Br4,aP14,2 P-1 0.726,0.7737,0.9018,92.95,102.23,92.87 - black 5.28 X 32897
Bi-Br-W W3BiBr9 W3BiBr9,mP52,14 P121/c1 0.9818,1.3059,1.2568,90,101.81,90 Chevrel phase amber 6.23 X 55461
Bi-Br-Zr Zr3Bi10Br18 Hf3Bi10Cl18,hP64,176 P63/m 1.439,1.439,1.107,90,90,120 - - 6.36 X 32334
Bi-C-O Bi2[CO3]O2 bis Bi2[CO3]O2,oI16,44 Imm2 0.3865,0.3862,1.3675,90,90,90 bismutite brown 8.30 X 39890
Bi-C-O Bi2[CO3]O2 rt Bi2[CO3]O2,oP64,33 Pna21 0.5468,2.732,0.5468,90,90,90 - - 8.29 X 21615
Bi-C-O Bi2[CO3]O2 tet Bi2[CO3]O2,tI54,139 I4/mmm 0.3867,0.3867,1.3689,90,90,90 - - 8.27 A 55987
Bi-C-Y Y1.8 Bi0.2 C2.9 Pu2C3,cI40,220 I-43d 0.8239,0.8239,0.8239,90,90,90 - - 5.62 A 4710
Bi-Ca-Cd Ca21 Cd4Bi18 Sr21Mn4Sb18,mS172,12 C12/m1 1.7566,1.6721,1.7233,90,92.095,90 - - 6.64 A 50402
Bi-Ca-Cd Ca9Cd4Bi9 Ca9Mn4Bi9,oP44,55 Pbam 1.278,2.258,0.474,90,90,90 - gray steel 6.53 X 14784
Bi-Ca-Cd Ca9Cd4.06 Bi9 Zn4.23 Yb9Sb9,oP48,55 Pbam 1.27079,2.2499,0.47229,90,90,90 - black 6.64 X 48508
Bi-Ca-Cu CaCuBi BeZrSi,hP6,194 P63/mmc 0.4559,0.4559,0.8053,90,90,120 AlB2 family - 7.16 X 23592
Bi-Ca-D Ca5Bi3D0.93 Ba3FeS5,oP36,62 Pnma 1.26068,0.9707,0.84384,90,90,90 - - 5.33 X 54896
Bi-Ca-H Ca5Bi3H *,oP*,62 Pnma 1.2609,0.97141,0.84443,90,90,90 - - - N 34418
Bi-Ca-K KCaBi PbClF,tP6,129 P4/nmm 0.5384,0.5384,0.838,90,90,90 - gray 3.94 X 42488
Bi-Ca-Li LiCaBi TiNiSi,oP12,62 Pnma 0.777,0.475,0.844,90,90,90 AlB2 family black 5.46 X 9488
Bi-Ca-Mg CaMg2Bi2 Ce2SO2,hP5,164 P-3m1 0.47236,0.47236,0.76512,90,90,120 - gray silver 5.69 X 56275
Bi-Ca-Mn CaMnBi2 CuHfSi2,tP8,129 P4/nmm 0.45,0.45,1.108,90,90,90 - gray 7.59 X 13858
Bi-Ca-Mn CaMn2Bi2 Ce2SO2,hP5,164 P-3m1 0.463,0.463,0.764,90,90,120 - gray silver 6.65 X 10296
Bi-Ca-Mn Ca14 MnBi11 Ca14 AlSb11,tI208,142 I41/acd 1.7002,1.7002,2.2422,90,90,90 - black 5.97 X 25886
Bi-Ca-Mn Ca21 Mn4Bi18 Ca21 Mn4Sb18,mS172,15 C12/c1 1.747,1.7392,1.7208,90,93.253,90 - black 6.14 X 48482
Bi-Ca-Mn Ca9Mn4Bi9 Ca9Mn4Bi9,oP44,55 Pbam 1.2499,2.2367,0.4706,90,90,90 - black 6.21 X 54022
Bi-Ca-N Ca3BiN CaTiO3,cP5,221 Pm-3m 0.48884,0.48884,0.48884,90,90,90 perovskite family - 4.88 X 26375
Bi-Ca-O CaBi2O4 rt CaBi2O4,mS112,15 C12/c1 1.6613,1.159,1.21882,90,124.387,90 - - 7.16 X 29057
Bi-Ca-O Ca0.1 Bi1.9O2.95 m Bi2O3,tP20,117 P-4b2 0.79125,0.79125,0.5595,90,90,90 - - 8.50 A 9992
Bi-Ca-O Ca0.274 Bi0.726 O1.363 *,hR*,* - 0.38,0.38,0.9633,90,90,120 fluorite family - - N 9992
Bi-Ca-O Ca0.29 Bi0.71 O1.355 ht CaF2 ,cF12,225 Fm-3m 0.563,0.563,0.563,90,90,90 fluorite family - 6.76 X 34752
Bi-Ca-O Ca0.39 Bi2.61 O4.305 ht (Eu0.5 Yb0.5 )Fe2O4,hR21,166 R-3m 0.395,0.395,2.787,90,90,120 - - 8.33 A 14647
Bi-Ca-O Ca0.4 Bi0.6O1.3 ht NdO1.5 ,cI26,229 Im-3m 0.4246,0.4246,0.4246,90,90,90 - yellow 7.04 X 29025
Bi-Ca-O Ca0.528 Bi2.472 O4.236 rt (Ca0.53 Bi0.47)Bi2O4.24 ,mS72,12 C12/m1 1.3653,0.7866,0.9554,90,103.76,90 - golden 8.07 X 21643
Bi-Ca-O Ca2Bi2O5 rt Ca2Bi2O5,aP54,2 P-1 1.0101,1.013,1.0466,116.86,107.18,92.9 - green faint 6.46 X 27627
Bi-Ca-O Ca26 Bi74O137 ht *,hP*,* - 1.0101,1.0101,0.9662,90,90,120 - - - N 29243
Bi-Ca-O Ca4Bi2O K2NiF4,tI14,139 I4/mmm 0.4719,0.4719,1.6505,90,90,90 high-Tc family black 5.37 X 48550
Bi-Ca-O Ca4Bi6O13 rt Ca4Bi6O13,oS48,38 Amm2 0.7206,1.7356,0.5937,90,90,90 - yellow 7.26 X 23289
Bi-Ca-Pd CaPdBi HoNiGa,oP12,62 Pnma 0.7422,0.4753,0.8085,90,90,90 AlB2 family gray 8.28 X 26866
Bi-Ca-Pd Ca3Pd4Bi8 Ca3Pd4Bi8,oP30,55 Pbam 1.0814,1.705,0.4149,90,90,90 - black gray 9.63 X 40932
Bi-Ca-S Ca0.9998 Bi0.0002 S NaCl,cF8,225 Fm-3m 0.5686,0.5686,0.5686,90,90,90 rocksalt family - 2.61 X 49234
Bi-Ca-Te Ca4Bi2Te Th3P 4,cI28,220 I-43d 0.9591,0.9591,0.9591,90,90,90 - - 5.31 A 12608
Bi-Ca-Zn Ca9Zn4Bi9 Ca9Mn4Bi9,oP44,55 Pbam 1.264,2.212,0.465,90,90,90 - - 6.39 X 12863
Bi-Ca-Zn Ca9Zn4.09 Bi9 Zn4.23 Yb9Sb9,oP48,55 Pbam 1.25898,2.20688,0.46336,90,90,90 - black 6.47 X 48508
Bi-Cd-Eu Cd3Eu5Bi6 Cd3Eu5Bi6,oS30,65 Cmmm 0.784,2.406,0.47809,90,90,90 - black 8.66 X 48111
Bi-Cd-Eu Cd4Eu21Bi18 Sr21Mn4Sb18,mS172,12 C12/m1 1.83298,1.74929,1.79504,90,92.073,90 - - 8.55 X 50402
Bi-Cd-Eu Cd4.21 Eu9Bi9 Zn4.23 Yb9Sb9,oP48,55 Pbam 1.30114,2.31615,0.48588,90,90,90 - black 8.44 X 48508
Bi-Cd-F Cd0.1 Bi0.9F2.9 HoH3,hP24,165 P-3c1 0.71,0.71,0.726,90,90,120 - - 8.00 A 23981
Bi-Cd-F Cd0.65 Bi0.35 F2.35 CeH3,cF44,225 Fm-3m 0.558,0.558,0.558,90,90,90 fluorite family - 7.30 A 23981
Bi-Cd-O CdBi2O4 rt CdBi2O4,tI112,141 I41/amd 1.44963,1.44963,0.93193,90,90,90 - yellow 8.06 X 28631
Bi-Cd-O Cd0.032 Bi12.968 O19.484 Ga0.5 Bi12.5 O19.5 ,cI74,197 I23 1.02652,1.02652,1.02652,90,90,90 - - 9.29 X 35594
Bi-Cd-O Cd0.21 Bi0.79 O1.395 ht VH0.5 ,cI14,229 Im-3m 0.4281,0.4281,0.4281,90,90,90 - brown red 8.93 X 19276
Bi-Cd-O Cd0.7 Bi12O18.7 ht Bi12 SiO20,cI66,197 I23 1.01938,1.01938,1.01938,90,90,90 - brown 9.05 X 43563
Bi-Cd-O Cd3Bi10O18 ht *,hR*,* - 0.61,0.61,0.67709,90,90,120 - - - N 23399
Bi-Cd-O Cd4Bi2O7 rt Cd4Bi2O7,tI112,88 I41/a 1.4494,1.4494,0.9317,90,90,90 - gray 6.65 X 26727
Bi-Cd-S CdBi2S4 HgBi2S4,mS28,12 C12/m1 1.3095,0.39792,1.4677,90,116.816,90 - - 6.41 X 32915
Bi-Cd-S CdBi4S7 ht *,m**,* - 1.1765,0.40032,1.3112,90,105.21,90 - - - N 32915
Bi-Cd-S Cd2Bi6S11 *,m**,* - 1.3112,0.3997,3.584,90,90.39,90 - - - N 32915
Bi-Cd-S Cd2.8 Bi8.1S15 Cd2.8 Bi8.1S15,mS52,12 C12/m1 1.3111,0.39885,2.471,90,97.84,90 - - 6.46 X 32915
Bi-Cd-Se CdBi2Se4 ht *,t**,* - 1.3736,1.3736,1.3515,90,90,90 - - - N 19525
Bi-Cd-Sr SrCdBi2 SrZnBi2,tI16,139 I4/mmm 0.4635,0.4635,2.288,90,90,90 - - 8.35 X 14270
Bi-Cd-Sr Sr21 Cd4Bi18 Sr21Mn4Sb18,mS172,12 C12/m1 1.851,1.7685,1.8213,90,92.064,90 - - 6.75 X 50402
Bi-Cd-Sr Sr9Cd4Bi9 Ca9Mn4Bi9,oP44,55 Pbam 1.327,2.347,0.489,90,90,90 - gray steel 6.80 X 14784
Bi-Cd-Sr Sr9Cd4.27 Bi9 Zn4.23 Yb9Sb9,oP48,55 Pbam 1.3186,2.3402,0.48906,90,90,90 - black 6.93 X 48508
Bi-Cd-Te Cd0.05 Bi1.95 Te2.98 Bi2Te3,hR15,166 R-3m 0.435,0.435,3.044,90,90,120 - - 7.92 A 14566
Bi-Cd-Yb Cd4.01Yb9Bi9 Zn4.23 Yb9Sb9,oP48,55 Pbam 1.2629,2.2426,0.472,90,90,90 - black 9.66 X 48508
Bi-Ce-Cu CuCe5Bi3 CuHf5Sn3,hP18,193 P63/mcm 0.959,0.959,0.659,90,90,120 AlB2 family - 8.80 A 4690
Bi-Ce-Cu Cu0.71 CeBi2 CuHfSi2,tP8,129 P4/nmm 0.4555,0.4555,0.9772,90,90,90 - - 9.88 X 31319
Bi-Ce-Ge CeGeBi2 SrZnBi2,tI16,139 I4/mmm 0.4738,0.4738,1.5484,90,90,90 - - 12.05 X 35106
Bi-Ce-Ge Ce3GeBi Gd3Ga2,tI80,140 I4/mcm 1.2257,1.2257,1.62,90,90,90 - - 7.66 A 35106
Bi-Ce-Ge Ce5GeBi2 Y2HfS5,oP32,62 Pnma 1.26354,0.95752,0.83316,90,90,90 - - 7.85 X 56869
Bi-Ce-Mn Ce3MnBi5 CuHf5Sn3,hP18,193 P63/mcm 0.96229,0.96229,0.6442,90,90,120 AlB2 family - 9.77 X 50416
Bi-Ce-Ni CeNi0.8 Bi2 CuHfSi2,tP8,129 P4/nmm 0.45439,0.45439,0.96414,90,90,90 - - 10.09 X 57167
Bi-Ce-Ni CeNi1.5 Bi2 CaBe2Ge2,tP10,129 P4/nmm 0.4546,0.4546,0.9656,90,90,90 - - 10.75 A 21323
Bi-Ce-O Ce0.75 Bi0.25 O1.875 CaF2 ,cF12,225 Fm-3m 0.5438,0.5438,0.5438,90,90,90 fluorite family yellow 7.74 X 54018
Bi-Ce-O Ce2BiO2 (Li0.25 Bi0.75 )2ClO2,tI10,139 I4/mmm 0.40369,0.40369,1.3746,90,90,90 - - 7.73 X 52512
Bi-Ce-Pd CePdBi MgAgAs,cF12,216 F-43m 0.6818,0.6818,0.6818,90,90,90 - - 9.55 X 51123
Bi-Ce-Pd Ce3Pd3Bi4 Au3 Y3Sb4,cI40,220 I-43d 1.0052,1.0052,1.0052,90,90,90 - - 10.30 X 51123
Bi-Ce-Pt CePtBi MgAgAs,cF12,216 F-43m 0.6779,0.6779,0.6779,90,90,90 - - 11.60 X 40552
Bi-Ce-Pt Ce3Pt3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.9998,0.9998,0.9998,90,90,90 - - 12.24 X 26616
326 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Ce-Rh CeRhBi TiNiSi,oP12,62 Pnma 0.74648,0.47173,0.79715,90,90,90 AlB2 family - 10.70 A 37437


Bi-Ce-S Ce1.25 Bi3.78 S8 Ce1.25 Bi3.78 S8,oP56,62 Pnma 1.655,0.4053,2.152,90,90,90 - - 5.62 X 10421
Bi-Ce-S Ce4Bi2S9 La4Bi2S9,oP60,62 Pnma 2.85,0.402,1.278,90,90,90 - - 5.75 A 33698
Bi-Ce-S Ce7.5 Bi2.5S15 Pr10S14O,tI200,142 I41/acd 1.56,1.56,2.06,90,90,90 - - 5.44 A 33698
Bi-Ce-Sb CeBi0.2 Sb0.8 NaCl,cF8,225 Fm-3m 0.6438,0.6438,0.6438,90,90,90 rocksalt family - 6.95 X 13608
Bi-Ce-Si Ce5Bi2.1 Si0.9 Y2HfS5,oP32,62 Pnma 1.26368,0.95556,0.83736,90,90,90 - black 7.65 X 56869
Bi-Ce-Te CeBiTe3 *,h**,* - 0.419,0.419,3.116,90,90,120 - black - N 12680
Bi-Ce-Zn ZnCe6Bi14 ZnCe6Bi14 ,oI46,71 Immm 0.43916,1.5399,1.9315,90,90,90 - - 9.74 X 50116
Bi-Ce-Zn Zn0.47 CeBi2 CuHfSi2,tP8,129 P4/nmm 0.4572,0.4572,0.983,90,90,90 - - 9.52 X 50569
Bi-Cl-Cs Cs3BiCl6 orth Rb3BiBr6,oP80,62 Pnma 1.3129,2.6593,0.829,90,90,90 - colorless 3.77 A 19319
Bi-Cl-Cs Cs3BiCl6 rt Cs3BiCl6,mS80,15 C12/c1 2.7017,0.8252,1.3121,90,99.7,90 - - 3.78 X 19319
Bi-Cl-Cs Cs3Bi2Cl9 ht Cs3As2Cl9 ,hP14,150 P321 0.7823,0.7823,0.9613,90,90,120 - - 3.70 X 13799
Bi-Cl-Cs Cs3Bi2Cl9 rt Cs3Sb2Cl9 ,oP56,62 Pnma 1.8684,0.7644,1.3227,90,90,90 - colorless 3.99 X 7893
Bi-Cl-F [ClF2]BiF6 [ClF2]SbF6,aP20,2 P-1 0.5174,0.5674,1.0552,88.72,94.03,87.8 - - 4.27 X 26667
Bi-Cl-Ga GaBi4Cl4 GaBi4Cl4,hP108,173 P63 1.776,1.776,1.2979,90,90,120 - black 5.89 X 44561
Bi-Cl-Ga Ga3Bi5Cl12 Al3Bi5Cl12 ,hR120,167 R-3c 1.1871,1.1871,3.0101,90,90,120 - red 4.56 X 31615
Bi-Cl-Hf Hf3Bi10Cl18 Hf3Bi10Cl18 ,hP64,176 P63 /m 1.389,1.389,1.0692,90,90,120 - - 6.07 X 7368
Bi-Cl-Ir IrBi11.2 Cl12.2 IrBi11.23 Cl12.23 ,hR87,146 R3 1.2666,1.2666,1.586,90,90,120 - - 6.70 X 40678
Bi-Cl-K K7Bi3Cl16 *,h*156,* - 1.281,1.281,3.339,90,90,120 - colorless 3.08 N 770
Bi-Cl-Mo Mo5BiCl14 HgMo6Cl14 ,cP84,201 Pn-3 1.2916,1.2916,1.2916,90,90,90 Chevrel phase black 3.65 X 57445
Bi-Cl-Mo Mo6BiCl15 Mo6BiCl15 ,mS176,15 C12/c1 1.2681,1.3046,2.5719,90,91.79,90 - red light 4.11 X 35196
Bi-Cl-Nb Nb3Bi10Cl18 Hf3Bi10Cl18 ,hP64,176 P63 /m 1.3771,1.3771,1.0655,90,90,120 - black 5.71 X 42867
Bi-Cl-O BiClO PbClF,tP6,129 P4/nmm 0.38903,0.38903,0.73674,90,90,90 - yellow 7.76 X 58493
Bi-Cl-O Bi12Cl2O17 *,t**,* - 0.54391,0.54391,3.51784,90,90,90 - - - N 58493
Bi-Cl-O Bi24Cl10O31 Bi24Cl10O31 ,mP130,13 P12/c1 1.0033,0.79745,2.9552,90,91.258,90 - green pale 8.24 X 36942
Bi-Cl-O Bi3ClO4 rt Bi3ClO4,mS32,15 C12/c1 1.92814,0.56476,0.56954,90,105.651,90 - colorless 8.08 X 35343
Bi-Cl-O Bi4Cl2O5 Bi4Cl2O5,oP132,62 Pnma 4.0532,0.38688,1.5487,90,90,90 - colorless 8.10 X 9609
Bi-Cl-Pd PdBi16Cl22 PdBi16Cl22 ,aP312,2 P-1 2.0477,2.1321,2.1454,91.09,95.14,93.16 - black 6.03 X 43987
Bi-Cl-Pt PtBi12Cl12 PtBi12Cl12 ,aP25,1 P1 0.9052,0.9052,0.9052,89.88,89.88,89.88 - black 7.00 X 47573
Bi-Cl-Pt PtBi6Cl10 PtBi6Cl10,oP136,62 Pnma 1.6325,2.6685,0.9057,90,90,90 - - 6.07 X 51571
Bi-Cl-Pt PtBi6.67 Cl12 PtBi6.67 Cl12 ,hR81,148 R-3 1.27416,1.27416,1.53404,90,90,120 - black 4.65 X 47573
Bi-Cl-Rh RhBi11.7 Cl12.7 IrBi11.23 Cl12.23 ,hR87,146 R3 1.2612,1.2612,1.5917,90,90,120 - - 6.81 X 40678
Bi-Cl-S BiSCl BiSCl,oP12,62 Pnma 0.77508,0.39955,0.9992,90,90,90 demicheleite-(Cl) red dark 5.94 X 13830
Bi-Cl-S Bi3.32 S3.96 Cl2.04 Bi3.32 (S0.66 Cl0.34)6,hP32,176 P63 /m 1.1427,1.1427,0.4071,90,90,120 - black 6.44 X 47079
Bi-Cl-S Bi5S6.25 Cl2.5 ht Bi5(S0.71 Cl0.29)8.75 ,hR168,148 R-3 1.9804,1.9804,1.2359,90,90,120 - black 6.33 X 12080
Bi-Cl-Se BiSeCl BiSeCl,oP12,62 Pnma 0.80787,0.42182,0.93046,90,90,90 - red dark 6.77 X 19756
Bi-Cl-Se Bi11Se12Cl9 Bi11Se12Cl9,mS268,12 C12/m1 2.4182,0.81656,3.6362,90,91.21,90 - black 6.60 X 36690
Bi-Cl-Se Bi2Se2Cl7 Bi2Se2Cl7,tP44,85 P4/n 1.0891,1.0891,0.9937,90,90,90 - red 4.64 X 38248
Bi-Cl-Se Bi2Se4Cl7 Bi2Se4Cl7,aP52,2 P-1 1.0481,1.1701,1.3643,76.04,86.28,67.9 - black 4.34 X 36774
Bi-Cl-Se Bi2Se5Cl7 Bi2Se5Cl7,oP112,19 P212121 1.18457,1.19888,2.19953,90,90,90 - red 4.51 X 55471
Bi-Cl-Se Bi5Se10Cl17 Bi5Se10Cl17 ,mP128,14 P121/c1 1.07924,2.0629,1.6761,90,90.87,90 - gray dark 4.34 X 38248
Bi-Cl-Te BiTeCl CdCl[OH],hP6,186 P63 mc 0.42426,0.42426,1.2397,90,90,120 - - 6.39 X 30516
Bi-Cl-Te Bi0.74 Te4Cl4 Bi0.74 Te4Cl4,tP20,85 P4/n 1.2066,1.2066,0.3524,90,90,90 - golden 5.22 X 57562
Bi-Cl-Te Bi2Te4Cl7 Bi2Te4Cl7 ,oP104,19 P212121 0.8799,1.6423,2.2673,90,90,90 - black 4.77 X 39673
Bi-Cl-Te Bi2Te7Cl8 Bi2Te7Cl8 ,aP34,2 P-1 0.5472,1.3211,1.49,102.09,95.05,96.69 - gray silver 5.10 X 40922
Bi-Cl-Te Bi3Te2Cl10 Bi3Te2Cl10 ,aP30,2 P-1 0.7388,0.8751,1.3891,87.89,82.87,87.89 - violet dark 4.61 X 32897
Bi-Cl-Tl TlBi2Cl7 rt TlBi2Cl7,aP20,2 P-1 0.69329,0.88832,1.07632,75.684,72.477,72.666 - red dark 4.86 X 55524
Bi-Cl-Tl Tl3BiCl6 mon Tl3BiCl6,mS160,9 C1c1 2.6686,1.5127,1.3014,90,108.11,90 steropesite yellow 5.51 X 51911
Bi-Cl-Tl Tl3BiCl6 tet [NH4]3MoCl6,tP20,84 P42 /m 0.8969,0.8969,0.74876,90,90,90 - colorless 5.71 X 55524
Bi-Cl-W W6BiCl15 mon1 Mo6BiCl15 ,mS176,15 C12/c1 1.26935,1.3045,2.5789,90,91.687,90 - black 5.74 X 53501
Bi-Cl-W W6BiCl15 mon2 W6BiCl15,mP88,14 P121/c1 1.3543,1.2344,1.5389,90,118.76,90 - red 5.43 X 53424
Bi-Cl-Zr Zr3Bi10Cl18 *,hP62,176 P63 /m 1.3892,1.3892,1.07,90,90,120 - - - N 32334
Bi-Co-Dy Dy12Co5Bi Ho12Co5Bi,oI36,71 Immm 0.9459,0.9471,0.9949,90,90,90 - gray 9.14 A 44665
Bi-Co-Dy Dy5CoBi2 Y2HfS5,oP32,62 Pnma 1.2113,0.8983,0.7922,90,90,90 - - 9.94 A 56226
Bi-Co-Dy Dy5Co2Bi Mo5SiB2,tI32,140 I4/mcm 0.75748,0.75748,1.3846,90,90,90 - - 9.53 A 50351
Bi-Co-Er Er12Co5Bi Ho12Co5Bi,oI36,71 Immm 0.9327,0.9328,0.9836,90,90,90 - gray 9.74 A 44665
Bi-Co-Er Er5CoBi2 Y2HfS5,oP32,62 Pnma 1.1968,0.898,0.7906,90,90,90 - - 10.27 A 44867
Bi-Co-Er Er6CoBi2 K2UF6,hP9,189 P-62m 0.8208,0.8208,0.40828,90,90,120 Fe2P family - 10.32 X 44864
Bi-Co-Gd Gd12Co5Bi Ho12Co5Bi,oI36,71 Immm 0.9602,0.9623,1.0054,90,90,90 - gray 8.55 A 44665
Bi-Co-Gd Gd5CoBi2 Y2HfS5,oP32,62 Pnma 1.2242,0.9099,0.8017,90,90,90 - - 9.40 A 44867
Bi-Co-Gd Gd5Co1.73 Bi Mo5SiB2,tI32,140 I4/mcm 0.77435,0.77435,1.3734,90,90,90 - - 8.85 X 50351
Bi-Co-Hf Hf6CoBi2 K2UF6,hP9,189 P-62m 0.77782,0.77782,0.36256,90,90,120 Fe2P family - 13.53 X 37266
Bi-Co-Ho Ho12Co5Bi Ho12Co5Bi,oI36,71 Immm 0.9376,0.93787,0.98546,90,90,90 - gray 9.52 X 44665
Bi-Co-Ho Ho5CoBi2 Yb5Sb3,oP32,62 Pnma 1.21526,0.8927,0.79247,90,90,90 - - 10.06 X 50351
Bi-Co-Ho Ho5Co2Bi Mo5SiB2,tI32,140 I4/mcm 0.74816,0.74816,1.38838,90,90,90 - - 9.84 X 50351
Bi-Co-Ho Ho6CoBi2 K2UF6,hP9,189 P-62m 0.8252,0.8252,0.40974,90,90,120 Fe2P family - 10.08 X 50351
Bi-Co-La La6Co13Bi La6Co9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.8114,0.8114,2.3477,90,90,90 - - 7.77 A 27706
Bi-Co-O CoBiO3 hp1 BaBiO3,cF40,225 Fm-3m 0.846,0.846,0.846,90,90,90 perovskite family - 6.93 A 30126
Bi-Co-O CoBiO3 hp2 GdFeO3,oP20,62 Pnma 0.53936,0.75469,0.52963,90,90,90 perovskite family - 9.73 X 54470
Bi-Co-O CoBiO3 orth (K0.5 [H2O]0.5 )(Ta0.5 ...,cF80,227 Fd-3m 1.052,1.052,1.052,90,90,90 pyrochlore family - 7.21 A 4853
Bi-Co-O CoBiO3 tet BaTiO3,tP5,99 P4mm 0.37294,0.37294,0.47238,90,90,90 perovskite family - 7.98 X 46263
Bi-Co-O Co7.95 Bi5.05 O20 Bi12SiO20,cI66,197 I23 1.0138,1.0138,1.0138,90,90,90 - black 5.88 X 28628
Bi-Co-Tb Tb12Co5Bi Ho12Co5Bi,oI36,71 Immm 0.9502,0.9519,0.9989,90,90,90 - gray 8.86 A 44665
Bi-Co-Tb Tb5CoBi2 Y2HfS5,oP32,62 Pnma 1.216,0.907,0.7975,90,90,90 - - 9.60 A 44867
Bi-Co-Te CoBi0.9 Te 1.1 FeSb2,oP6,34 Pnn2 0.5402,0.64,0.3965,90,90,90 pyrite-marcasite family - 9.39 A 20102
Bi-Co-Ti Ti4CoBi2 V4SiSb2,tI28,140 I4/mcm 1.0506,1.0506,0.4882,90,90,90 - gray light 8.24 X 33504
Bi-Co-Tm Tm12Co5Bi Ho12Co5Bi,oI36,71 Immm 0.9272,0.9276,0.9791,90,90,90 - gray 9.98 A 44665
Bi-Co-Tm Tm5Co0.5 Bi2.5 Y2HfS5,oP32,62 Pnma 1.1781,0.9071,0.7936,90,90,90 - - 10.94 A 56226
Handbook of Inorganic Substances – Edition 2015 : Data 327

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Co-Tm Tm6 CoBi2 K2UF6,hP9,189 P-62m 0.8155,0.8155,0.4066,90,90,120 Fe2P family - 10.57 X 41725
Bi-Co-Y Y12Co 5Bi Ho12 Co5Bi,oI36,71 Immm 0.9524,0.9533,0.9952,90,90,90 - gray 5.77 A 44665
Bi-Co-Y Y5CoBi2 Y2HfS5,oP32,62 Pnma 1.2215,0.8948,0.7977,90,90,90 - - 7.02 A 56226
Bi-Co-Y Y6CoBi2 K2UF6,hP9,189 P-62m 0.8312,0.8312,0.4144,90,90,120 Fe2P family - 6.77 X 41725
Bi-Co-Zr ZrCoBi MgAgAs,cF12,216 F-43m 0.61917,0.61917,0.61917,90,90,90 - gray 10.05 X 33145
Bi-Co-Zr Zr6CoBi2 K2UF6,hP9,189 P-62m 0.78496,0.78496,0.37,90,90,120 Fe2P family - 8.61 X 37266
Bi-Cr-O Bi14 [CrO4]O20 lt Bi14 [WO4]O20,mS96,12 C12/m1 1.21697,1.71842,0.86176,90,134.672,90 - - 8.71 X 41980
Bi-Cr-O Bi6[CrO4]2O7 Sb6[SO4]2O7,oS92,37 Ccc2 1.23018,1.98749,0.58816,90,90,90 - green dark 7.38 X 40426
Bi-Cr-O Bi8[CrO4]O11 Bi8[CrO4]O11,mP96,11 P121/m1 0.9657,1.1934,1.3868,90,104.14,90 - yellow 8.42 X 47120
Bi-Cr-O CrBiO3 cub *,cF40,* - 0.778,0.778,0.778,90,90,90 perovskite family - - N 6991
Bi-Cr-O CrBiO3 hp *,aP5,1 P1 0.387,0.3906,0.3906,89.15,89.45,89.45 - - - N 30126
Bi-Cr-O CrBiO3 ht GdFeO3,oP20,62 Pnma 0.55457,0.77577,0.54286,90,90,90 perovskite family - 8.79 X 50154
Bi-Cr-O CrBiO3 rt ScBiO3,mS40,15 C12/c1 0.94658,0.5481,0.95879,90,108.564,90 - - 8.70 X 50154
Bi-Cr-O CrBi14O24 rt Bi14 [CrO4]O20,tI108,87 I4/m 0.8684,0.8684,1.7238,90,90,90 - orange red 8.59 X 37553
Bi-Cr-O Cr0.15 Bi0.85 O1.73 CaF2 ,cF12,225 Fm-3m 0.56025,0.56025,0.56025,90,90,90 fluorite family red 8.05 X 39073
Bi-Cr-O Cr0.33 Bi12.67 O20 Bi12 SiO20,cI66,197 I23 1.0239,1.0239,1.0239,90,90,90 - - 9.24 A 15164
Bi-Cr-O Cr5Bi31O61.5 Cr5Bi31O61.5 ,mP384,14 P121/c1 2.3579,1.16189,2.81773,90,124.696,90 - orange red 8.08 X 54877
Bi-Cr-Ti Ti4CrBi2 V4SiSb2,tI28,140 I4/mcm 1.0516,1.0516,0.5067,90,90,90 - gray light 7.84 A 33504
Bi-Cr-Zr Zr5Cr0.5Bi2.5 W5Si3,tI32,140 I4/mcm 1.1286,1.1286,0.564,90,90,90 - gray 9.29 A 43495
Bi-Cs-F CsBiF6 KAsF6,hR24,148 R-3 0.793,0.793,0.8274,90,90,120 - colorless 5.04 X 5589
Bi-Cs-F CsBi2F7 CsBi2F7,oS320,20 C222 1 1.6215,2.8085,1.27,90,90,90 - - 6.28 X 31525
Bi-Cs-I Cs3BiI6 *,hP*,* - 0.95,0.95,0.78,90,90,120 - orange - N 17435
Bi-Cs-I Cs3Bi2I9 lt Cs3Bi2I9,mS56,15 C12/c1 0.8346,1.4472,2.11,90,91.,90 - - 5.11 X 39566
Bi-Cs-I Cs3Bi2I9 rt Cs3Cr2Cl9,hP28,194 P63/mmc 0.8409,0.8409,2.1243,90,90,120 perovskite family red wine 5.00 X 36692
Bi-Cs-In Cs7In4Bi6 Cs7In4Bi6,aP68,2 P-1 1.01851,1.02318,2.7617,94.457,91.462,90.214 - gray 6.12 X 35740
Bi-Cs-Mn CsMnBi PbClF,tP6,129 P4/nmm 0.4843,0.4843,0.8933,90,90,90 - gray 6.29 X 36632
Bi-Cs-Ni Cs2NiBi2 K2PdAs2,oS20,63 Cmcm 0.71533,1.51223,0.67947,90,90,90 - - 6.71 A 29530
Bi-Cs-O CsBiO2 KSbS2,mS16,15 C12/c1 0.8274,0.9204,0.59787,90,122.51,90 - yellow pale 6.47 X 33837
Bi-Cs-O Cs2Bi4O7 Rb2Bi4O7,mS208,15 C12/c1 2.1306,1.3019,1.6056,90,95.725,90 - colorless 7.28 X 41074
Bi-Cs-O Cs3BiO3 Na3AsS3,cP28,198 P213 0.92086,0.92086,0.92086,90,90,90 - yellow 5.58 X 33837
Bi-Cs-O Cs6Bi4O9 Cs6Bi4O9,aP38,2 P-1 0.81382,0.9916,1.21383,103.658,93.694,91.662 - colorless 6.22 X 41074
Bi-Cs-Pd Cs2PdBi2 K2PdAs2,oS20,63 Cmcm 0.70791,1.52001,0.69007,90,90,90 - - 7.07 A 29530
Bi-Cs-Pt Cs2PtBi2 K2PdAs2,oS20,63 Cmcm 0.70102,1.52151,0.68922,90,90,90 - - 7.94 A 29530
Bi-Cs-S CsBiS2 mon CsSbS2,mP16,14 P121/c1 0.7794,0.961,0.7329,90,102.16,90 - red dark 5.03 X 27177
Bi-Cs-S CsBiS2 rhom *,hR*,* - 0.4166,0.4166,4.877,90,90,120 - black - N 27177
Bi-Cs-S CsBi3S5 CsBi3S5,oP36,62 Pnma 1.2098,0.40644,2.1098,90,90,90 - black 5.89 X 13187
Bi-Cs-Sb CsBi1.5 Sb0.5 MgCu2,cF24,227 Fd-3m 0.97,0.97,0.97,90,90,90 Friauf-Laves phase - 7.38 X 43945
Bi-Cs-Se CsBi3Se5 mon RbBi3Se5,mP44,11 P121/m1 1.3603,0.41502,2.1639,90,92.435,90 - - 6.28 X 41602
Bi-Cs-Se CsBi3Se5 orth RbBi3Se5,oP36,62 Pnma 2.274,0.4171,1.2472,90,90,90 - black 6.48 X 46179
Bi-Cs-Se CsBi3.67 Se6 Cs(Pb0.25Bi0.75 )4Se6,oP44,62 Pnma 2.3421,0.41877,1.371,90,90,90 - - 6.79 X 38568
Bi-Cs-Se CsBi4Se7 RbBi4Se7,mS52,12 C12/m1 2.2224,0.4178,1.9742,90,116.384,90 - gray silver 6.15 X 36803
Bi-Cs-Se Cs2Bi4Se7 Rb2Bi4Se7,mP28,11 P121/m1 1.3227,0.41857,1.5556,90,94.592,90 - gray silver 6.40 X 36803
Bi-Cs-Se Cs2Bi8Se13 Rb2Bi8Se13,mP46,11 P121/m1 1.3704,0.41532,2.5008,90,96.848,90 - - 6.97 X 38568
Bi-Cs-Se Cs3BiSe3 Na3AsS3,cP28,198 P213 1.0583,1.0583,1.0583,90,90,90 - black 4.73 X 33774
Bi-Cs-Se Cs3Bi7Se12 Cs3Bi7Se12,mS44,8 C1m1 2.7733,0.4177,1.3286,90,107.9,90 - - 6.37 X 18503
Bi-Cs-Te CsBi4Te6 CsBi4Te6,mS88,12 C12/m1 5.19205,0.44025,1.45118,90,101.48,90 - white silver7.09 X 43063
Bi-Cu-Eu CuEuBi BeZrSi,hP6,194 P63/mmc 0.4622,0.4622,0.8536,90,90,120 AlB2 family blue gray 8.93 X 14785
Bi-Cu-Gd CuGd5Bi3 CuHf5Sn3,hP18,193 P63/mcm 0.9265,0.9265,0.6424,90,90,120 AlB2 family - 10.27 X 4690
Bi-Cu-Ho Cu0.7 Ho5Bi2.3 Y2HfS5,oP32,62 Pnma 1.1936,0.9151,0.8023,90,90,90 - - 10.23 A 44867
Bi-Cu-I Cu0.5 Bi0.5I2 ht (Cu0.5 In0.5)In0.5 (Se...,cF112,227 Fd-3m 1.2134,1.2134,1.2134,90,90,90 - black 5.80 X 24400
Bi-Cu-I Cu2BiI5 ht *,hP8,* - 0.433,0.433,2.081,90,90,120 - black 4.77 N 23297
Bi-Cu-La CuLaBi2 CuHfSi2,tP8,129 P4/nmm 0.45795,0.45795,0.98858,90,90,90 - - 9.94 A 44605
Bi-Cu-La CuLa5Bi3 CuHf5Sn3,hP18,193 P63/mcm 0.9695,0.9695,0.6662,90,90,120 AlB2 family - 8.48 A 4690
Bi-Cu-La Cu3La3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.9982,0.9982,0.9982,90,90,90 - - 9.64 A 38029
Bi-Cu-Mg MgCuBi MgAgAs,cF12,216 F-43m 0.6256,0.6256,0.6256,90,90,90 - - 8.05 X 206
Bi-Cu-Mn Cu0.1 Mn0.9 Bi ht (Cu0.1 Mn0.9)Bi,oP10,17 P222 1 0.428,0.741,0.584,90,90,90 - - 9.50 X 10096
Bi-Cu-Mn Cu4Mn3Bi4 Cu4Mn3Bi4,cF88,225 Fm-3m 1.22,1.22,1.22,90,90,90 - - 9.18 X 14630
Bi-Cu-Nd CuNd5Bi3 CuHf5Sn3,hP18,193 P63/mcm 0.9476,0.9476,0.6519,90,90,120 AlB2 family - 9.25 A 4690
Bi-Cu-Nd Cu0.85 NdBi2 CuHfSi2,tP8,129 P4/nmm 0.45193,0.45193,0.97885,90,90,90 - - 10.24 A 44605
Bi-Cu-Nd Cu3Nd3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.9834,0.9834,0.9834,90,90,90 - - 10.19 A 38029
Bi-Cu-O CuBi2O4 hp *,oF28,* - 0.491,0.545,1.442,90,90,90 - - 9.39 N 46946
Bi-Cu-O CuBi2O4 CuBi2O4,tP28,130 P4/ncc 0.85019,0.85019,0.58196,90,90,90 kusachiite black 8.61 X 25152
Bi-Cu-O Cu0.84 Bi2.08 O4 Cu0.84 Bi2.08 O4,tP32,130 P4/ncc 0.858,0.858,0.5788,90,90,90 - black 8.61 X 38567
Bi-Cu-Pr CuPr5Bi3 CuHf5Sn3,hP18,193 P63/mcm 0.9493,0.9493,0.6548,90,90,120 AlB2 family - 9.07 A 4690
Bi-Cu-Pr Cu0.83PrBi2 CuHfSi2,tP8,129 P4/nmm 0.4536,0.4536,0.97832,90,90,90 - - 10.09 A 44605
Bi-Cu-Pr Cu3Pr3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.9864,0.9864,0.9864,90,90,90 - - 10.03 A 38029
Bi-Cu-S CuBiS2 CuSbS2,oP16,62 Pnma 0.6134,0.39111,1.4548,90,90,90 emplectite - 6.41 X 44338
Bi-Cu-S CuBi5S8 CuBi5S8,mS30,12 C12/m1 1.3214,0.4025,1.4087,90,115.6,90 - - 6.71 X 7841
Bi-Cu-S Cu1.5 Bi0.167 S dig ht Cu1.5 Bi0.167 S,cF72,225 Fm-3m 0.5563,0.5563,0.5563,90,90,90 - - 6.26 X 15027
Bi-Cu-S Cu1.6 Bi4.8S8 mon Cu1.6 Bi4.8S8,mS46,12 C12/m1 1.3217,0.40327,1.4076,90,115.53,90 - - 6.68 X 13536
Bi-Cu-S Cu1.6 Bi4.8S8 tri Cu1.6 Bi4.8Se8,aP19,2 P-1 0.4029,0.69067,1.29695,84.543,80.094,73.032 - - 6.66 X 23340
Bi-Cu-S Cu19 Bi2.5 S12 *,hP402,182 P6322 2.361,2.361,1.3323,90,90,120 - - - N 13920
Bi-Cu-S Cu3BiS3 ht1 *,oP*,* - 0.6719,0.7664,1.0446,90,90,90 - - - N 16314
Bi-Cu-S Cu3BiS3 ht2 *,oP28,* - 0.671,0.7658,1.0486,90,90,90 - - - N 16314
Bi-Cu-S Cu3BiS3 rt Cu3BiS3,oP28,19 P212121 0.6716,0.7723,1.0395,90,90,90 wittichenite - 6.11 X 7159
Bi-Cu-S Cu3Bi5S9 Cu3Bi5S9,mS54,12 C12/m1 1.3207,0.3993,1.4812,90,100.2,90 - - 6.58 X 13536
Bi-Cu-S Cu4Bi3.92 S9 Cu4Bi4S9,oP72,62 Pnma 3.168,0.3972,1.1659,90,90,90 - - 6.17 X 16839
Bi-Cu-S Cu4Bi5S10 Cu4Bi5S10,mS38,12 C12/m1 1.7539,0.3931,1.2847,90,108.,90 - - 6.39 X 8853
328 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Cu-S Cu4Bi5.92 S11 Cu4Bi5.92 S11,mS84,12 C12/m1 1.758,0.394,2.721,90,92.15,90 hodrusite - 6.50 X 4215
Bi-Cu-S Cu4.64 Bi6.28 S12 Cu4.64 Bi6.28 S12,mS50,12 C12/m1 1.752,0.3926,1.5261,90,101.18,90 cuprobismutite - 6.42 X 9257
Bi-Cu-S Cu5.16 Bi6.28 S12 Cu5.16 Bi6.28 S12,mS58,12 C12/m1 1.752,0.3926,1.5261,90,100.18,90 cuprobismutite - 6.51 X 9468
Bi-Cu-Se Cu1.78 Bi4.73 Se8 Cu1.78 Bi4.73 Se8,mS54,12 C12/m1 1.3759,0.41684,1.4683,90,115.61,90 - - 7.58 X 47686
Bi-Cu-Se Cu3BiSe3 rt *,hR36,166 R-3m 0.412,0.412,4.983,90,90,120 - - - N 23859
Bi-Cu-Se Cu4Bi4Se9 Cu4Bi4S9,oP72,62 Pnma 3.2692,0.41198,1.2202,90,90,90 - - 7.28 X 41004
Bi-Cu-Se Cu6BiSe6 Cu6BiSe6,oP52,62 Pnma 0.95559,0.40341,2.7056,90,90,90 eldragonite - 6.78 X 57813
Bi-Cu-Sr SrCuBi BeZrSi,hP6,194 P63 /mmc 0.462,0.462,0.884,90,90,120 AlB2 family - 7.32 X 8677
Bi-Cu-Tb CuTb5Bi3 CuHf5Sn3,hP18,193 P63 /mcm 0.92,0.92,0.6383,90,90,120 AlB2 family - 10.54 A 4690
Bi-Cu-Ti CuTi5Bi3 CuHf5Sn3,hP18,193 P63 /mcm 0.8164,0.8164,0.5642,90,90,120 AlB2 family - 9.48 A 38029
Bi-Cu-Yb CuYbBi ht BeZrSi,hP6,194 P63 /mmc 0.45885,0.45885,0.7913,90,90,120 AlB2 family - 10.26 X 47705
Bi-Cu-Yb CuYbBi rt LiGaGe,hP6,186 P63 mc 0.45821,0.45821,0.78107,90,90,120 AlB2 family - 10.42 X 47705
Bi-Cu-Zr CuZr6Bi2 K2UF6,hP9,189 P-62m 0.77866,0.77866,0.37796,90,90,120 Fe2P family - 8.61 X 56210
Bi-Dy-Fe Dy6FeBi2 K2UF6,hP9,189 P-62m 0.8229,0.8229,0.4173,90,90,120 Fe2P family - 9.83 X 41701
Bi-Dy-Gd Gd3DyBi3 Th3P 4,cI28,220 I-43d 0.937,0.937,0.937,90,90,90 - - 10.18 A 3580
Bi-Dy-Ge Dy2Ge3.52 Bi0.18 Gd2(Sn0.82 Ge0.18 )Ge2.76 ,oS32,63 Cmcm 0.4112,2.9917,0.39234,90,90,90 - - 8.51 X 59008
Bi-Dy-Ge Dy5Ge1.1 Bi1.9 Y2HfS5,oP32,62 Pnma 1.1902,0.9131,0.7978,90,90,90 - - 9.88 A 56869
Bi-Dy-Mn Dy6MnBi2 K2UF6,hP9,189 P-62m 0.8211,0.8211,0.4286,90,90,120 Fe2P family - 9.61 X 41723
Bi-Dy-Ni DyNiBi MgAgAs,cF12,216 F-43m 0.64108,0.64108,0.64108,90,90,90 - - 10.85 X 51356
Bi-Dy-Ni DyNi0.77 Bi2 CuHfSi2,tP8,129 P4/nmm 0.44749,0.44749,0.92585,90,90,90 - - 11.21 X 45040
Bi-Dy-Ni DyNi1.5 Bi2 CaBe2Ge2 ,tP10,129 P4/nmm 0.4481,0.4481,0.9271,90,90,90 - - 11.93 A 21323
Bi-Dy-Ni Dy5Ni0.66 Bi2.34 Yb5Sb3,oP32,62 Pnma 1.2075,0.9165,0.8072,90,90,90 - - 9.97 X 53346
Bi-Dy-Ni Dy5Ni2Bi Mo5SiB2,tI32,140 I4/mcm 0.7651,0.7651,1.345,90,90,90 - - 9.61 A 36495
Bi-Dy-O Dy0.25 Bi0.75 O1.5 cub CaF2,cF12,225 Fm-3m 0.55129,0.55129,0.55129,90,90,90 fluorite family orange 8.78 X 46125
Bi-Dy-O Dy0.485 Bi0.515 O1.5 tricl *,aP*,* - 0.8539,0.8604,1.0056,111.45,93.65,105.9 - - - N 32070
Bi-Dy-O Dy0.625 Bi0.375 O1.5 (La0.67 Bi0.33)O1.5 ,hR9,160 R3m 0.3774,0.3774,0.9482,90,90,120 - - 8.69 A 30615
Bi-Dy-O Dy0.675 Bi2.325 O4.5 (Sr0.78Bi0.22 )Bi2O4.11 ,hR27,166 R-3m 0.39549,0.39549,2.7296,90,90,120 - - 8.99 X 36131
Bi-Dy-O Dy1.3 Bi2.7 O6 Gd(Gd0.17 Bi0.83)3O6,cI80,199 I213 1.09872,1.09872,1.09872,90,90,90 - - 8.73 X 30721
Bi-Dy-O Dy2BiO2 Cu2TlSe2,tI10,139 I4/mmm 0.38761,0.38761,1.3233,90,90,90 - - 9.45 X 59503
Bi-Dy-Pd Dy5Pd2Bi Mo5SiB2,tI32,140 I4/mcm 0.777,0.777,1.3558,90,90,90 - - 10.02 A 37652
Bi-Dy-Pt DyPtBi MgAgAs,cF12,216 F-43m 0.6644,0.6644,0.6644,90,90,90 - - 12.83 X 7870
Bi-Dy-Pt Dy5Pt2Bi Mo5SiB2,tI32,140 I4/mcm 0.7744,0.7744,1.3557,90,90,90 - - 11.53 A 38900
Bi-Dy-Rh DyRhBi ZrNiAl,hP9,189 P-62m 0.7579,0.7579,0.3926,90,90,120 Fe2P family - 12.10 X 40552
Bi-Dy-S Dy0.34 Bi1.66 S3 Sb2S3,oP20,62 Pnma 1.1173,0.3993,1.1007,90,90,90 - - 6.74 A 20634
Bi-Dy-S Dy1.62 Bi0.38 S3 Sb2S3,oP20,62 Pnma 1.0707,0.3916,1.0523,90,90,90 - - 6.61 A 20634
Bi-Dy-S Dy4Bi2S9 *,oP105,* - 0.404,1.276,2.85,90,90,90 - - - N 27342
Bi-Dy-Si Dy5Bi1.8 Si1.2 Y2HfS5,oP32,62 Pnma 1.1898,0.914,0.7984,90,90,90 - - 9.35 A 56869
Bi-Dy-Te DyBiTe3 *,h**,* - 0.414,0.414,3.102,90,90,120 - - - N 20089
Bi-Er-Fe Er6FeBi2 K2UF6,hP9,189 P-62m 0.8145,0.8145,0.4148,90,90,120 Fe2P family - 10.29 X 44864
Bi-Er-Ge ErGe1.84 Bi0.16 Sc(Co0.25 Si0.75)Si,oS12,63 Cmcm 0.40475,1.5969,0.38983,90,90,90 - - 8.81 X 59008
Bi-Er-Ge Er5Ge1.1 Bi1.9 Y2HfS5,oP32,62 Pnma 1.1802,0.9034,0.795,90,90,90 - - 10.29 A 56869
Bi-Er-Mn Er6MnBi2 K2UF6,hP9,189 P-62m 0.81303,0.81303,0.42354,90,90,120 Fe2P family - 10.11 X 44864
Bi-Er-Ni ErNiBi MgAgAs,cF12,216 F-43m 0.6375,0.6375,0.6375,90,90,90 - - 11.15 X 40552
Bi-Er-Ni Er5Ni1.72Bi Mo5SiB2,tI32,140 I4/mcm 0.75813,0.75813,1.3395,90,90,90 - - 9.89 X 36495
Bi-Er-O Er0.25 Bi0.75 O1.5 (Y0.27 Bi0.73 )O1.5 ,cF112,225 Fm-3m 0.5479,0.5479,0.5479,90,90,90 fluorite family brown 8.99 X 20358
Bi-Er-O Er0.490 Bi0.510 O1.5 tricl *,aP*,* - 0.8475,0.8541,0.9982,111.3,93.86,105.83 - - - N 32070
Bi-Er-O Er0.5 Bi0.5 O1.5 cub CaF2,cF12,225 Fm-3m 0.5387,0.5387,0.5387,90,90,90 fluorite family - 9.01 X 23695
Bi-Er-O Er2BiO2 Cu2TlSe2,tI10,139 I4/mmm 0.38453,0.38453,1.31513,90,90,90 - - 9.83 X 56443
Bi-Er-Pd ErPdBi MgAgAs,cF12,216 F-43m 0.66096,0.66096,0.66096,90,90,90 - - 11.10 X 46747
Bi-Er-Pd Er5Pd2Bi Mo5SiB2,tI32,140 I4/mcm 0.7695,0.7695,1.3527,90,90,90 - - 10.43 A 37652
Bi-Er-Pt ErPtBi MgAgAs,cF12,216 F-43m 0.6616,0.6616,0.6616,90,90,90 - - 13.10 X 7870
Bi-Er-Pt Er5Pt2Bi Mo5SiB2,tI32,140 I4/mcm 0.77012,0.77012,1.35599,90,90,90 - - 11.86 X 38900
Bi-Er-Rh ErRhBi ZrNiAl,hP9,189 P-62m 0.7565,0.7565,0.3892,90,90,120 Fe2P family - 12.37 A 40552
Bi-Er-Si Er5Bi1.9Si1.1 Y2HfS5,oP32,62 Pnma 1.1799,0.9035,0.791,90,90,90 - - 9.96 A 56869
Bi-Eu-H Eu5Bi3H2.0 *,oP*,62 Pnma 1.3158,1.014,0.8752,90,90,90 - - - N 34418
Bi-Eu-In Eu14InBi11 Ca14AlSb11 ,tI208,142 I41/acd 1.7672,1.7672,2.311,90,90,90 - - 8.36 A 32916
Bi-Eu-Li LiEuBi TiNiSi,oP12,62 Pnma 0.7981,0.4848,0.8483,90,90,90 AlB2 family black 7.44 A 33892
Bi-Eu-Mg Mg2EuBi2 Ce2SO2,hP5,164 P-3m1 0.47716,0.47716,0.78365,90,90,120 - - 6.65 X 56275
Bi-Eu-Mn Eu14MnBi11 Ca14AlSb11 ,tI208,142 I41/acd 1.7632,1.7632,2.3047,90,90,90 - - 8.31 X 32916
Bi-Eu-O Eu0.25 Bi0.75 O1.5 CaF2,cF12,225 Fm-3m 0.5526,0.5526,0.5526,90,90,90 fluorite family - 8.61 X 46125
Bi-Eu-O Eu0.636 Bi0.364 O1.5 (La0.67 Bi0.33)O1.5 ,hR9,160 R3m 0.3836,0.3836,0.9509,90,90,120 - - 8.09 A 30615
Bi-Eu-O Eu0.675 Bi2.325 O4.5 (Sr0.78 Bi0.22 )Bi2O4.11 ,hR27,166 R-3m 0.39736,0.39736,2.7353,90,90,120 - - 8.80 X 36131
Bi-Eu-O Eu1.5 Bi2.5O6 Gd(Gd0.17 Bi0.83)3O6,cI80,199 I213 1.10722,1.10722,1.10722,90,90,90 - - 8.28 X 30721
Bi-Eu-O Eu4Bi2O K2NiF4,tI14,139 I4/mmm 0.4954,0.4954,1.7367,90,90,90 high-Tc family - 8.12 X 35279
Bi-Eu-Pd EuPd2Bi2 CaBe2Ge2 ,tP10,129 P4/nmm 0.4735,0.4735,1.0297,90,90,90 - - 11.26 A 18318
Bi-Eu-S Eu0.5 Bi2S3.5 PbBi2S4,oP28,62 Pnma 1.253,0.406,1.41,90,90,90 - gray 5.61 A 18997
Bi-Eu-S Eu1.1 Bi2S4 Ba1.1 Bi2S4 ,hP86,176 P63 /m 2.482,2.482,0.408,90,90,120 - gray 6.53 X 18807
Bi-Eu-S Eu2BiS4 Eu2BiS4,oP28,62 Pnma 1.1579,0.4089,1.4523,90,90,90 - gray 6.19 X 15000
Bi-Eu-S Eu3Bi4S9 Eu3Sb4S9,oP64,62 Pnma 1.734,0.408,2.47,90,90,90 - - 6.01 A 18997
Bi-Eu-Se EuBiSe3 SrBiSe3,oP80,19 P212121 0.42274,1.55804,3.3307,90,90,90 - black 7.24 X 46964
Bi-Eu-Se Eu0.4 Bi1.6Se3 Bi2Te3,hR15,166 R-3m 0.411,0.411,2.858,90,90,120 - black 7.53 A 57440
Bi-Eu-Se Eu0.5 Bi2Se 3.5 PbBi2S4,oP28,62 Pnma 1.264,0.417,1.497,90,90,90 - gray 6.48 A 18997
Bi-Eu-Se Eu3Bi4Se9 Eu3Sb4S9,oP64,62 Pnma 1.76,0.412,2.474,90,90,90 - - 7.41 A 18997
Bi-Eu-Sn Eu3Sn4Bi Tl4PbTe3,tI32,140 I4/mcm 0.8794,0.8794,1.2443,90,90,90 - gray silver 7.87 X 48455
Bi-Eu-Te EuBi2Te4 Th3P 4,cI28,220 I-43d 1.048,1.048,1.048,90,90,90 - - 6.23 A 18997
Bi-Eu-Te Eu0.57 Bi2.29 Te4 Th3P 4,cI28,220 I-43d 1.06,1.06,1.06,90,90,90 - - 6.00 A 18997
Bi-Eu-Te Eu4Bi2Te Th3P 4,cI28,220 I-43d 0.9926,0.9926,0.9926,90,90,90 - - 7.83 A 12608
Bi-Eu-Zn Zn0.5 EuBi BeZrSi,hP6,194 P63 /mmc 0.47016,0.47016,0.8308,90,90,120 AlB2 family - 8.22 X 57420
Handbook of Inorganic Substances – Edition 2015 : Data 329

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-F-Gd Gd5 Bi3F CuHf5Sn3,hP18,193 P63/mcm 0.91808,0.91808,0.6406,90,90,120 AlB2 family - 10.17 A 52282
Bi-F-K KBiF4 hex2 *,h**,* - 0.714,0.714,0.725,90,90,120 - - - N 17453
Bi-F-K KBiF4 ht *,hP*,* - 0.653,0.653,1.1445,90,90,120 - - - N 16315
Bi-F-K KBiF4 rt *,oP96,62 Pnma 1.2596,0.7541,1.5745,90,90,90 - - - N 26673
Bi-F-K KBiF6 cub KSbF6,cI64,206 Ia-3 1.034,1.034,1.034,90,90,90 - colorless 4.35 X 6332
Bi-F-K KBiF6 tet KNbF6,tP16,116 P-4c2 0.5248,0.5248,1.007,90,90,90 - colorless 4.34 X 6332
Bi-F-K KBi3F10 KY3 F10,cF112,225 Fm-3m 1.178,1.178,1.178,90,90,90 - - 6.96 A 21435
Bi-F-K K0.068 Bi0.932 F2.86 HoH3,hP24,165 P-3c1 0.7144,0.7144,0.7274,90,90,120 - - 7.80 A 14652
Bi-F-K K0.35 Bi0.65F2.3 calc (Th0.025Pb0.975)F2.05 ,cF60,225 Fm-3m 0.58885,0.58885,0.58885,90,90,90 fluorite family - 6.29 X 15605
Bi-F-K K2BiF5 Y2HfS5,oP32,62 Pnma 1.13862,0.7548,0.66008,90,90,90 - - 4.47 X 51639
Bi-F-K K3Bi2F9 K3Bi2F9,hR42,155 R32 0.6545,0.6545,1.9333,90,90,120 - colorless 4.91 X 37767
Bi-F-Kr BiKrF7 KrAsF7,mP36,14 P121/c1 0.5336,1.0513,1.1046,90,94.79,90 - colorless 4.58 X 38674
Bi-F-Li LiBiF4 Ca[WO4],tI24,88 I41/a 0.5301,0.5301,1.1319,90,90,90 - - 6.10 X 20248
Bi-F-Li LiBiF6 LiSbF6,hR24,148 R-3 0.5181,0.5181,1.399,90,90,120 - colorless 5.05 X 5589
Bi-F-Mg MgBi2F12 CaAu2F12,tP15,81 P-4 0.4803,0.4803,0.7624,90,90,90 - - 6.33 A 24000
Bi-F-N Bi3NF6 Bi3NF6,oP40,57 Pbcm 0.58174,0.57018,1.85113,90,90,90 - - 8.17 X 30536
Bi-F-Na NaBiF4 *,hP*,147 P-3 0.6144,0.6144,0.3721,90,90,120 - - - N 12672
Bi-F-Na NaBiF6 LiSbF6,hR24,148 R-3 0.5468,0.5468,1.516,90,90,120 - colorless 4.39 X 5589
Bi-F-Na Na0.3 Bi0.7F2.4 CeH3,cF44,225 Fm-3m 0.5742,0.5742,0.5742,90,90,90 fluorite family - 6.97 A 26679
Bi-F-O BiOF rt PbClF,tP6,129 P4/nmm 0.3756,0.3756,0.6234,90,90,90 zavaritskite - 9.21 X 17549
Bi-F-O BiO0.03 F2.94 ht HoH3,hP24,165 P-3c1 0.7068,0.7068,0.7333,90,90,120 - colorless 8.33 A 57275
Bi-F-O BiO0.51 F1.98 ht BiF3 ,cF16,225 Fm-3m 0.5848,0.5848,0.5848,90,90,90 b.c.c. family - 8.46 X 5791
Bi-F-O BiO0.55 F1.90 ht BiO0.55 F1.90 ,hR48,166 R-3m 0.41378,0.41378,2.0321,90,90,120 - - 8.40 X 36259
Bi-F-O Bi7O5F11 rt Bi7O5F11,mS46,5 C121 1.35238,0.55285,0.91886,90,96.171,90 - - 8.52 X 28642
Bi-F-Pb Pb0.2 Bi0.8 F2.8 HoH3,hP24,165 P-3c1 0.7162,0.7162,0.729,90,90,120 - - 8.06 A 25464
Bi-F-Pb Pb0.9 Bi0.1 F2.1 UO2.12 ,cF92,225 Fm-3m 0.5932,0.5932,0.5932,90,90,90 fluorite family - 7.87 X 13445
Bi-F-Rb RbBiF6 KAsF6,hR24,148 R-3 0.7712,0.7712,0.7889,90,90,120 - colorless 5.01 X 5589
Bi-F-Rb RbBi3F10 KY3 F10,cF112,225 Fm-3m 1.193,1.193,1.193,90,90,90 - - 7.06 A 21435
Bi-F-Rb Rb0.4 Bi0.6F2.2 CeH3,cF44,225 Fm-3m 0.6021,0.6021,0.6021,90,90,90 fluorite family - 6.13 A 16470
Bi-F-Rb Rb2BiF5 Rb2CrF5,oP32,62 Pnma 0.7625,0.6791,1.177,90,90,90 - - 5.18 A 16470
Bi-F-Sb Bi0.25 Sb0.75 F5 MoF5,mS48,12 C12/m1 0.9704,1.4353,0.5266,90,95.59,90 - colorless 4.34 A 18030
Bi-F-Sr Sr0.65 Bi0.35F2.35 Th0.1 Pb0.9F2.2,cF124,225 Fm-3m 0.58185,0.58185,0.58185,90,90,90 fluorite family - 5.89 X 26750
Bi-F-Tl TlBiF4 rt *,oP96,* - 0.782,1.302,1.518,90,90,90 - - 8.41 N 10860
Bi-F-Tl TlBi3F10 KY3 F10,cF112,225 Fm-3m 1.196,1.196,1.196,90,90,90 - - 7.93 A 15064
Bi-F-Tl Tl0.5 Bi0.5 F2 ht CaF2 ,cF12,225 Fm-3m 0.5981,0.5981,0.5981,90,90,90 fluorite family - 7.60 X 10860
Bi-F-Xe BiXeF7 KrAsF7,mP36,14 P121/c1 0.5235,0.9946,1.2333,90,91.251,90 - colorless 4.90 X 54390
Bi-F-Xe BiXeF9 BiXeF9,aP22,2 P-1 0.5698,0.7811,0.87294,78.529,72.282,87.16 - - 4.68 X 10724
Bi-F-Xe Bi2XeF12 Bi2XeF12,oP60,19 P212121 0.78615,0.95683,1.389,90,90,90 - yellow pale 4.94 X 54390
Bi-F-Zr Zr3BiF15 Zr(Zr0.67Bi0.33)3F15,hR114,167 R-3c 1.243,1.243,1.132,90,90,120 - colorless 5.05 X 21142
Bi-Fe-Gd Gd6 FeBi2 K2UF6,hP9,189 P-62m 0.8343,0.8343,0.4227,90,90,120 Fe2P family - 9.24 X 41701
Bi-Fe-Ho Ho6 FeBi2 K2UF6,hP9,189 P-62m 0.8197,0.8197,0.41663,90,90,120 Fe2P family - 10.02 X 44875
Bi-Fe-Lu Lu6FeBi2 K2UF6,hP9,189 P-62m 0.8059,0.8059,0.4116,90,90,120 Fe2P family - 10.93 X 41701
Bi-Fe-Nd Nd6 Fe13Bi La6Co 9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.8103,0.8103,2.3417,90,90,90 - - 7.78 A 27706
Bi-Fe-O FeBiO3 hp mon FeBiO3,mS60,12 C12/m1 1.75687,0.77461,0.54927,90,108.217,90 - red 8.78 X 52018
Bi-Fe-O FeBiO3 hp1 ZrPbO3,oP40,55 Pbam 0.55177,1.1159,0.7755,90,90,90 perovskite family - 8.70 X 57188
Bi-Fe-O FeBiO3 hp2 *,oS30,65 Cmmm 0.54939,1.66896,0.38728,90,90,90 - - 8.78 N 52018
Bi-Fe-O FeBiO3 hp3 *,oI60,72 Ibam 0.55021,1.62439,0.7696,90,90,90 - - 9.06 N 52018
Bi-Fe-O FeBiO3 ht mon FeBiO3,mP20,11 P121/m1 0.56148,0.56467,0.79725,90,90.015,90 - - 8.22 X 51289
Bi-Fe-O FeBiO3 ht1 K[BrO3],hR15,160 R3m 0.561,0.561,0.696,90,90,120 perovskite family - 8.22 A 59129
Bi-Fe-O FeBiO3 ht2 CaTiO3,cP5,221 Pm-3m 0.3939,0.3939,0.3939,90,90,90 perovskite family - 8.50 X 59129
Bi-Fe-O FeBiO3 orth GdFeO3,oP20,62 Pnma 0.54951,0.76496,0.53273,90,90,90 perovskite family red 9.28 X 53208
Bi-Fe-O FeBiO3 rt LiNbO3,hR30,161 R3c 0.55787,0.55787,1.38688,90,90,120 - red 8.34 X 23265
Bi-Fe-O FeBiO3 tf BaTiO3,tP5,99 P4mm 0.372,0.372,0.467,90,90,90 perovskite family - 8.04 A 46355
Bi-Fe-O Fe0.5 Bi12.5 O20 Bi12 SiO20,cI66,197 I23 1.01789,1.01789,1.01789,90,90,90 - yellow 9.32 X 9174
Bi-Fe-O Fe4Bi2O9 hp Ga4Bi2O9,oP60,62 Pnma 0.832,1.1888,0.756,90,90,90 - black 6.98 X 58617
Bi-Fe-O Fe4Bi2O9 Al4Bi2O9,oP30,55 Pbam 0.7757,0.8346,0.5956,90,90,90 - black 6.76 X 58617
Bi-Fe-O Fe4Bi2O9.26 Fe4Bi2O9.26 ,oP34,55 Pbam 0.79679,0.84399,0.60042,90,90,90 - black 6.49 X 59236
Bi-Fe-O Fe5Bi3O12 Y3 Al5O12,cI160,230 Ia-3d 1.26469,1.26469,1.26469,90,90,90 garnet family - 7.21 X 30476
Bi-Fe-Pr Pr6Fe 13Bi La6Co 9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.8116,0.8116,2.3516,90,90,90 - - 7.63 A 27706
Bi-Fe-Sm Sm6 Fe13Bi La6Co 9(Co 0.5Ga0.5 )4Ga,tI80,140 I4/mcm 0.8057,0.8057,2.3316,90,90,90 - - 8.06 A 27706
Bi-Fe-Tb Tb6FeBi2 K2UF6,hP9,189 P-62m 0.8274,0.8274,0.42004,90,90,120 Fe2P family - 9.52 X 56570
Bi-Fe-Te Fe0.02 Bi1.98 Te3 Fe0.02 Bi1.98 Te3,hR21,166 R-3m 0.43822,0.43822,3.04733,90,90,120 - - 7.84 X 49206
Bi-Fe-Ti Ti4FeBi2 V4SiSb2,tI28,140 I4/mcm 1.0486,1.0486,0.4933,90,90,90 - gray light 8.15 X 33504
Bi-Fe-Tm Tm6 FeBi2 K2UF6,hP9,189 P-62m 0.8112,0.8112,0.4135,90,90,120 Fe2P family - 10.48 X 41701
Bi-Fe-Y Y6FeBi2 K2UF6,hP9,189 P-62m 0.8265,0.8265,0.4214,90,90,120 Fe2P family - 6.71 X 41701
Bi-Fe-Zn ZnFeBi MgAgAs,cF12,216 F-43m 0.5547,0.5547,0.5547,90,90,90 - - 12.85 X 38110
Bi-Fe-Zn Zn2.5 FeBi0.5 CoAs3,cI32,204 Im-3 0.9177,0.9177,0.9177,90,90,90 - - 5.57 X 38110
Bi-Fe-Zr Zr6FeBi2 K2UF6,hP9,189 P-62m 0.78567,0.78567,0.36964,90,90,120 Fe2P family - 8.58 X 37266
Bi-Ga-I GaBi2.778 I4 rt InBi2.778 I4,cF3256,226 Fm-3c 1.9777,1.9777,1.9777,90,90,90 - black 5.97 A 53410
Bi-Ga-La LaGaBi2 LaGaBi2,hP24,191 P6/mmm 1.35483,1.35483,0.43937,90,90,120 - black 8.94 X 41510
Bi-Ga-O GaBiO3 hp1 *,oS*,63 Cmcm 0.76946,0.77389,0.77201,90,90,90 - - - N 53250
Bi-Ga-O GaBiO3 hp2 *,oP*,55 Pbam 0.53922,1.08968,0.76476,90,90,90 - - - N 53250
Bi-Ga-O GaBiO3 mon *,mS*,8 C1m1 0.52171,0.521,0.45702,90,91.352,90 - - - N 53250
Bi-Ga-O GaBiO3 orth GaBiO3,oP20,54 Pcca 0.54162,0.51335,0.99369,90,90,90 - white 7.85 X 46200
Bi-Ga-O Ga0.5 Bi12.5 O19.5 Ga0.5 Bi12.5 O19.5 ,cI74,197 I23 1.0183,1.0183,1.0183,90,90,90 - brown light 9.31 X 22210
Bi-Ga-O Ga4Bi2O9 hp Ga4Bi2O9,oP60,62 Pnma 0.8155,1.149,0.6966,90,90,90 - yellow 8.56 X 53842
Bi-Ga-O Ga4Bi2O9 Al4Bi2O9,oP30,55 Pbam 0.79264,0.82922,0.58892,90,90,90 - yellow 7.21 X 53842
Bi-Ga-Pd Pd3Ga0.5 Bi0.5 Cu3Au,cP4,221 Pm-3m 0.3968,0.3968,0.3968,90,90,90 close-packed structure - 12.19 X 5603
330 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Ga-S Ga2BiS4 Al2BiS4,tP28,126 P4/nnc 0.7458,0.7458,1.2032,90,90,90 - red ruby 4.73 X 35118


Bi-Ga-S Ga9BiS15 *,oP*,* - 1.269,1.286,1.357,90,90,90 - - - N 21101
Bi-Ga-Se Ga2BiSe4 Al2BiS4,tP28,126 P4/nnc 0.7708,0.7708,1.2514,90,90,90 - black gray 5.93 X 35118
Bi-Ga-Te Ga0.05 Bi1.95 Te3 Bi2Te3,hR15,166 R-3m 0.428,0.428,3.022,90,90,120 - - 8.25 A 24709
Bi-Gd-Ge Gd2Ge3.38 Bi0.42 Gd2(Sn0.82 Ge0.18 )Ge2.76 ,oS32,63 Cmcm 0.40404,3.0444,0.41629,90,90,90 - - 8.40 X 59008
Bi-Gd-Ge Gd4Ge2.5 Bi0.5 Th3P 4,cI28,220 I-43d 0.89799,0.89799,0.89799,90,90,90 - - 8.39 X 58208
Bi-Gd-Ge Gd5Ge1.2 Bi1.8 Y2HfS5,oP32,62 Pnma 1.2051,0.9247,0.8065,90,90,90 - - 9.24 A 56869
Bi-Gd-H Gd5Bi3H4.5 Y5Bi3,oP32,62 Pnma 0.8248,0.9583,1.209,90,90,90 - - 9.85 F 52282
Bi-Gd-Ni GdNiBi MgAgAs,cF12,216 F-43m 0.6435,0.6435,0.6435,90,90,90 - - 10.59 X 7870
Bi-Gd-Ni GdNi0.86 Bi2 CuHfSi2,tP8,129 P4/nmm 0.44888,0.44888,0.93658,90,90,90 - - 11.01 X 45040
Bi-Gd-Ni GdNi1.5 Bi2 CaBe2Ge2 ,tP10,129 P4/nmm 0.4496,0.4496,0.937,90,90,90 - - 11.63 A 21323
Bi-Gd-Ni Gd5Ni0.71 Bi2.29 Yb5Sb3,oP32,62 Pnma 1.2228,0.9241,0.8137,90,90,90 - - 9.44 X 50876
Bi-Gd-Ni Gd5Ni2Bi Mo5SiB2,tI32,140 I4/mcm 0.7756,0.7756,1.3537,90,90,90 - - 9.08 A 36495
Bi-Gd-O Gd0.1 Bi1.9 O3 Bi2O3,tP20,114 P-42 1c 0.77377,0.77377,0.56509,90,90,90 - - 9.05 A 33130
Bi-Gd-O Gd0.25 Bi0.75 O1.5 ht UO2,cF36,225 Fm-3m 0.5521,0.5521,0.5521,90,90,90 fluorite family yellow 8.69 X 31004
Bi-Gd-O Gd0.6 Bi0.4 O1.5 Pr0.7 Bi0.3 O1.5 ,hR9,166 R-3m 0.38174,0.38174,0.95445,90,90,120 fluorite family - 8.35 X 33130
Bi-Gd-O Gd0.675 Bi2.325 O4.5 rt (Sr0.78 Bi0.22 )Bi2O4.11 ,hR27,166 R-3m 0.39724,0.39724,2.7339,90,90,120 - - 8.85 X 36131
Bi-Gd-O Gd1.4 Bi2.6 O6 rt Gd(Gd0.17 Bi0.83)3O6,cI80,199 I213 1.1051,1.1051,1.1051,90,90,90 - - 8.46 X 30721
Bi-Gd-O Gd2BiO2 Cu2TlSe2,tI10,139 I4/mmm 0.39181,0.39181,1.34246,90,90,90 - - 8.95 X 56443
Bi-Gd-Pd GdPdBi MgAgAs,cF12,216 F-43m 0.6683,0.6683,0.6683,90,90,90 - - 10.52 X 49229
Bi-Gd-Pd Gd5Pd2Bi Mo5SiB2,tI32,140 I4/mcm 0.7864,0.7864,1.3644,90,90,90 - - 9.51 A 37652
Bi-Gd-Pt GdPtBi MgAgAs,cF12,216 F-43m 0.668,0.668,0.668,90,90,90 - - 12.51 X 7870
Bi-Gd-Pt Gd5Pt2Bi Mo5SiB2,tI32,140 I4/mcm 0.7851,0.7851,1.3687,90,90,90 - - 10.91 A 38900
Bi-Gd-Rh GdRhBi ZrNiAl,hP9,189 P-62m 0.7616,0.7616,0.3969,90,90,120 Fe2P family - 11.72 A 40552
Bi-Gd-S Gd0.8 Bi1.2 S3 Sb2S3,oP20,62 Pnma 1.1005,0.3972,1.1186,90,90,90 - - 6.42 A 22821
Bi-Gd-S Gd1.4 Bi0.6 S3 Sb2S3,oP20,62 Pnma 1.06,0.3951,1.078,90,90,90 - - 6.50 A 22821
Bi-Gd-Sb Gd4Bi1.5 Sb1.5 Th3P 4,cI28,220 I-43d 0.93072,0.93072,0.93072,90,90,90 - - 9.27 X 39041
Bi-Gd-Se Gd0.5 Bi1.5 Se3 Bi2Te3,hR15,166 R-3m 0.4115,0.4115,2.8529,90,90,120 - black 7.49 A 57440
Bi-Gd-Si Gd5Bi0.1 Si3.9 Sm5Ge4,oP36,62 Pnma 0.7485,1.4776,0.777,90,90,90 - - 7.09 X 52237
Bi-Gd-Si Gd5Bi1.58 Si2.42 Gd5(Bi0.79 Si0.21 )2Si2,oS52,64 Cmce 1.5246,0.7901,0.7898,90,90,90 - - 8.27 X 52237
Bi-Gd-Si Gd5Bi1.8 Si1.2 Y2HfS5,oP32,62 Pnma 1.2076,0.9198,0.8049,90,90,90 - - 8.89 A 56869
Bi-Gd-Si Gd5Bi2.07 Si1.93 Gd5Bi2Si2 ,tI104,142 I41/acd 0.79858,0.79858,3.07,90,90,90 - - 8.64 X 52237
Bi-Gd-Si Gd5Bi2.42 Si1.58 Gd5Bi2(Bi0.21 Si0.79 )2,tP120,106 P42bc 0.80296,0.80296,3.0883,90,90,90 - - 8.92 X 52237
Bi-Ge-Ho Ho2Ge3.54 Bi0.16 Gd2(Sn0.82 Ge0.18 )Ge2.76 ,oS32,63 Cmcm 0.40951,2.9799,0.39159,90,90,90 - - 8.62 X 59008
Bi-Ge-Ho Ho5Ge1.2 Bi1.8 Y2HfS5,oP32,62 Pnma 1.1862,0.9062,0.7959,90,90,90 - - 10.00 A 56869
Bi-Ge-La La5Ge1.2 Bi1.8 Y2HfS5,oP32,62 Pnma 1.2814,0.9604,0.8437,90,90,90 - - 7.41 A 56869
Bi-Ge-Lu LuGe1.94 Bi0.06 III Sc(Co0.25 Si0.75)Si,oS12,63 Cmcm 0.39935,1.5616,0.3857,90,90,90 - - 9.07 X 59008
Bi-Ge-Nd Nd2Ge3.24 Bi0.56 Pr2Ge2.88 (Ge 0.38 Bi0.62),oS36,63 Cmcm 0.41204,3.107,0.42592,90,90,90 - - 7.80 X 59008
Bi-Ge-Nd Nd5Ge1.2 Bi1.8 Y2HfS5,oP32,62 Pnma 1.2401,0.9413,0.8228,90,90,90 - - 8.19 A 56869
Bi-Ge-O GeBi12O20 Bi12SiO20,cI66,197 I23 1.0153,1.0153,1.0153,90,90,90 - yellow 9.20 X 26713
Bi-Ge-O GeBi2O5 mon GeBi2O5,mS32,9 C1c1 1.5686,0.5493,0.5376,90,90.01,90 - yellow 8.18 X 19536
Bi-Ge-O GeBi2O5 orth GeBi2O5,oS32,36 Cmc21 1.5667,0.5493,0.5376,90,90,90 - colorless 8.19 X 39357
Bi-Ge-O Ge3Bi2O9 Ge3Bi2O9,hP28,176 P63 /m 0.7006,0.7006,0.9786,90,90,120 - colorless 6.23 X 12836
Bi-Ge-O [GeO4]3Bi4 Bi4[SiO4]3 ,cI76,220 I-43d 1.0168,1.0168,1.0168,90,90,90 - yellowish 7.87 X 51701
Bi-Ge-Pd Pd3Ge0.5 Bi0.5 m BiF3,cF16,225 Fm-3m 0.6233,0.6233,0.6233,90,90,90 b.c.c. family - 12.62 X 23068
Bi-Ge-Pr Pr2Ge3.26 Bi0.62 Pr2Ge2.88 (Ge 0.38 Bi0.62),oS36,63 Cmcm 0.4147,3.1279,0.4303,90,90,90 - - 7.71 X 59008
Bi-Ge-Pr Pr5Ge1.2 Bi1.8 Y2HfS5,oP32,62 Pnma 1.2445,0.9439,0.8236,90,90,90 - - 8.02 A 56869
Bi-Ge-Sm Sm2Ge3.28 Bi0.52 I Pr2Ge2.88 (Ge 0.38 Bi0.62),oS36,63 Cmcm 0.40733,3.0715,0.42047,90,90,90 - - 8.18 X 59008
Bi-Ge-Tb Tb2Ge3.48 Bi0.28 Gd2(Sn0.82 Ge0.18 )Ge2.76 ,oS32,63 Cmcm 0.40052,3.0213,0.4121,90,90,90 - - 8.38 X 59008
Bi-Ge-Tb Tb5Ge1.2 Bi1.8 Y2HfS5,oP32,62 Pnma 1.1974,0.9199,0.8029,90,90,90 - - 9.45 A 56869
Bi-Ge-Te GeBi2Te4 In3 Te4,hR21,166 R-3m 0.4322,0.4322,4.127,90,90,120 - - 7.47 X 34421
Bi-Ge-Te GeBi4Te7 GeBi4Te7,hP12,164 P-3m1 0.4352,0.4352,2.3925,90,90,120 - - 7.62 X 6986
Bi-Ge-Te GeBi6Te10 GeSb6Te10 ,hR51,166 R-3m 0.43514,0.43514,10.1874,90,90,120 - - 7.76 X 53845
Bi-Ge-Te GeBi8Te13 *,hR66,166 R-3m 0.4363,0.4363,13.268,90,90,120 - - 7.75 N 37914
Bi-Ge-Te Ge0.16 Bi1.84 Te2.94 Bi2Te3,hR15,166 R-3m 0.4365,0.4365,3.0333,90,90,120 - - 7.68 A 6672
Bi-Ge-Te Ge0.25 Bi0.5 Te NiO,hR6,166 R-3m 0.43508,0.43508,1.1234,90,90,120 rocksalt family - 6.77 X 57210
Bi-Ge-Te Ge0.4 Bi0.4Te m NaCl,cF8,225 Fm-3m 0.61109,0.61109,0.61109,90,90,90 rocksalt family gray dark 6.99 X 48075
Bi-Ge-Te Ge0.9Bi0.1Te rt GeTe,hR6,160 R3m 0.42092,0.42092,1.05542,90,90,120 rocksalt family - 6.58 A 14189
Bi-Ge-Te Ge0.97 Bi0.03 Te ht NaCl,cF8,225 Fm-3m 0.59923,0.59923,0.59923,90,90,90 rocksalt family - 6.31 X 16085
Bi-Ge-Te Ge1.5 Bi2.5Te 5 Pb2Bi2Se5 ,hP9,164 P-3m1 0.4305,0.4305,1.7372,90,90,120 - - 7.56 X 34421
Bi-Ge-Te Ge2Bi10Te 17 *,hR87,166 R-3m 0.4355,0.4355,17.371,90,90,120 - - 7.69 N 37914
Bi-Ge-Te Ge3Bi2Te6 Ge3Bi2Te6 ,hR33,160 R3m 0.4268,0.4268,6.2592,90,90,120 - - 7.07 X 37913
Bi-Ge-Te Ge3.14 Bi2Te 6 *,hR78,* - 0.4264,0.4264,14.656,90,90,120 - - - N 28705
Bi-Ge-Te Ge3.66 Bi2.34 Te7 Ge4As2Te7,hR39,166 R-3m 0.421,0.421,7.328,90,90,120 - - 7.30 A 33075
Bi-Ge-Te Ge5Bi2Te8 Ge5As2Te8,hP15,164 P-3m1 0.4238,0.4238,2.789,90,90,120 - - 6.90 A 38915
Bi-Ge-Tm TmGe1.89 Bi0.11 III Sc(Co0.25 Si0.75)Si,oS12,63 Cmcm 0.4023,1.5814,0.38785,90,90,90 - - 8.86 X 59008
Bi-Ge-Y Y2Ge3.50 Bi0.22 II Gd2(Sn0.82 Ge0.18 )Ge2.76 ,oS32,63 Cmcm 0.4128,3.008,0.3934,90,90,90 - - 6.50 X 59008
Bi-H-Sm Sm5Bi3H Yb5Sb3,oP32,62 Pnma 1.31252,1.01418,0.87613,90,90,90 - - 7.86 P 54896
Bi-H-Sr Sr5Bi3H0.5 *,oP*,62 Pnma 1.3393,1.023,0.8874,90,90,90 - - - N 34418
Bi-H-Sr Sr5Bi3H0.5 Mn5Si3,hP16,193 P63 /mcm 0.9654,0.9654,0.7527,90,90,120 - - 5.83 F 46240
Bi-H-Yb Yb5Bi3Hx Yb5Sb3,oP32,62 Pnma 1.266,0.9714,0.84067,90,90,90 - - 9.59 X 54896
Bi-Hf-Li Li2.6 Hf0.1 Bi BiF3,cF16,225 Fm-3m 0.673,0.673,0.673,90,90,90 b.c.c. family - 5.34 X 25521
Bi-Hf-Ni Hf6NiBi2 K2UF6,hP9,189 P-62m 0.75707,0.75707,0.36543,90,90,120 Fe2P family - 14.17 A 37266
Bi-Hf-O Hf2Bi2O7 cub1 (Nb0.57 Fe0.43 )2Fe0.1 ...,cF168,227 Fd-3m 1.08779,1.08779,1.08779,90,90,90 pyrochlore family - 9.15 X 48183
Bi-Hf-O Hf2Bi2O7 cub2 *,cF*,219 F-43c 2.1733,2.1733,2.1733,90,90,90 - - - N 48183
Bi-Hf-O Hf2Bi2O7 mon Hf2Bi2O7,mP352,7 P1c1 1.53536,1.5332,2.18253,90,90.051,90 - - 9.17 X 48183
Bi-Hf-O Hf2Bi2O7 tet Hf2Bi2O7,tI52,98 I4122 0.76897,0.76897,1.08517,90,90,90 - - 9.18 X 48183
Bi-Hg-O Hg2.56 Bi10.24 O17.92 (Pb0.35 Bi0.65)12Bi0.6 O16.8 ,cI72,197 I23 1.02092,1.02092,1.02092,90,90,90 - black 9.18 X 43563
Handbook of Inorganic Substances – Edition 2015 : Data 331

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Hg-S HgBi2S4 HgBi2S4,mS28,12 C12/m1 1.417,0.406,1.399,90,118.27,90 grumiplucite gray 7.00 X 12947


Bi-Ho-Mn Ho6 MnBi2 K2UF6,hP9,189 P-62m 0.81756,0.81756,0.42565,90,90,120 Fe2P family - 9.86 X 44875
Bi-Ho-Ni HoNiBi MgAgAs,cF12,216 F-43m 0.6391,0.6391,0.6391,90,90,90 - - 11.01 X 35003
Bi-Ho-Ni Ho5 NiBi2 Y2HfS5,oP32,62 Pnma 1.2036,0.8952,0.7932,90,90,90 - - 10.11 A 44867
Bi-Ho-Ni Ho5 Ni2Bi Mo5 SiB2,tI32,140 I4/mcm 0.7614,0.7614,1.34435,90,90,90 - - 9.81 X 37652
Bi-Ho-O Ho0.25 Bi0.75 O1.5 CaF2 ,cF12,225 Fm-3m 0.54911,0.54911,0.54911,90,90,90 fluorite family - 8.91 X 46125
Bi-Ho-O Ho0.485 Bi0.515 O1.5 *,aP*,* - 0.851,0.8575,1.0018,111.36,93.77,105.88 - - - N 32070
Bi-Ho-O Ho0.625 Bi0.375 O1.5 (La0.67 Bi0.33)O1.5 ,hR9,160 R3m 0.3758,0.3758,0.9508,90,90,120 - - 8.80 A 30615
Bi-Ho-O Ho2 BiO2 Cu2TlSe 2,tI10,139 I4/mmm 0.38583,0.38583,1.3218,90,90,90 - - 9.63 X 59503
Bi-Ho-Pd Ho5PdBi2 Y2HfS5,oP32,62 Pnma 1.20374,0.91076,0.80135,90,90,90 - - 10.20 X 56226
Bi-Ho-Pd Ho5Pd2Bi Mo5 SiB2,tI32,140 I4/mcm 0.7719,0.7719,1.3563,90,90,90 - - 10.25 A 37652
Bi-Ho-Pt HoPtBi MgAgAs,cF12,216 F-43m 0.6631,0.6631,0.6631,90,90,90 - - 12.96 X 7870
Bi-Ho-Pt Ho5Pt2Bi Mo5 SiB2,tI32,140 I4/mcm 0.771,0.771,1.3576,90,90,90 - - 11.72 A 38900
Bi-Ho-Rh HoRhBi ZrNiAl,hP9,189 P-62m 0.7576,0.7576,0.3912,90,90,120 Fe2P family - 12.22 A 40552
Bi-Ho-Rh Ho5 RhBi2 Y2HfS5,oP32,62 Pnma 1.2082,0.90346,0.79413,90,90,90 - - 10.31 A 56226
Bi-Ho-Rh Ho6 RhBi2 K2UF6,hP9,189 P-62m 0.82782,0.82782,0.41065,90,90,120 Fe2P family - 10.29 X 56226
Bi-Ho-Ru Ho5 RuBi2 Y2HfS5,oP32,62 Pnma 1.1972,0.92096,0.80048,90,90,90 - - 10.11 A 56226
Bi-Ho-Ru Ho6 RuBi2 K2UF6,hP9,189 P-62m 0.8223,0.8223,0.41647,90,90,120 Fe2P family - 10.27 X 56210
Bi-Ho-Si Ho5 Bi1.8 Si1.2 Y2HfS5,oP32,62 Pnma 1.1844,0.9023,0.7922,90,90,90 - - 9.69 A 56869
Bi-Ho-Te HoBiTe 3 Bi2Te3,hR15,166 R-3m 0.428,0.428,3.149,90,90,120 - - 7.55 A 12377
Bi-I-In InBi2.778 I4 lt *,hR*,* - 1.4075,1.4075,3.4727,90,90,120 - black 6.04 N 53410
Bi-I-In InBi2.778 I4 rt InBi2.778 I4,cF3256,226 Fm-3c 2.0162,2.0162,2.0162,90,90,90 - black 5.85 X 53410
Bi-I-Ir Ir2Bi9I3 Ir2Bi9I3,oP112,62 Pnma 2.6775,1.3942,0.9676,90,90,90 - black 9.73 X 38210
Bi-I-Ni Ni4Bi12I3 Ni4Bi12I3,oS76,63 Cmcm 0.40654,1.5812,3.455,90,90,90 - black 9.34 X 33798
Bi-I-Ni Ni4Bi12.86 I6 Ni4Bi12.86 Br6,oI60,71 Immm 0.41005,0.91284,3.8267,90,90,90 - black 8.54 X 36646
Bi-I-Ni Ni5Bi5.6I Ni5Bi5.6I,mS56,12 C12/m1 2.29789,0.41845,1.3738,90,126.295,90 - black 9.92 X 31072
Bi-I-O BiIO rt PbClF,tP6,129 P4/nmm 0.3995,0.3995,0.9151,90,90,90 - red bright 8.00 X 45842
Bi-I-O Bi[IO3]O rt Bi[IO3]O,oP24,29 Pca21 0.56584,1.10386,0.57476,90,90,90 - yellow 7.40 X 56430
Bi-I-O Bi[IO3]3 Bi[IO3]3,mP52,14 P121/c1 0.88882,0.59445,1.66754,90,114.872,90 - - 6.10 X 41745
Bi-I-O Bi2[IO3]3[IO4] rt Bi2[IO3]3[IO4],oP76,19 P212121 0.56831,1.2394,1.6849,90,90,90 - colorless 6.34 X 56295
Bi-I-O Bi4I2O5 Bi4Br2O5,mP44,4 P1211 1.1263,0.56983,1.4944,90,99.81,90 - orange 8.22 X 40991
Bi-I-O Bi5IO7 mon Bi5IO7,mS52,12 C12/m1 1.8387,0.42497,1.3254,90,108.1,90 - colorless 8.66 X 18681
Bi-I-O Bi5IO7 orth Bi5IO7,oI104,73 Ibca 0.53439,1.6265,2.302,90,90,90 - colorless 8.52 X 39571
Bi-I-Pt Pt3Bi13I7 Pt3Bi13I7,aP50,2 P-1 0.91198,0.91261,2.1496,89.97,83.956,60.088 - black 9.04 X 33760
Bi-I-Pt Pt3Bi20I36 Pt3Bi20I36,aP59,2 P-1 1.16627,1.16627,1.8657,74.651,74.651,85.618 - black 6.57 X 51548
Bi-I-Rb Rb3Bi2I9 Rb3Bi2I9,mP56,7 P1c1 1.469,0.8195,2.54587,90,124.795,90 - - 4.79 X 37279
Bi-I-Rh Rh2Bi9I3 Rh2Bi9I3,mP28,11 P121/m1 0.7756,1.3749,0.9011,90,109.29,90 - black 9.04 X 38210
Bi-I-Ru RuBi4I2 RuBi4I2,tI28,87 I4/m 1.1839,1.1839,0.6697,90,90,90 - black 8.43 X 33762
Bi-I-S BiSI BiSCl,oP12,62 Pnma 0.8519,0.4172,1.0177,90,90,90 demicheleite-(I) red 6.76 X 7715
Bi-I-S Bi6.33 S9I Bi6.33 S9I,hP36,176 P63/m 1.563,1.563,0.402,90,90,120 - - 6.79 X 6199
Bi-I-Sb Bi0.5 Sb0.5 I3 BiI3,hR24,148 R-3 0.7505,0.7505,2.08,90,90,120 - - 5.36 A 4229
Bi-I-Se BiSeI BiSCl,oP12,62 Pnma 0.86967,0.42205,1.0574,90,90,90 - black 7.10 X 36861
Bi-I-Te BiTeI rt BiTeI,hP3,156 P3m1 0.4336,0.4336,0.684,90,90,120. - yellow 6.91 X 28251
Bi-I-Te Bi2TeI Bi2TeI,mS16,12 C12/m1 0.7586,0.438,1.7741,90,98.2,90 - - 7.66 X 45507
Bi-I-Te Bi4TeI1.125 *,h**,* - 0.4387,0.4387,0.652,90,90,120 - - - N 45507
Bi-I-Tl Tl3BiI6 Tl3BiI6,mP40,14 P121/c1 1.3469,0.8959,1.3477,90,104.41,90 - red dark 6.68 X 49643
Bi-I-Tl Tl3Bi2I9 Tl3Bi2I9,mP56,14 P121/c1 1.4389,0.77154,2.46888,90,122.271,90 - black 6.23 X 45639
Bi-I-Tl Tl7Bi3I16 Tl7Bi3I16,oS312,63 Cmcm 2.4734,1.4419,3.6169,90,90,90 - gray dark 6.32 X 49643
Bi-In-K K11In6Bi9 K11In6Bi9,aP52,2 P-1 1.2012,1.338,1.3695,76.7,64.14,75.68 - - 5.24 X 40446
Bi-In-K K4.67 In2.67 Bi4 K4.67 In2.67 Bi4,tP52,76 P41 0.9703,0.9703,1.7519,90,90,90 - - 5.34 X 40446
Bi-In-Na NaIn0.67 Bi NaIn0.67 Bi,oP12,62 Pnma 0.8062,0.48684,0.92455,90,90,90 - black 5.65 X 40446
Bi-In-Na Na3InBi2 Na3InBi2,mP72,14 P121/c1 1.8841,0.9235,1.2661,90,98.67,90 - black 5.51 X 40446
Bi-In-O InBiO3 hp GdFeO3,oP20,62 Pnma 0.59661,0.80103,0.55063,90,90,90 perovskite family - 9.38 X 53250
Bi-In-O InBiO3 ht-hp CdTiO3,oP20,33 Pna21 0.59546,0.56018,0.83863,90,90,90 perovskite family yellow 8.83 X 46209
Bi-In-O In0.52 Bi12.48 O19.5 Bi12 SiO20,cI66,197 I23 1.022,1.022,1.022,90,90,90 - - 9.27 A 10115
Bi-In-Pb In4PbBi3 Tl4PbTe 3,tI32,140 I4/mcm 0.8565,0.8565,1.2697,90,90,90 - - 9.22 A 25681
Bi-In-Pd Pd3In0.5 Bi0.5 Cu3Au,cP4,221 Pm-3m 0.4002,0.4002,0.4002,90,90,90 close-packed structure - 12.46 X 5603
Bi-In-Rb Rb4.67 In2.67 Bi4 K4.67 In2.67 Bi4,tP52,76 P41 0.9915,0.9915,1.787,90,90,90 - - 5.83 A 40446
Bi-In-S In2Bi4S9 rt *,mS*,* - 1.167,4.716,1.262,90,105.8,90 - gray dark - N 10206
Bi-In-S In4Bi2S9 In4Bi2S9,mP30,11 P121/m1 1.1111,0.3917,1.6167,90,94.044,90 - black 5.52 X 6457
Bi-In-S In4Bi3S10 In4Bi3S10,mP70,6 P1m1 1.1566,0.76427,1.7742,90,98.03,90 - black 6.02 X 54974
Bi-In-S In5Bi3S12 rt In5Bi3S12,mS80,12 C12/m1 3.313,0.3873,1.4413,90,91.21,90 - gray dark 5.70 X 12982
Bi-In-S In5.65 Bi7.35 S19 In4(In0.82 Bi0.18)2Bi7S19,mP66,11 P121/m1 1.1386,0.3857,3.4103,90,94.67,90 - black 6.22 X 54974
Bi-In-Se InBiSe 3 orth *,o**,* - 0.372,1.115,1.125,90,90,90 - - - N 9703
Bi-In-Se InBi2Se4 *,mP35,14 P121/c1 1.106,0.99,1.18,90,116.5,90 - - - N 26657
Bi-In-Se InBi6Se10 *,mP*,11 P121/m1 1.126,0.395,1.582,90,95.5,90 - - - N 26657
Bi-In-Se In0.4 Bi1.6 Se3 rhom Bi2Te3,hR15,166 R-3m 0.405,0.405,2.856,90,90,120 - - 7.58 A 32175
Bi-In-Se In0.84 Bi0.15 Se GaS-a,hP8,194 P63/mmc 0.4085,0.4085,1.69,90,90,120 - - 5.62 A 26657
Bi-In-Se In2Bi2Se5 *,mP36,14 P121/c1 0.642,0.592,1.108,90,104.5,90 - - - N 26657
Bi-In-Sr Sr5In2Bi6 Ca5Al2Bi6,oP26,55 Pbam 0.788,2.445,0.474,90,90,90 - black 6.99 X 46672
Bi-In-Te In0.045 Bi1.955 Te3 Bi2Te3,hR15,166 R-3m 0.43765,0.43765,3.0467,90,90,120 - - 7.85 A 25086
Bi-In-Te In0.25 Bi0.75 Te BiSe,hP12,164 P-3m1 0.4436,0.4436,2.418,90,90,120 - - 7.57 A 9019
Bi-In-Te In0.75 Bi0.25 Te TlSe,tI16,140 I4/mcm 0.8429,0.8429,0.7147,90,90,90 - - 6.96 A 9019
Bi-Ir-O IrBi12O20 rt Bi12 SiO20,cI66,197 I23 1.0305,1.0305,1.0305,90,90,90 - brown 9.17 A 28704
Bi-Ir-O Ir2Bi2O7 Ca2Nb2O7,cF88,227 Fd-3m 1.03111,1.03111,1.03111,90,90,90 pyrochlore family black 11.08 X 58632
Bi-Ir-S IrBiS NiSbS,cP12,198 P213 0.6143,0.6143,0.6143,90,90,90 pyrite-marcasite family - 12.41 A 1975
Bi-Ir-Se IrBiSe NiSbS,cP12,198 P213 0.629,0.629,0.629,90,90,90 pyrite-marcasite family - 12.82 A 1975
Bi-Ir-Te IrBi0.6 Te1.4 FeS2 ,cP12,205 Pa-3 0.6483,0.6483,0.6483,90,90,90 mayingite - 12.10 A 6345
332 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-K-Mg KMgBi PbClF,tP6,129 P4/nmm 0.4881,0.4881,0.8382,90,90,90 - gray steel 4.53 A 12878


Bi-K-Mn KMnBi PbClF,tP6,129 P4/nmm 0.4747,0.4747,0.8314,90,90,90 - - 5.37 X 36632
Bi-K-O KBiO2 KSbS2,mS16,15 C12/c1 0.78313,0.79092,0.59686,90,124.81,90 - colorless 6.13 X 35181
Bi-K-O KBiO3 cub1 KSbO3,cP60,201 Pn-3 1.001,1.001,1.001,90,90,90 - red dark 5.88 X 297
Bi-K-O KBiO3 rt KBiO3,cI74,204 Im-3 1.00194,1.00194,1.00194,90,90,90 - red 5.87 X 27169
Bi-K-O K0.05 Bi0.95 O1.75 CaF2,cF12,225 Fm-3m 0.5543,0.5543,0.5543,90,90,90 fluorite family maroon 8.91 X 15433
Bi-K-O K0.06 Bi0.65 O m AgI,cI38,229 Im-3m 0.4371,0.4371,0.4371,90,90,90 - golden 6.13 A 27632
Bi-K-O K0.87 Bi1.13 O3 hp CaTiO3,cP5,221 Pm-3m 0.42338,0.42338,0.42338,90,90,90 perovskite family - 6.96 X 36172
Bi-K-O K3BiO3 Na3SbO3,cI56,217 I-43m 1.07015,1.07015,1.07015,90,90,90 rocksalt family colorless 4.06 X 33949
Bi-K-O K3BiO4 K3BiO4,aP16,2 P-1 0.6432,0.6573,0.7624,101.724,96.472,105.465 - yellow 4.33 X 41100
Bi-K-O K4Bi2O5 K4Bi2O5,aP22,2 P-1 0.5693,0.9528,0.9786,106.47,105.06,106.42 - colorless 4.79 X 34829
Bi-K-O K9Bi5O13 K9Bi5O13,mP108,14 P121/c1 1.50998,0.56759,2.6856,90,111.19,90 - colorless 4.97 X 41074
Bi-K-Pb KPb0.4 Bi1.6 MgCu2,cF24,227 Fd-3m 0.95232,0.95232,0.95232,90,90,90 Friauf-Laves phase gray 7.02 X 44726
Bi-K-Pb K2Pb1.6 Bi2.4 MgCu4Sn,cF24,216 F-43m 0.9572,0.9572,0.9572,90,90,90 Friauf-Laves phase gray 6.90 X 44726
Bi-K-S KBi3S5 rt KBi3S5,oP40,62 Pnma 1.7013,0.4076,1.7365,90,90,90 - gray dark 4.56 X 30142
Bi-K-S KBi6.33 S10 KBi6.33 S10 ,oP72,62 Pnma 2.405,0.41,1.944,90,90,90 - gray silver 5.83 X 31496
Bi-K-S K0.5 Bi0.5 S NaCl,cF8,225 Fm-3m 0.6,0.6,0.6,90,90,90 rocksalt family - 4.80 X 5966
Bi-K-S K2Bi8S13 (K0.67 Bi0.33 )3Bi7S13,mP46,11 P121/m1 1.6818,0.4074,1.7801,90,90.48,90 - gray silver 5.90 X 31496
Bi-K-Se K0.5 Bi0.5 Se NaCl,cF8,225 Fm-3m 0.5922,0.5922,0.5922,90,90,90 rocksalt family - 6.49 X 711
Bi-K-Se K2Bi8Se13 mon (K0.67 Bi0.33 )3Bi7S13,mP46,11 P121/m1 1.7492,0.4205,1.8461,90,90.49,90 - black 6.79 X 32923
Bi-K-Se K2Bi8Se13 tricl K2Bi8Se13 ,aP23,2 P-1 0.41656,1.2096,1.3768,92.04,98.64,90.02 - black 6.73 X 27177
Bi-K-Se K2.5 Bi8.5 Se 14 K2.5 Bi8.5 Se14,mP52,11 P121/m1 1.7535,0.4206,2.1387,90,109.65,90 - black 6.66 X 32923
Bi-K-Se K3BiSe3 Na3AsS3,cP28,198 P213 0.9773,0.9773,0.9773,90,90,90 - black 4.01 X 32374
Bi-K-Sn K2SnBi K2SnBi,oP16,57 Pbcm 0.6804,1.3393,0.6499,90,90,90 - gray silver 4.55 X 26885
Bi-K-Sn K5SnBi3 Na5GeP3,mP36,14 P121/c1 1.0105,0.8818,1.92298,90,121.762,90 - black 4.29 X 28266
Bi-K-Sn K6Sn23Bi2 Ba6(In0.36 Ge0.64)11Ge14,cP124,213 P4132 1.63,1.63,1.63,90,90,90 clathrate black 5.19 X 35208
Bi-K-Te K3BiTe3 Na3AsS3,cP28,198 P213 1.0369,1.0369,1.0369,90,90,90 - black 4.22 X 25657
Bi-La-Li LiLaBi2 CuHfSi2,tP8,129 P4/nmm 0.45206,0.45206,1.09942,90,90,90 - gray 8.33 X 46936
Bi-La-Li Li3LaBi2 Li3LaSb2,hP6,164 P-3m1 0.4704,0.4704,0.7527,90,90,120 - black 6.65 A 17606
Bi-La-Mg MgLa3Bi5 CuHf5Sn3,hP18,193 P63 /mcm 0.97882,0.97882,0.65492,90,90,120 AlB2 family gray 9.08 X 46936
Bi-La-Mn La3MnBi5 CuHf5Sn3,hP18,193 P63 /mcm 0.97139,0.97139,0.64883,90,90,120 AlB2 family - 9.50 X 50416
Bi-La-Ni LaNi1.5 Bi2 CaBe2Ge2 ,tP10,129 P4/nmm 0.4565,0.4565,0.9814,90,90,90 - - 10.47 A 21323
Bi-La-Ni La3Ni3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.9889,0.9889,0.9889,90,90,90 - - 9.81 A 38029
Bi-La-O La0.12 Bi0.88 O1.5 ht CaF2,cF12,225 Fm-3m 0.55773,0.55773,0.55773,90,90,90 fluorite family - 8.60 X 46125
Bi-La-O La0.225 Bi0.775 O1.5 ht3 (La0.22 Bi0.78)O1.5 ,hR33,166 R-3m 0.40176,0.40176,2.75507,90,90,120 - - 8.43 X 47473
Bi-La-O La0.57 Bi2.43 O4.5 ht1 (La0.57 Bi0.43)Bi2O4.5 ,mP18,13 P12/c1 0.94956,0.39742,0.70425,90,104.7,90 - yellow 8.51 X 39205
Bi-La-O La0.67 Bi0.33 O1.5 ht (La0.67 Bi0.33)O1.5 ,hR9,160 R3m 0.3966,0.3966,0.9931,90,90,120 - - 6.85 X 36001
Bi-La-O La0.67 Bi0.33 O1.5 rt (La0.67 Bi0.33)O1.5,mS6,12 C12/m1 0.6829,0.39887,0.40524,90,125.094,90 - - 6.84 X 32072
Bi-La-O La0.67 Bi0.33 O1.5 tricl (La0.67 Bi0.33)O1.5 ,aP6,2 P-1 0.392,0.4023,0.5628,87.63,89.71,89.91 - - 6.97 X 33464
Bi-La-O La0.67 Bi0.33 O1.68 (La0.67 Bi0.33)O1.68 ,aP6,2 P-1 0.3918,0.4024,0.5629,87.57,89.7,89.86 - - 7.08 X 36001
Bi-La-O La0.675 Bi2.325 O4.5 (La0.675 Bi0.325)Bi2O4.5 ,hR45,166 R-3m 0.40253,0.40253,2.76004,90,90,120 - yellow 8.38 X 40571
Bi-La-O La2BiO2 Cu2TlSe2,tI10,139 I4/mmm 0.40848,0.40848,1.39866,90,90,90 - - 7.38 X 56443
Bi-La-O La2Bi2O7 Ca2Nb2O7 ,cF88,227 Fd-3m 1.1211,1.1211,1.1211,90,90,90 pyrochlore family brown 7.62 A 27744
Bi-La-O La5Bi4O13.5 La5Bi4O13.5 ,oI50,71 Immm 0.40988,1.2079,1.6348,90,90,90 - yellow 7.17 X 25001
Bi-La-Pb La4Pb0.5 Bi2.5 Th3P 4,cI28,220 I-43d 0.9795,0.9795,0.9795,90,90,90 - - 8.35 A 10750
Bi-La-Pd LaPdBi MgAgAs,cF12,216 F-43m 0.6871,0.6871,0.6871,90,90,90 - - 9.30 X 49229
Bi-La-Pt LaPtBi MgAgAs,cF12,216 F-43m 0.6829,0.6829,0.6829,90,90,90 - - 11.32 X 40552
Bi-La-Pt La3Pt3Bi4 Au3 Y3Sb4,cI40,220 I-43d 1.009,1.009,1.009,90,90,90 - - 11.88 X 26616
Bi-La-Rh La16Rh9Bi2 Ce16Ru8(Ru0.29 In0.71 )In2,tP54,127 P4/mbm 1.204,1.204,1.0072,90,90,90 - - 8.11 A 59570
Bi-La-S La0.2 Bi1.8 S3 Sb2S3,oP20,62 Pnma 1.13,0.4037,1.12,90,90,90 - - 6.50 A 33698
Bi-La-S La1.7 Bi0.3 S3 rt Cr3C2-b,oP20,62 Pnma 0.7622,0.4115,1.588,90,90,90 - - 5.27 A 21633
Bi-La-S La4Bi2S9 La4Bi2S9,oP60,62 Pnma 2.855,0.406,1.282,90,90,90 - - 5.64 X 21633
Bi-La-S La8.5 Bi1.5 S15 Pr10S14O,tI200,142 I41/acd 1.567,1.567,2.062,90,90,90 - - 5.18 A 33698
Bi-La-Sb La4Bi1.5 Sb1.5 Th3P 4,cI28,220 I-43d 0.9804,0.9804,0.9804,90,90,90 - - 7.41 A 10750
Bi-La-Sc La3ScBi5 CuHf5Sn3,hP18,193 P63 /mcm 0.97573,0.97573,0.65592,90,90,120 AlB2 family gray 9.25 X 47563
Bi-La-Si La5Bi2Si Y2HfS5,oP32,62 Pnma 1.2798,0.9567,0.8418,90,90,90 - - 7.35 A 56869
Bi-La-Sn La4SnBi2 Th3P 4,cI28,220 I-43d 0.9779,0.9779,0.9779,90,90,90 - - 7.76 A 10750
Bi-La-Te LaBiTe *,oP*,19 P212121 0.708,0.72,1.82,90,90,90 - - - N 30977
Bi-La-Zn Zn0.52 LaBi2 CuHfSi2,tP8,129 P4/nmm 0.4599,0.4599,0.9987,90,90,90 - - 9.29 X 50569
Bi-Li-Mg LiMgBi MgAgAs,cF12,216 F-43m 0.674,0.674,0.674,90,90,90 - - 5.21 X 1276
Bi-Li-Mg Li2MgBi Cu2MnAl,cF16,225 Fm-3m 0.6755,0.6755,0.6755,90,90,90 b.c.c. family - 5.33 X 4310
Bi-Li-O LiBiO2 LiBiO2,oI32,72 Ibam 0.5208,1.8041,0.4999,90,90,90 - colorless 7.01 X 16561
Bi-Li-O LiBiO3 LiBiO3,oP40,56 Pccn 0.49135,0.88278,1.06914,90,90,90 - - 7.56 X 32108
Bi-Li-O Li3BiO3 Li3BiO3,aP56,2 P-1 0.90238,0.92353,0.97302,65.931,72.496,89.291 - colorless 5.27 X 23015
Bi-Li-O Li3BiO4 *,tP*,* - 0.875,0.875,0.422,90,90,90 - - - N 2409
Bi-Li-O Li5BiO5 Li5BiO5,mS22,8 C1m1 0.9964,0.4148,0.59409,90,109.49,90 - - 4.64 X 22685
Bi-Li-O Li7BiO6 lt Li7TaO6,aP15,2 P-1 0.54427,0.55231,0.60668,62.64,62.402,60.287 - colorless 4.38 X 45698
Bi-Li-O Li7BiO6 rt Li7SbO6,hR42,146 R3 0.55,0.55,1.545,90,90,120 - - 4.35 A 4921
Bi-Li-S Li0.5 Bi0.5 S NaCl,cF8,225 Fm-3m 0.5603,0.5603,0.5603,90,90,90 rocksalt family - 5.29 X 711
Bi-Li-Sr LiSrBi TiNiSi,oP12,62 Pnma 0.829,0.493,0.876,90,90,90 AlB2 family black 5.63 X 9488
Bi-Li-Te Li0.5 Bi0.5 Te NaCl,cF8,225 Fm-3m 0.6234,0.6234,0.6234,90,90,90 rocksalt family black 6.46 X 11836
Bi-Li-Ti LiTiBi *,o**,* - 0.7889,0.8484,0.9698,90,90,90 - - - N 38100
Bi-Li-Ti Li2TiBi Cu2MnAl,cF16,225 Fm-3m 0.6663,0.6663,0.6663,90,90,90 b.c.c. family - 6.08 X 38100
Bi-Li-V LiVBi MgAgAs,cF12,216 F-43m 0.742,0.742,0.742,90,90,90 - - 4.34 X 47552
Bi-Li-V Li0.8 V0.2 Bi CuAu,tP2,123 P4/mmm 0.32103,0.32103,0.4052,90,90,90 close-packed structure - 8.94 X 47552
Bi-Li-V Li2.6 V0.4 Bi BiF3,cF16,225 Fm-3m 0.6641,0.6641,0.6641,90,90,90 b.c.c. family - 5.61 X 47552
Bi-Li-Y Li3YBi2 Li3LaSb2,hP6,164 P-3m1 0.46065,0.46065,0.729,90,90,120 - black 6.54 A 17606
Bi-Li-Yb LiYbBi TiNiSi,oP12,62 Pnma 0.7692,0.4733,0.8374,90,90,90 AlB2 family black 8.47 A 33892
Handbook of Inorganic Substances – Edition 2015 : Data 333

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Li-Zr Li2.44 Zr0.14Bi BiF3 ,cF16,225 Fm-3m 0.6738,0.6738,0.6738,90,90,90 b.c.c. family - 5.18 X 25521
Bi-Lu-Mn Lu6MnBi2 K2UF6,hP9,189 P-62m 0.8019,0.8019,0.4185,90,90,120 Fe2P family - 10.85 X 41723
Bi-Lu-Ni LuNiBi MgAgAs,cF12,216 F-43m 0.634,0.634,0.634,90,90,90 - - 11.54 X 7870
Bi-Lu-Ni Lu5Ni2Bi Mo5 SiB2,tI32,140 I4/mcm 0.7429,0.7429,1.3415,90,90,90 - - 10.78 A 36495
Bi-Lu-O LuBiO3 rt YbBiO3,aP48,2 P-1 0.8383,0.8465,0.9902,111.22,94.08,105.76 - - 9.27 A 45583
Bi-Lu-O Lu0.67 Bi1.33 O3 *,cF20,225 Fm-3m 0.5441,0.5441,0.5441,90,90,90 - - - N 30615
Bi-Lu-O Lu7Bi17O36 rt Yb7Bi17O36,oP72,47 Pmmm 0.5478,1.0688,1.6197,90,90,90 - - 9.37 A 45583
Bi-Lu-Pd LuPdBi MgAgAs,cF12,216 F-43m 0.6566,0.6566,0.6566,90,90,90 - - 11.51 X 40552
Bi-Lu-Pd Lu5Pd2Bi Mo5 SiB2,tI32,140 I4/mcm 0.7586,0.7586,1.344,90,90,90 - - 11.14 A 37652
Bi-Lu-Pt LuPtBi MgAgAs,cF12,216 F-43m 0.6574,0.6574,0.6574,90,90,90 - - 13.54 X 40552
Bi-Lu-Te LuBiTe 3 Bi2Te3,hR15,166 R-3m 0.418,0.418,3.088,90,90,120 - - 8.17 A 12377
Bi-Lu-Te Lu9BiTe Sc9Te2,oS88,36 Cmc21 0.8172,1.655,1.83,90,90,90 - black 10.26 X 54138
Bi-Mg-Ni MgNiBi MgAgAs,cF12,216 F-43m 0.6166,0.6166,0.6166,90,90,90 - - 8.27 X 450
Bi-Mg-O MgBi2O6 Ta2FeO6,tP18,136 P42/mnm 0.4826,0.4826,0.9719,90,90,90 - brown dark 7.90 X 33576
Bi-Mg-O Mg4 Bi9O18 Bi12 SiO20,cI66,197 I23 1.025,1.025,1.025,90,90,90 - - 6.99 X 14484
Bi-Mg-Pb Mg0.0126Pb0.9859 Bi0.0015 Cu,cF4,225 Fm-3m 0.49461,0.49461,0.49461,90,90,90 close-packed structure - 11.25 X 1242
Bi-Mg-Si Mg1.96 Bi0.02 Si0.98 CaF2 ,cF12,225 Fm-3m 0.6362,0.6362,0.6362,90,90,90 fluorite family - 2.05 X 58955
Bi-Mg-Sr SrMg2Bi2 Ce2SO2,hP5,164 P-3m1 0.479,0.479,0.793,90,90,120 - gray silver 5.84 A 11115
Bi-Mg-Yb Mg2 YbBi2 Ce2SO2,hP5,164 P-3m1 0.47258,0.47258,0.76453,90,90,120 - - 7.18 X 56275
Bi-Mn-Na NaMnBi PbClF,tP6,129 P4/nmm 0.4527,0.4527,0.7672,90,90,90 - gray 6.06 X 36632
Bi-Mn-Nd Nd3 MnBi5 CuHf5Sn3,hP18,193 P63/mcm 0.95438,0.95438,0.64089,90,90,120 AlB2 family - 10.07 X 50416
Bi-Mn-Nd Ndx MnBi (Nd) tf NiAs,hP4,194 P63/mmc 0.414,0.414,0.58,90,90,120 AlB2 family - 10.18 X 26289
Bi-Mn-Ni Mn5 Ni2Bi4 Mn5 Ni2Bi4,cF88,216 F-43m 1.2161,1.2161,1.2161,90,90,90 - - 9.07 X 14630
Bi-Mn-O MnBiO2.99 orth (Mn0.67 Ni0.33 )BiO3,oP80,31 Pmn21 1.56,0.552,1.11,90,90,90 - - 8.67 X 56699
Bi-Mn-O MnBiO3 hp GdFeO3,oP20,62 Pnma 0.55132,0.75752,0.54535,90,90,90 perovskite family black 9.10 X 52235
Bi-Mn-O MnBiO3 ht BaTiO3,tP5,99 P4mm 0.3943,0.3943,0.393,90,90,90 perovskite family - 8.48 A 36108
Bi-Mn-O MnBiO3 lt *,aP5,1 P1 0.3919,0.395,0.3995,91.9,90.7,90.9 perovskite family - - N 36108
Bi-Mn-O MnBi0.95 O2.93 rt ScBiO3,mS40,15 C12/c1 0.95207,0.5598,0.98344,90,110.567,90 - gray dark 8.13 X 57351
Bi-Mn-O MnBi12O20 Bi12 SiO20,cI66,197 I23 1.0206,1.0206,1.0206,90,90,90 - green dark 9.01 X 29098
Bi-Mn-O Mn0.11 Bi0.59 O AgI,cI38,229 Im-3m 0.4338,0.4338,0.4338,90,90,90 - brown dark 5.91 A 27632
Bi-Mn-O Mn0.974 Bi0.974 O3 Mn0.974 Bi0.974 O3,mP40,14 P121/c1 0.95565,0.55182,0.97051,90,109.442,90 - - 8.40 X 54464
Bi-Mn-O Mn16 Bi16O45 Mn16 Bi16O45,cI308,220 I-43d 1.58855,1.58855,1.58855,90,90,90 - - 8.19 X 56378
Bi-Mn-O Mn2 BiO5 rt DyMn2O5,oP32,55 Pbam 0.75472,0.85244,0.57836,90,90,90 - black 7.12 X 58204
Bi-Mn-O Mn2 Bi3O7 Ca3Ti2O7,oS48,36 Cmc21 1.68,0.551,0.545,90,90,90 - - 11.18 X 56699
Bi-Mn-O Mn3 Bi3O10.5 Mn3 Bi3O10.5,cP88,201 Pn-3 0.91192,0.91192,0.91192,90,90,90 - black 8.41 X 54431
Bi-Mn-O Mn3 Bi3O11 (Ga0.33 Sb0.67 )3Bi3O11 ,cP84,201 Pn-3 0.91634,0.91634,0.91634,90,90,90 - black 8.35 X 52412
Bi-Mn-O Mn3 Bi4O11.5 Mn3 Bi4O11.5,hR123,148 R-3 0.7709,0.7709,2.7832,90,90,120 - black 8.24 X 57564
Bi-Mn-O Mn7 BiO12 mon Mn7 BiO12,mS40,8 C1m1 1.05296,0.7384,0.75178,90,134.32,90 - - 6.24 X 53183
Bi-Mn-O Mn7 Bi0.91 O12 cub Mn7 Bi0.91 O12,cI54,204 Im-3 0.7458,0.7458,0.7458,90,90,90 - black 6.14 X 55977
Bi-Mn-O Mn7 Bi0.95 O12 Mn7 Bi0.95 O12,hR69,146 R3 1.0584,1.0584,0.64458,90,90,120 - black 6.17 X 55977
Bi-Mn-Pd Mn5 Pd2Bi4 Cu4Mn3Bi4,cF88,225 Fm-3m 1.244,1.244,1.244,90,90,90 - - 9.13 X 8580
Bi-Mn-Pr Pr3MnBi5 CuHf5Sn3,hP18,193 P63/mcm 0.95849,0.95849,0.64311,90,90,120 AlB2 family - 9.88 X 50416
Bi-Mn-Rb RbMnBi PbClF,tP6,129 P4/nmm 0.4785,0.4785,0.8542,90,90,90 - gray 5.93 X 36632
Bi-Mn-Rh Mn5 Rh2Bi4 Cu4Mn3Bi4,cF88,225 Fm-3m 1.231,1.231,1.231,90,90,90 - - 9.38 A 8580
Bi-Mn-S Mn0.7 Bi2.2 S4 HgBi2S4,mS28,12 C12/m1 1.2869,0.39546,1.4771,90,116.69,90 gratianite - 6.20 X 27418
Bi-Mn-Sb MnBi0.1 Sb0.9 rt NiAs,hP4,194 P63/mmc 0.4133,0.4133,0.5756,90,90,120 AlB2 family - 7.23 X 9272
Bi-Mn-Sb MnBi0.85 Sb0.15 rt Mn(Bi0.85 Sb0.15),oP10,51 Pmma 0.570,0.427,0.740,90,90,90 - - 9.25 X 10096
Bi-Mn-Se MnBi2Se4 mon HgBi2S4,mS28,12 C12/m1 1.3384,0.40925,1.53238,90,116.368,90 - gray 6.97 X 58434
Bi-Mn-Se MnBi2Se4 tet *,t*14,* - 0.578,0.578,0.95,90,90,90 - gray 8.25 N 12686
Bi-Mn-Se Mn3 Bi2Se6 *,hP*,* - 0.436,0.436,3.037,90,90,120 - gray - N 12686
Bi-Mn-Sm Sm2 Mn3Bi6 Sm2 Mn3Bi6,mP22,11 P121/m1 1.03917,0.44557,1.32793,90,108.01,90 - - 9.77 X 50416
Bi-Mn-Sr SrMnBi2 SrZnBi2,tI16,139 I4/mmm 0.458,0.458,2.313,90,90,90 - gray steel 7.67 X 11112
Bi-Mn-Sr Sr14 MnBi11 Ca14 AlSb11,tI208,142 I41/acd 1.782,1.782,2.3394,90,90,90 - black 6.40 X 25886
Bi-Mn-Te Mn0.125 Bi0.75 Te1.125 BiSe,hP12,164 P-3m1 0.43783,0.43783,2.38107,90,90,120 - - 7.74 X 47370
Bi-Mn-Ti Ti0.03 Mn0.97 Bi (Cu0.1 Mn0.9)Bi,oP10,17 P222 1 0.436,0.755,0.579,90,90,90 - - 9.19 X 10096
Bi-Mn-Ti Ti4MnBi2 V4SiSb2,tI28,140 I4/mcm 1.0491,1.0491,0.4978,90,90,90 - gray light 8.06 X 33504
Bi-Mn-Tm Tm6 MnBi2 K2UF6,hP9,189 P-62m 0.8062,0.8062,0.4215,90,90,120 Fe2P family - 10.40 X 43149
Bi-Mn-Y Y6MnBi2 K2UF6,hP9,189 P-62m 0.8242,0.8242,0.4292,90,90,120 Fe2P family - 6.62 X 41723
Bi-Mn-Yb Yb14 MnBi11 Ca14 AlSb11,tI208,142 I41/acd 1.7,1.7,2.2259,90,90,90 - - 9.86 X 34248
Bi-Mn-Yb Yb9Mn4Bi9 Ca9Mn4Bi9,oP44,55 Pbam 1.24098,2.2265,0.4707,90,90,90 - black 9.34 X 54022
Bi-Mn-Zn Zn0.07 Mn0.93 Bi (Cu0.1 Mn0.9)Bi,oP10,17 P222 1 0.435,0.754,0.577,90,90,90 - - 9.29 X 10096
Bi-Mn-Zr Zr5Mn0.5 Bi2.5 W5Si3,tI32,140 I4/mcm 1.1274,1.1274,0.5629,90,90,90 - gray 9.34 A 43495
Bi-Mn-Zr Zr6MnBi2 K2UF6,hP9,189 P-62m 0.78282,0.78282,0.37147,90,90,120 Fe2P family - 8.59 X 44864
Bi-Mo-O Bi14 [MoO4]O20 lt Bi14 [WO4]O20,mS96,12 C12/m1 1.2211,1.73356,0.86454,90,134.514,90 - - 8.67 X 41980
Bi-Mo-O Bi14 [MoO4]O20 rt Bi14 [WO4]O20,tI82,87 I4/m 0.87084,0.87084,1.73163,90,90,90 - - 8.61 X 35553
Bi-Mo-O Bi2[MoO4]2O Bi2[MoO4]2O,mP104,14 P121/c1 1.1899,1.0813,1.68603,90,134.759,90 - yellow 6.50 X 19295
Bi-Mo-O Bi2[MoO4]3 Bi2[MoO4]3,mP68,14 P121/c1 0.7685,1.1491,1.1929,90,115.4,90 - yellow 6.27 X 7157
Bi-Mo-O MoBi2O6 ht2 MoBi2O6,mP144,14 P121/c1 1.7244,2.2429,0.5586,90,90.486,90 - yellow 7.50 X 38089
Bi-Mo-O MoBi2O6 rt MoBi2O6,oP36,29 Pca21 0.54822,1.61986,0.55091,90,90,90 koechlinite low yellow 8.28 X 16844
Bi-Mo-O MoBi2O6 tet *,tI18,121 I-42m 0.395,0.395,1.721,90,90,90 - - - N 3159
Bi-Mo-O MoBi4O9 ht2 *,t**,* - 0.409,0.409,1.691,90,90,90 - brown red - N 1154
Bi-Mo-O Mo0.125 Bi1.75 O3 Bi2O3,tP20,114 P-421c 0.77875,0.77875,0.57716,90,90,90 - - 8.08 X 33664
Bi-Mo-O Mo0.16 Bi0.84 O1.74 ht1 CaF2 ,cF12,225 Fm-3m 0.56478,0.56478,0.56478,90,90,90 fluorite family yellow 8.06 X 37662
Bi-Mo-O Mo2 Bi2O9 *,oP*,* - 1.079,1.186,1.189,90,90,90 - - - N 2955
Bi-Mo-O Mo2 Bi6O15 rt Mo2 Bi6O15,mP92,14 P121/c1 0.86615,0.56484,2.90708,90,97.983,90 - white 7.95 X 57775
Bi-Mo-O Mo3 Bi10O24 rt Mo3 Bi10O24,mS74,5 C121 2.37282,0.56491,0.86817,90,95.867,90 - white 7.92 X 52844
Bi-Mo-O Mo3 Bi8O21 rt Mo3 Bi8O21,mP128,14 P121/c1 0.86368,0.56301,3.99117,90,100.977,90 - white 8.00 X 57775
Bi-Mo-O Mo4.8 Bi13.2 O34.2 Mo5 Bi13O34.5 ,mP110,13 P12/c1 1.17525,0.58005,2.48024,90,102.867,90 - yellow 7.59 X 36127
334 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Mo-O Mo5Bi14O36 rt Mo5Bi14O36,mS110,5 C121 3.44733,0.5641,0.86453,90,99.697,90 - white 7.98 X 57775


Bi-Mo-O Mo7Bi38O78 Mo7Bi38O78,oP492,60 Pbcn 2.87058,1.68493,1.69376,90,90,90 - - 8.00 X 52850
Bi-Mo-S Mo6BiS8 Mo6PbS8,hR45,148 R-3 0.9194,0.9194,1.1325,90,90,120 Chevrel phase black gray 6.26 A 19244
Bi-N-O Bi5[NO3]O7 Bi5[NO3]O7,mP64,14 P121/c1 0.85846,2.3385,0.55422,90,108.103,90 - colorless 7.66 X 44091
Bi-N-Sr Sr3BiN CaTiO3,cP5,221 Pm-3m 0.5207,0.5207,0.5207,90,90,90 perovskite family black 5.71 X 48480
Bi-N-Th Th2BiN2 (Li0.25 Bi0.75 )2ClO2,tI10,139 I4/mmm 0.4075,0.4075,1.362,90,90,90 - - 10.29 X 5027
Bi-N-U U2BiN2 (Li0.25 Bi0.75 )2ClO2,tI10,139 I4/mmm 0.39292,0.39292,1.2548,90,90,90 - - 12.22 X 5027
Bi-Na-O NaBiO2 KSbS2,mS16,15 C12/c1 0.73917,0.72554,0.58823,90,127.694,90 - yellow 7.02 X 51590
Bi-Na-O NaBiO3 TiFeO3,hR30,148 R-3 0.55672,0.55672,1.5989,90,90,120 - - 6.50 X 37861
Bi-Na-O Na0.05 Bi0.65 O2.87 m AgI,cI38,229 Im-3m 0.4339,0.4339,0.4339,90,90,90 - golden 7.44 A 27632
Bi-Na-O Na0.1 Bi0.9O1.75 CaF2,cF12,225 Fm-3m 0.553,0.553,0.553,90,90,90 fluorite family - 8.58 X 15433
Bi-Na-O Na0.39 Bi3.45 O7 Ca2Nb2O7 ,cF88,227 Fd-3m 1.0943,1.0943,1.0943,90,90,90 pyrochlore family - 8.54 X 27545
Bi-Na-O Na1.5 Bi0.5O2 NaFeO2,hR12,166 R-3m 0.33214,0.33214,1.64852,90,90,120 rocksalt family red dark 5.41 X 45769
Bi-Na-O Na3BiO3 Na3SbO3,cI56,217 I-43m 0.9687,0.9687,0.9687,90,90,90 rocksalt family colorless 4.76 X 13796
Bi-Na-O Na3BiO4 Na3BiO4,mP16,13 P12/c1 0.5871,0.6696,0.565,90,109.8,90 - orange 5.43 X 7062
Bi-Na-S Na0.5 Bi0.5S NaCl,cF8,225 Fm-3m 0.5776,0.5776,0.5776,90,90,90 rocksalt family - 5.10 X 10128
Bi-Na-Se Na0.5 Bi0.5Se NaCl,cF8,225 Fm-3m 0.5988,0.5988,0.5988,90,90,90 rocksalt family gray 6.03 X 12822
Bi-Na-Te Na0.5 Bi0.5Te NaCl,cF8,225 Fm-3m 0.6366,0.6366,0.6366,90,90,90 rocksalt family black 6.27 X 12822
Bi-Nb-O NbBiO4 ht NbBiO4,aP24,2 P-1 0.55376,0.76184,0.79324,77.435,89.857,92.788 - colorless 7.45 X 47096
Bi-Nb-O NbBiO4 rt WSnO4,oP24,52 Pnna 0.5673,1.1714,0.4978,90,90,90 - colorless 7.35 X 27871
Bi-Nb-O NbBi15O25 *,cI32,229 Im-3m 1.05,1.05,1.05,90,90,90 - - - P 19481
Bi-Nb-O Nb0.2 Bi0.8 O1.7 (Ta0.21 Bi0.79)O1.71 ,cF60,225 Fm-3m 0.54867,0.54867,0.54867,90,90,90 fluorite family - 8.56 X 58607
Bi-Nb-O Nb0.25 Bi0.75 O1.75 rt UO2,cF36,225 Fm-3m 0.54653,0.54653,0.54653,90,90,90 fluorite family yellow 8.46 X 47464
Bi-Nb-O Nb16Bi47O111 Nb16Bi47O111 ,tI348,119 I-4m2 1.15216,1.15216,3.85603,90,90,90 - yellow 8.49 X 43379
Bi-Nb-O Nb17Bi3O47 Nb17Bi3O47 ,oP152,32 Pba2 1.2516,3.714,0.3922,90,90,90 - - 5.39 X 6043
Bi-Nb-O Nb25Bi103 O217 *,c**,* - 4.4,4.4,4.4,90,90,90 - - - N 19481
Bi-Nb-O Nb3Bi5O15 rt Nb3Bi5O15 ,oP46,30 Pnc2 2.1011,0.5473,0.5463,90,90,90 - - 8.27 X 49021
Bi-Nb-O Nb7.09 Bi3.32 O22.7 Nb7.09 Bi3.32 O22.7,hP108,194 P63 /mmc 0.74363,0.74363,1.97587,90,90,120 - gray 6.02 X 51015
Bi-Nb-S Nb3Bi0.33 S4 Tl0.39 V3S4 ,hP16,176 P63 /m 0.9572,0.9572,0.3376,90,90,120 - - 5.90 A 20550
Bi-Nb-S Nb3Bi2S6 Nb3Bi2S6,hP22,193 P63 /mcm 0.5743,0.5743,1.737,90,90,120 - - 5.95 X 13610
Bi-Nb-Se Nb3Bi0.33 Se4 Tl0.39 V3S4 ,hP16,176 P63 /m 0.9995,0.9995,0.3462,90,90,120 - - 7.36 A 20550
Bi-Nb-Te Nb3Bi0.33 Te 4 Tl0.39 V3S4 ,hP16,176 P63 /m 1.0648,1.0648,0.3636,90,90,120 - - 7.98 A 20550
Bi-Nd-Ni NdNiBi MgAgAs,cF12,216 F-43m 0.6479,0.6479,0.6479,90,90,90 - - 10.06 X 40552
Bi-Nd-Ni NdNi0.64 Bi2 CuHfSi2,tP8,129 P4/nmm 0.4525,0.4525,0.9546,90,90,90 - black 10.19 X 34437
Bi-Nd-Ni NdNi1.5 Bi2 CaBe2Ge2 ,tP10,129 P4/nmm 0.4521,0.4521,0.9556,90,90,90 - - 11.06 A 21323
Bi-Nd-Ni Nd3Ni3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.9753,0.9753,0.9753,90,90,90 - - 10.34 A 38029
Bi-Nd-O NdBi2O4.5 (La0.57 Bi0.43)Bi2O4.5 ,mP18,13 P12/c1 0.9439,0.3944,0.6923,90,105.03,90 - - 8.46 A 42087
Bi-Nd-O Nd0.25 Bi0.75 O1.5 CaF2,cF12,225 Fm-3m 0.55685,0.55685,0.55685,90,90,90 fluorite family - 8.34 X 46125
Bi-Nd-O Nd0.45 Bi0.55 O1.5 *,cF*,* - 0.5548,0.5548,0.5548,90,90,90 - - - N 33109
Bi-Nd-O Nd0.625 Bi0.375 O1.5 (La0.67 Bi0.33)O1.5 ,hR9,160 R3m 0.38844,0.38844,0.9712,90,90,120 - greenish 7.56 A 38876
Bi-Nd-O Nd0.67 Bi0.33 O1.5 (La0.67 Bi0.33)O1.5 ,mS6,12 C12/m1 0.68026,0.39062,0.39542,90,126.419,90 - - 7.45 X 37678
Bi-Nd-O Nd0.675 Bi2.325 O4.5 ht2 (Sr0.78 Bi0.22 )Bi2O4.11 ,hR27,166 R-3m 0.39915,0.39915,2.7463,90,90,120 - yellow 8.61 X 36131
Bi-Nd-O Nd2BiO2 Cu2TlSe2,tI10,139 I4/mmm 0.39911,0.39911,1.3663,90,90,90 - - 8.08 X 59503
Bi-Nd-Rh NdRhBi TiNiSi,oP12,62 Pnma 0.7377,0.471,0.8008,90,90,90 AlB2 family - 10.89 A 40552
Bi-Nd-S NdBiS3 Sb2S3,oP20,62 Pnma 1.127,0.394,1.14,90,90,90 - - 5.90 A 33698
Bi-Nd-S Nd4Bi2S9 La4Bi2S9,oP60,62 Pnma 2.836,0.4,1.267,90,90,90 - gray 5.93 A 33698
Bi-Nd-Si Nd5Bi1.8 Si1.2 Y2HfS5,oP32,62 Pnma 1.2397,0.9344,0.8211,90,90,90 - - 7.90 A 56869
Bi-Ni-O NiBiO3 hp GdFeO3,oP20,62 Pnma 0.54323,0.75537,0.52843,90,90,90 perovskite family - 9.67 X 48519
Bi-Ni-O NiBiO3 rt NaCuF3,aP20,2 P-1 0.53942,0.56519,0.77131,92.182,90.22,88.296 perovskite family - 8.93 X 48519
Bi-Ni-O NiBi2O4 Co2.95 O4,cF56,216 F-43m 0.80462,0.80462,0.80462,90,90,90 - - 13.79 X 54175
Bi-Ni-O Ni2Bi2O5 *,oP*,* - 0.782,1.317,1.398,90,90,90 - - - N 14484
Bi-Ni-O Ni3.2 Bi9.8 O20 Bi12SiO20,cI66,197 I23 1.0141,1.0141,1.0141,90,90,90 - - 8.14 X 28628
Bi-Ni-Pr PrNiBi MgAgAs,cF12,216 F-43m 0.6512,0.6512,0.6512,90,90,90 - - 9.83 X 40552
Bi-Ni-Pr PrNi1.5 Bi2 CaBe2Ge2 ,tP10,129 P4/nmm 0.45349,0.45349,0.9604,90,90,90 - - 10.88 A 21323
Bi-Ni-Pr Pr3Ni3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.9807,0.9807,0.9807,90,90,90 - - 10.10 A 38029
Bi-Ni-Rh Rh0.4 Ni0.6 Bi NiAs,hP4,194 P63 /mmc 0.409,0.409,0.548,90,90,120 AlB2 family - 11.94 X 1727
Bi-Ni-Rh Rh0.5 Ni0.5 Bi3 NiBi3,oP16,62 Pnma 0.89054,0.4166,1.1403,90,90,90 - - 11.11 X 20164
Bi-Ni-S Ni3Bi2S2 Ni3Bi2S2,mS28,12 C12/m1 1.1066,0.8085,0.7965,90,134.,90 parkerite - 8.53 X 8036
Bi-Ni-S Ni4Bi4S0.5 Ta4SiTe4,oP36,55 Pbam 1.0077,1.75014,0.4196,90,90,90 - - 9.75 X 57421
Bi-Ni-Sb NiBi0.4 Sb0.6 NiAs,hP4,194 P63 /mmc 0.4,0.4,0.52,90,90,120 AlB2 family - 9.93 X 1727
Bi-Ni-Sc ScNiBi MgAgAs,cF12,216 F-43m 0.6191,0.6191,0.6191,90,90,90 - - 8.75 X 7870
Bi-Ni-Se NiBiSe NiSbS,cP12,198 P213 0.6214,0.6214,0.6214,90,90,90 pyrite-marcasite family - 9.60 A 1975
Bi-Ni-Se Ni3Bi2Se2 Ni3Bi2S2,mS28,12 C12/m1 1.1224,0.8188,0.81,90,133.24,90 - - 9.21 X 10881
Bi-Ni-Sm SmNiBi MgAgAs,cF12,216 F-43m 0.6433,0.6433,0.6433,90,90,90 - - 10.43 X 40552
Bi-Ni-Sm SmNi1.5 Bi2 CaBe2Ge2 ,tP10,129 P4/nmm 0.45049,0.45049,0.9438,90,90,90 - - 11.38 A 21323
Bi-Ni-Sm Sm3Ni3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.9702,0.9702,0.9702,90,90,90 - - 10.64 A 38029
Bi-Ni-Tb TbNiBi MgAgAs,cF12,216 F-43m 0.6419,0.6419,0.6419,90,90,90 - - 10.71 X 40552
Bi-Ni-Tb TbNi0.78 Bi2 CuHfSi2,tP8,129 P4/nmm 0.44849,0.44849,0.93062,90,90,90 - - 11.05 X 45040
Bi-Ni-Tb TbNi1.5 Bi2 CaBe2Ge2 ,tP10,129 P4/nmm 0.44899,0.44899,0.9309,90,90,90 - - 11.77 A 21323
Bi-Ni-Tb Tb5Ni2Bi Mo5SiB2,tI32,140 I4/mcm 0.7693,0.7693,1.3445,90,90,90 - - 9.36 A 36495
Bi-Ni-Ti Ti4NiBi2 V4SiSb2,tI28,140 I4/mcm 1.0554,1.0554,0.4814,90,90,90 - gray light 8.28 X 33504
Bi-Ni-Tm TmNiBi MgAgAs,cF12,216 F-43m 0.6368,0.6368,0.6368,90,90,90 - - 11.23 X 7870
Bi-Ni-Tm Tm5Ni2Bi Mo5SiB2,tI32,140 I4/mcm 0.7522,0.7522,1.3411,90,90,90 - - 10.25 A 36495
Bi-Ni-U U3Ni3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.95793,0.95793,0.95793,90,90,90 - - 13.04 X 51260
Bi-Ni-Y YNiBi MgAgAs,cF12,216 F-43m 0.6411,0.6411,0.6411,90,90,90 - - 8.99 X 7870
Bi-Ni-Y YNi0.82 Bi2 CuHfSi2,tP8,129 P4/nmm 0.44835,0.44835,0.93003,90,90,90 - - 9.86 X 45040
Bi-Ni-Y Y5Ni2Bi Mo5SiB2,tI32,140 I4/mcm 0.7673,0.7673,1.3566,90,90,90 - - 6.41 A 36495
Bi-Ni-Zn ZnNiBi MgAgAs,cF12,216 F-43m 0.58935,0.58935,0.58935,90,90,90 - - 10.81 X 39418
Handbook of Inorganic Substances – Edition 2015 : Data 335

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Ni-Zr ZrNiBi MgAgAs,cF12,216 F-43m 0.6148,0.6148,0.6148,90,90,90 - gray 10.26 X 33145


Bi-Ni-Zr Zr6NiBi2 K2UF6,hP9,189 P-62m 0.78269,0.78269,0.37205,90,90,120 Fe2P family - 8.61 X 37266
Bi-O-Os Os2Bi2O7 Ca2Nb2O7,cF88,227 Fd-3m 1.0338,1.0338,1.0338,90,90,90 pyrochlore family black 10.95 A 11829
Bi-O-P BiP 3O9 rt BiP 3 O9,mP52,14 P121/c1 0.7152,0.6933,1.3732,90,93.35,90 - colorless 4.36 X 8795
Bi-O-P BiP 5O14 ht HoP5O14,oP80,62 Pnma 0.8771,1.303,0.8993,90,90,90 - - 3.80 A 14199
Bi-O-P BiP 5O14 rt *,mP*,14 P121/c1 0.8702,0.8938,1.2926,90,90.566,90 - - - N 11528
Bi-O-P Bi[PO4] ht2 Sb[AsO4],mP12,11 P121/m1 0.4709,0.7073,0.4871,90,96.24,90 - - 6.26 X 17890
Bi-O-P Bi[PO4] rt Ce[PO4],mP24,14 P121/c1 0.64822,0.69516,0.81813,90,126.587,90 - white 6.82 X 28664
Bi-O-P Bi[PO4] trig Bi[PO4],hP18,152 P3121 0.6966,0.6966,0.646,90,90,120 ximengite - 5.58 X 1793
Bi-O-P Bi11.82P 0.91O20 Bi12 SiO20,cI66,197 I23 1.0169,1.0169,1.0169,90,90,90 - - 8.90 X 24919
Bi-O-P Bi14 [PO4]4O15 Bi14 [PO4]4O15,mS784,15 C12/c1 1.92745,1.13698,5.24082,90,93.63,90 - - 8.22 X 45159
Bi-O-P Bi17 [PO4]8O15 Bi17 [PO4]8O15,aP71,2 P-1 0.7047,0.9863,1.5365,77.604,84.556,70.152 - - 7.71 X 46459
Bi-O-P Bi2P4O13 rt Bi2P4O13,mS76,15 C12/c1 1.1977,0.6878,1.3285,90,106.5,90 - - 4.75 X 20878
Bi-O-P Bi23 [PO4]4O28.5 Bi23 [PO4]4O28.5 ,aP162,2 P-1 1.1366,1.1369,2.04492,93.775,102.442,119.565 - - 8.53 X 35103
Bi-O-P Bi46 [PO4]8O57 Bi46 [PO4]8O57,mS320,12 C12/m1 1.96073,1.14181,2.11119,90,112.14,90 - green pale 8.56 X 45145
Bi-O-P Bi5PO10 *,mS*,12 C12/m1 1.9642,1.1441,2.1131,90,112.37,90 - yellow - N 7680
Bi-O-P Bi5[PO4]2O4.5 Bi5[PO4]2O4.5 ,mS84,15 C12/c1 1.3093,0.5707,1.5293,90,98.24,90 - - 7.68 X 46459
Bi-O-P Bi6.67 [PO4]4O4 ht Bi6.67 [PO4]4O4,aP31,2 P-1 0.6933,0.7552,0.9195,106.9,93.9,112.2 - colorless 7.30 X 34824
Bi-O-P Bi7PO13 *,mS*,* - 1.9649,1.2031,2.4341,90,111.81,90 - - - N 27733
Bi-O-Pb PbBi12O20 rt Bi12 SiO20,cI66,197 I23 1.0292,1.0292,1.0292,90,90,90 - orange 9.25 X 28628
Bi-O-Pb Pb0.08 Bi0.92 O1.46 ht Cu2Se,cF44,225 Fm-3m 0.564,0.564,0.564,90,90,90 fluorite family - 8.60 X 19262
Bi-O-Pb Pb0.38 Bi0.62 O1.31 W,cI2,229 Im-3m 0.4357,0.4357,0.4357,90,90,90 - yellow 9.21 P 27632
Bi-O-Pb Pb2Bi2O7 Ca2Nb2O7,cF88,227 Fd-3m 1.1007,1.1007,1.1007,90,90,90 pyrochlore family red 9.41 A 37560
Bi-O-Pb Pb3Bi5O10.5 tet1 *,tP*,86 P42/n 1.2132,1.2132,2.0059,90,90,90 - - - N 36171
Bi-O-Pb Pb4.2 Bi8.4 O16.8 (Pb0.35 Bi0.65)12Bi0.6 O16.8 ,cI72,197 I23 1.02617,1.02617,1.02617,90,90,90 - yellow 8.90 X 43563
Bi-O-Pb Pb5Bi8O17 tet2 *,tI*,* - 0.3897,0.3897,1.3885,90,90,90 - - - N 36175
Bi-O-Pb Pb6.17 Bi9.83 O21 rt Pb4(Pb0.54 Bi0.45)4Bi8O21,aP37,2 P-1 0.72101,0.74507,1.41768,80.643,82.81,61.527 - - 9.24 X 38489
Bi-O-Pd PdBi2O4 PdBi2O4,tI28,108 I4cm 0.8623,0.8623,0.5909,90,90,90 - black 8.89 X 10303
Bi-O-Pd Pd2BiO4 Pt2PbO4,aP14,2 P-1 0.57363,0.60253,0.6411,114.371,95.91,111.54 - black 9.01 X 58371
Bi-O-Pr PrBi2O4.5 (La0.57 Bi0.43)Bi2O4.5 ,mP18,13 P12/c1 0.947,0.3945,0.6968,90,104.73,90 - - 8.32 A 42087
Bi-O-Pr Pr0.25 Bi0.75O1.5 CaF2 ,cF12,225 Fm-3m 0.55579,0.55579,0.55579,90,90,90 fluorite family - 8.36 X 46125
Bi-O-Pr Pr0.675 Bi2.325 O4.5 ht2 (Sr0.78 Bi0.22 )Bi2O4.11 ,hR27,166 R-3m 0.39975,0.39975,2.7509,90,90,120 - yellow 8.54 X 36131
Bi-O-Pr Pr0.7 Bi0.3 O1.5 rt Pr0.7 Bi0.3 O1.5 ,hR9,166 R-3m 0.38729,0.38729,0.97452,90,90,120 fluorite family - 7.29 X 32105
Bi-O-Pr Pr2BiO2 (Li0.25 Bi0.75 )2ClO2,tI10,139 I4/mmm 0.40149,0.40149,1.37017,90,90,90 - - 7.86 X 52512
Bi-O-Pt Pt2Bi2O7 Ca2Nb2O7,cF88,227 Fd-3m 1.0369,1.0369,1.0369,90,90,90 pyrochlore family black 10.96 X 22562
Bi-O-Rb RbBiO2 KSbS2,mS16,15 C12/c1 0.8062,0.83888,0.59814,90,123.68,90 - colorless 6.44 X 35181
Bi-O-Rb Rb2Bi4O7 Rb2Bi4O7,mS208,15 C12/c1 2.037,1.2855,1.5666,90,94.783,90 - white 7.27 X 41074
Bi-O-Rb Rb3BiO3 Na3AsS3,cP28,198 P213 0.87548,0.87548,0.87548,90,90,90 - yellow 5.08 X 33949
Bi-O-Re Bi[ReO4] Bi[ReO4],oS24,63 Cmcm 0.3839,1.4914,0.5534,90,90,90 - red 9.63 X 12547
Bi-O-Re Bi14 [ReO4]O20.5 Bi14 [WO4]O20,tI124,87 I4/m 0.87216,0.87216,1.74177,90,90,90 - yellow 8.78 X 45045
Bi-O-Re ReBi3O8 ht ReBi3O8,cI96,199 I213 1.16263,1.16263,1.16263,90,90,90 - yellow 7.96 X 59361
Bi-O-Re ReBi3O8 rt ReBi3O8,cP96,198 P213 1.15951,1.15951,1.15951,90,90,90 - yellow 8.02 X 59361
Bi-O-Re ReBi9O17 rt ReBi9O17,mP108,14 P121/c1 0.9903,1.97139,1.16212,90,125.299,90 - - 8.39 X 54945
Bi-O-Re Re0.1 Bi0.9O1.7 ht CaF2 ,cF12,225 Fm-3m 0.57809,0.57809,0.57809,90,90,90 fluorite family - 8.04 X 52912
Bi-O-Re Re0.4 Bi3.6O6.8 (Re0.4 Bi0.6)Bi3O6.8 ,mP24,11 P121/m1 0.9788,0.39843,1.00025,90,109.91,90 fluorite family - 8.47 X 55354
Bi-O-Re Re2BiO6 Re2BiO6,mS32,12 C12/m1 0.5516,0.4906,0.8384,90,106.71,90 - colorless 10.35 X 12547
Bi-O-Re Re3Bi3O11 Ru3Bi3O11,cP68,201 Pn-3 0.9367,0.9367,0.9367,90,90,90 - black 11.00 X 49141
Bi-O-Rh RhBiO3 hp GdFeO3,oP20,62 Pnma 0.58098,0.7772,0.5351,90,90,90 perovskite family black 9.89 X 59693
Bi-O-Rh RhBiO3 (K0.5 [H2O]0.5 )(Ta0.5 ...,cF80,227 Fd-3m 1.0207,1.0207,1.0207,90,90,90 pyrochlore family black 8.99 A 20654
Bi-O-Rh Rh12 Bi6O29 Rh12 Bi6O29,mS188,12 C12/m1 1.9833,1.2224,0.95036,90,97.274,90 - black 8.58 X 49075
Bi-O-Rh Rh2Bi2O7 Ca2Nb2O7,cF88,227 Fd-3m 1.02764,1.02764,1.02764,90,90,90 pyrochlore family black 9.01 X 33600
Bi-O-Ru RuBi12O20 rt Bi12 SiO20,cI66,197 I23 1.031,1.031,1.031,90,90,90 - - 8.88 A 13652
Bi-O-Ru Ru2Bi2O6.8 Ca2Nb2O7,cF88,227 Fd-3m 1.02991,1.02991,1.02991,90,90,90 pyrochlore family black 8.86 X 35989
Bi-O-Ru Ru3Bi3O11 ht Ru3Bi3O11,cP68,201 Pn-3 0.9305,0.9305,0.9305,90,90,90 - - 9.12 X 27068
Bi-O-S Bi14 [SO4]O20 Bi14 [SO4]O20,tI94,87 I4/m 0.866,0.866,1.7272,90,90,90 - yellow pale 8.57 X 34261
Bi-O-S Bi14 [SO4]5O16 Bi14 [SO4]5O16,mS138,12 C12/m1 2.1638,0.5657,1.5087,90,119.1,90 - - 7.54 X 19811
Bi-O-S Bi2SO2 Bi2SO2,oP10,58 Pnnm 0.3874,1.1916,0.384,90,90,90 - gray silver 9.03 X 16893
Bi-O-S Bi2[SO4]O2 *,mS*,5 C121 1.414,0.42343,0.41026,90,106.706,90 - - - N 19811
Bi-O-S Bi2[SO4]2O Bi2[SO4]2O,mS312,15 C12/c1 3.216,0.67606,2.2612,90,119.55,90 - - 5.83 X 20933
Bi-O-S Bi6S4[SO4]O4 Bi6S4[SO4]O4,tI46,139 I4/mmm 0.39592,0.39592,4.1241,90,90,90 - gray 7.92 X 59295
Bi-O-S Bi8[SO4]O11 Bi8[SO4]O11,tP208,92 P41212 1.17884,1.17884,2.27642,90,90,90 - - 8.16 X 43277
Bi-O-S Bi8.67 [SO4]4O9 Bi8.67 [SO4]4O9,mS152,15 C12/c1 2.467,0.565,1.5139,90,97.67,90 - - 7.43 X 19811
Bi-O-Sb Bi0.5 Sb0.5 O2 SbO2,mS24,15 C12/c1 1.20295,0.48784,0.54518,90,105.295,90 - orange 8.50 X 29747
Bi-O-Sb Bi1.8 Sb0.2 O3 Bi2O3,tP20,114 P-421c 0.7753,0.7753,0.5595,90,90,90 - - 8.86 A 14221
Bi-O-Sb Bi3SbO7 Bi3SbO7,aP22,2 P-1 0.66044,0.70146,0.76048,73.388,89.225,76.19 - - 8.73 X 40439
Bi-O-Sc ScBiO3 hp ScBiO3,mS40,15 C12/c1 0.98899,0.58221,1.00462,90,108.3,90 - - 7.30 X 46559
Bi-O-Sc ScBiO3 rt (K0.5 [H2O]0.5 )(Ta0.5 ...,cF80,227 Fd-3m 1.078,1.078,1.078,90,90,90 pyrochlore family - 6.40 A 4853
Bi-O-Se Bi1.8 Se0.1 O2.7 *,tP*,* - 1.093,1.093,0.5774,90,90,90 - - - N 22785
Bi-O-Se Bi2SeO2 (Li0.25 Bi0.75 )2ClO2,tI10,139 I4/mmm 0.3887,0.3887,1.2164,90,90,90 - - 9.56 X 38176
Bi-O-Se Bi2SeO5 Bi2TeO5,oS64,39 Aem2 1.1425,1.6244,0.5487,90,90,90 - yellow 7.53 X 39616
Bi-O-Se Bi2[SeO3]3 Bi2[SeO3]3,mP56,14 P121/c1 1.3491,0.4675,1.53033,90,117.767,90 - colorless 6.21 X 38316
Bi-O-Se Bi4SeO8 ht *,mP*,* - 1.22288,1.118,1.5051,90,107.221,90 - - - N 22785
Bi-O-Se Bi6SeO11 *,o**,* - 1.126,1.1307,1.628,90,90,90 - - - N 22785
Bi-O-Si Bi12 SiO20 Bi12 SiO20,cI66,197 I23 0.9944,0.9944,0.9944,90,90,90 sillénite yellow 9.65 X 54700
Bi-O-Si Bi2SiO5 GeBi2O5,oS32,36 Cmc21 1.5173,0.54729,0.53132,90,90,90 - colorless 7.92 X 19418
Bi-O-Si Bi2Si3O9 Ge3Bi2O9,hP28,176 P63/m 0.68443,0.68443,0.94125,90,90,120 - - 5.62 X 47172
Bi-O-Si Bi4[SiO4]3 Bi4[SiO4]3,cI76,220 I-43d 1.02867,1.02867,1.02867,90,90,90 eulytine white 6.79 X 33863
Bi-O-Sm Sm0.06 Bi1.94 O3 *,t**,* - 1.096,1.096,0.566,90,90,90 - - - N 24941
336 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-O-Sm Sm0.1 Bi0.9 O1.5 ht CaF2,cF12,225 Fm-3m 0.556,0.556,0.556,90,90,90 fluorite family orange 8.78 X 24941
Bi-O-Sm Sm0.25 Bi0.75 O1.5 ht *,hR*,* - 0.3976,0.3976,2.7357,90,90,120 - - - N 46125
Bi-O-Sm Sm0.625 Bi0.375 O1.5 (La0.67 Bi0.33)O1.5 ,hR9,160 R3m 0.385,0.385,0.9569,90,90,120 - - 7.96 A 30615
Bi-O-Sm Sm0.675 Bi2.325 O4.5 rt (Sr0.78 Bi0.22 )Bi2O4.11 ,hR27,166 R-3m 0.39783,0.39783,2.7391,90,90,120 - - 8.75 X 36131
Bi-O-Sm Sm1.52 Bi2.48 O6 rt Gd(Gd0.17 Bi0.83)3O6,cI80,199 I213 1.11017,1.11017,1.11017,90,90,90 - - 8.18 X 30721
Bi-O-Sm Sm2BiO2 Cu2TlSe2,tI10,139 I4/mmm 0.3953,0.3953,1.35083,90,90,90 - - 8.52 X 56443
Bi-O-Sm Sm4Bi2O K2NiF4,tI14,139 I4/mmm 0.49228,0.49228,1.7558,90,90,90 high-Tc family - 8.08 X 57414
Bi-O-Sn Sn0.15 Bi1.80 O3 *,t**,* - 1.093,1.093,0.556,90,90,90 - - - N 2037
Bi-O-Sn Sn2Bi2O7 hp Sn2Bi2O7,hP132,144 P31 0.75803,0.75803,3.71321,90,90,120 - - 8.28 X 56286
Bi-O-Sn Sn2Bi2O7 ht1 *,cF*,* - 2.142,2.142,2.142,90,90,90 - yellow - N 41809
Bi-O-Sn Sn2Bi2O7 ht2 Ca2Nb2O7 ,cF88,227 Fd-3m 1.07428,1.07428,1.07428,90,90,90 pyrochlore family - 8.22 X 33454
Bi-O-Sn Sn2Bi2O7 orth *,oP*,* - 0.37652,0.7957,1.2262,90,90,90 - - - N 40088
Bi-O-Sn Sn2Bi2O7 rt Hf2Bi2O7,mP352,7 P1c1 1.50502,1.50545,2.15114,90,89.962,90 - - 8.37 X 41809
Bi-O-Sr SrBiO3 HoNiO3,mP20,14 P121/c1 0.5948,0.60951,1.03678,90,125.072,90 perovskite family - 7.44 X 33609
Bi-O-Sr SrBi2O4 rt SrBi2O4,mS28,12 C12/m1 1.93,0.4358,0.61057,90,94.801,90 - white 7.39 X 25208
Bi-O-Sr SrBi2.8 O6.7 Ca2Nb2O7 ,cF88,227 Fd-3m 1.101,1.101,1.101,90,90,90 pyrochlore family brown dark 7.76 X 27763
Bi-O-Sr Sr0.25 Bi0.50 O ht AgI,cI38,229 Im-3m 0.4344,0.4344,0.4344,90,90,90 - yellow 5.77 A 27632
Bi-O-Sr Sr0.66 Bi2.34 O4.17 *,hR9,166 R-3m 0.397,0.397,2.835,90,90,120 - - 7.90 P 231
Bi-O-Sr Sr0.75 Bi2.25 O4.125 ht (Sr0.75 Bi0.25 )Bi2O4.125 ,hR63,166 R-3m 0.4011,0.4011,2.901,90,90,120 - - 7.42 X 29128
Bi-O-Sr Sr0.75 Bi2.25 O4.125 rt (La0.675 Bi0.325)Bi2O4.5 ,hR45,166 R-3m 0.397,0.397,2.854,90,90,120 - green 7.70 X 29128
Bi-O-Sr Sr0.88 Bi1.12 O2.56 *,t**,* - 1.3238,1.3238,0.4261,90,90,90 - - - N 29008
Bi-O-Sr Sr2Bi2O5 rt orth1 Sr2Bi2O5,oS20,63 Cmcm 0.38268,1.43142,0.61724,90,90,90 - - 6.61 X 25756
Bi-O-Sr Sr2Bi2O5 rt orth2 Sr2Bi2O5,oP36,62 Pnma 1.4261,0.616,0.7642,90,90,90 - yellow pale 6.66 X 25070
Bi-O-Sr Sr2.5 Bi1.5 O6 Ca(Ca0.5 Nd0.5)2NbO6,mP20,14 P121/c1 0.59476,0.60971,1.03659,90,125.055,90 perovskite family - 6.78 X 37600
Bi-O-Sr Sr3BiO5.5 Sr3BiO5.5,tI20,139 I4/mmm 0.60058,0.60058,0.83718,90,90,90 - yellow 6.16 X 27727
Bi-O-Sr Sr3Bi2O6 *,hR*,* - 1.2526,1.2526,1.8331,90,90,120 - - - N 23446
Bi-O-Sr Sr4Bi2O Sr4Bi2O,tI16,139 I4/mmm 0.49948,0.49948,1.7548,90,90,90 - black 5.95 X 57477
Bi-O-Sr Sr6Bi2O9 *,oP*,* - 1.6758,1.6998,1.7147,90,90,90 - yellow - N 22727
Bi-O-Ta TaBiO4 ht mon *,m**,* - 0.7681,0.5627,0.7749,90,101.45,90 - - - N 8822
Bi-O-Ta TaBiO4 ht orth *,o**,* - 0.499,0.557,1.185,90,90,90 - - - N 11003
Bi-O-Ta TaBiO4 ht tricl NbBiO4,aP24,2 P-1 0.5931,0.7672,0.7786,77.06,89.96,93.53 - colorless 8.75 X 47096
Bi-O-Ta TaBiO4 rt WSnO4,oP24,52 Pnna 0.56384,1.1773,0.49608,90,90,90 - yellowish 9.16 X 41961
Bi-O-Ta TaBi0.333 O3 *,t**,* - 0.3893,0.3893,0.3941,90,90,90 - - - N 13711
Bi-O-Ta TaBi15O25 *,cI*,* - 1.1078,1.1078,1.1078,90,90,90 - - - N 34794
Bi-O-Ta TaBi4.12 O8.68 *,cF400,227 Fd-3m 4.38,4.38,4.38,90,90,90 - - - P 26337
Bi-O-Ta Ta0.033 Bi1.948 O3 Bi2O3,tP20,114 P-42 1c 0.774,0.774,0.563,90,90,90 - - 9.08 A 26337
Bi-O-Ta Ta0.21 Bi0.79 O1.71 (Ta0.21 Bi0.79)O1.71 ,cF60,225 Fm-3m 0.54797,0.54797,0.54797,90,90,90 fluorite family yellow 9.30 X 57306
Bi-O-Ta Ta17Bi31O89 *,mS*,12 C12/m1 0.64319,0.38561,0.39033,90,126.033,90 - - - N 34794
Bi-O-Ta Ta2Bi4O11 mon *,m**,* - 1.347,1.463,1.94959,90,92.314,90 - - - N 26337
Bi-O-Ta Ta2Bi4O11 tricl Ta2Bi4O11 ,aP34,2 P-1 0.66089,0.76569,0.98828,101.345,90.183,90.029 - - 9.31 X 36129
Bi-O-Ta Ta3Bi7O18 mon Ta3Bi7O18 ,mS112,12 C12/m1 3.21758,0.76069,0.66364,90,93.684,90 - yellow 9.40 X 35545
Bi-O-Ta Ta3Bi7O18 tricl Ta3Bi7O18 ,aP56,1 P1 0.66358,0.76023,1.65366,103.208,93.672,90.086 - yellow 9.40 X 35545
Bi-O-Ta Ta7BiO19 (Ce0.5Ta0.5 )2Ta6O19,hP54,193 P63 /mcm 0.62211,0.62211,2.00345,90,90,120 - - 8.80 X 34620
Bi-O-Tb Tb0.25 Bi0.75 O1.5 CaF2,cF12,225 Fm-3m 0.55027,0.55027,0.55027,90,90,90 fluorite family - 8.79 X 46125
Bi-O-Tb Tb0.62 Bi0.38 O1.5 (La0.67 Bi0.33)O1.5,hR9,160 R3m 0.3784,0.3784,0.9517,90,90,120 - - 8.52 A 30615
Bi-O-Tb Tb0.675 Bi2.325 O4.5 (Sr0.78 Bi0.22 )Bi2O4.11 ,hR27,166 R-3m 0.39653,0.39653,2.7317,90,90,120 - - 8.91 X 36131
Bi-O-Tb Tb1.3 Bi2.7O6 Gd(Gd0.17 Bi0.83)3O6,cI80,199 I213 1.10192,1.10192,1.10192,90,90,90 - - 8.61 X 30721
Bi-O-Tb Tb2BiO2 Cu2TlSe2,tI10,139 I4/mmm 0.38962,0.38962,1.3317,90,90,90 - - 9.18 X 59503
Bi-O-Tc TcBi3O8 ReBi3O8,cP96,198 P213 1.15749,1.15749,1.15749,90,90,90 - yellow 7.31 X 50448
Bi-O-Tc Tc2Bi2O7 Ca2Nb2O7 ,cF88,227 Fd-3m 1.04746,1.04746,1.04746,90,90,90 pyrochlore family gray dark 8.39 X 50448
Bi-O-Tc Tc3Bi3O11 Ru3Bi3O11 ,cP68,201 Pn-3 0.93433,0.93433,0.93433,90,90,90 - - 8.93 A 50448
Bi-O-Te BiTeO4 BiTeO4,mS56,15 C12/c1 1.2792,0.5559,1.0283,90,114.48,90 - yellow 8.00 X 31584
Bi-O-Te Bi0.33 Te0.67 O1.835 ht CaF2,cF12,225 Fm-3m 0.56385,0.56385,0.56385,90,90,90 fluorite family gray steel 6.81 X 34750
Bi-O-Te Bi0.75 Te0.25 O1.625 ht *,tP*,* - 1.597,1.597,1.098,90,90,90 - - - N 17444
Bi-O-Te Bi0.825 Te0.175 O1.588 CaF2,cF12,225 Fm-3m 0.5576,0.5576,0.5576,90,90,90 fluorite family - 8.43 X 22505
Bi-O-Te Bi0.84 Te0.16 O1.58 *,oP*,* - 0.7761,1.13,1.136,90,90,90 - - - N 17444
Bi-O-Te Bi0.86 Te0.14 O1.57 ht *,tP*,* - 1.587,1.587,1.123,90,90,90 - - - N 17444
Bi-O-Te Bi1.895 Te0.105 O3.053 ht *,t**,* - 0.548,0.548,0.5669,90,90,90 - - - N 12293
Bi-O-Te Bi10Te2O19 ht *,m**,* - 0.542,0.5651,0.5422,90,91.4,90 - - - N 12293
Bi-O-Te Bi18Te7O41 ht *,t**,* - 0.5646,0.5646,0.5507,90,90,90 - - - N 12293
Bi-O-Te Bi2TeO2 (Li0.25 Bi0.75 )2ClO2,tI10,139 I4/mmm 0.3983,0.3983,1.2699,90,90,90 - - 9.52 X 38176
Bi-O-Te Bi2TeO5 Bi2TeO5,oS64,39 Aem2 1.1572,1.6458,0.55245,90,90,90 smirnite yellowish 7.90 X 38655
Bi-O-Te Bi2TeO6 MoBi2O6,oS36,64 Cmce 0.5319,1.6599,0.5318,90,90,90 - - 9.08 X 8077
Bi-O-Te Bi2Te2O7 Bi2Te2O7,oP176,60 Pbcn 2.27824,0.5514,2.21198,90,90,90 - - 7.51 X 34299
Bi-O-Te Bi2Te4O11 rt Bi2Te4O11 ,mP68,14 P121/c1 0.7013,0.7978,1.95825,90,105.705,90 chekhovichite gray steel 6.95 X 25820
Bi-O-Te Bi6Te2O15 *,oP*,* - 0.539,1.06,2.27,90,90,90 - - - N 22505
Bi-O-Th Th0.5 Bi0.5O1.75 CaF2,cF12,225 Fm-3m 0.5603,0.5603,0.5603,90,90,90 fluorite family brown 9.38 X 2415
Bi-O-Ti TiBi12O20 Bi12SiO20,cI66,197 I23 1.0188,1.0188,1.0188,90,90,90 - brown 9.03 X 21064
Bi-O-Ti Ti0.08 Bi1.92 O3.04 tet (Ti0.04 Bi0.96 )2O3.04 ,tP24,137 P42 /nmc 0.77069,0.77069,0.56735,90,90,90 fluorite family orange 8.94 X 31321
Bi-O-Ti Ti2Bi2O7 Ti2Bi2O7,cF200,227 Fd-3m 1.03591,1.03591,1.03591,90,90,90 - - 7.48 X 43348
Bi-O-Ti Ti3Bi4O12 ht1 Ti3Bi4O12,oS76,41 Aea2 0.54086,3.28425,0.54444,90,90,90 - yellow 8.05 X 35653
Bi-O-Ti Ti3Bi4O12 ht2 Ti3Bi4O12,tI38,139 I4/mmm 0.38633,0.38633,3.32942,90,90,90 - - 7.83 X 35653
Bi-O-Ti Ti4Bi2O11 ht Ti4Bi2O11,mS34,12 C12/m1 1.46412,0.38032,1.01483,90,132.586,90 - - 6.27 X 29878
Bi-O-Ti Ti4Bi2O11 rt Ti4Bi2O11,mS68,15 C12/c1 1.45999,0.38063,1.49418,90,93.129,90 - - 6.29 X 29878
Bi-O-Tl TlBiO2 *,mP32,14 P121/c1 0.716,1.165,0.716,90,90.,90 - yellow - N 5178
Bi-O-Tl Tl0.5 Bi12.5 O19.50 Tl0.5 Bi12.5 O19.5 ,cI82,197 I23 1.0221,1.0221,1.0221,90,90,90 - red dark 9.41 X 28446
Bi-O-Tl Tl3BiO3 *,cI448,220 I-43d 2.095,2.095,2.095,90,90,90 - black - N 5178
Bi-O-Tl Tl4Bi2O5 *,mP242,14 P121/c1 1.463,2.283,1.458,90,95.08,90 - red - N 5178
Handbook of Inorganic Substances – Edition 2015 : Data 337

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-O-Tm TmBiO3 rt YbBiO3,aP48,2 P-1 0.8443,0.8515,0.9955,111.4,93.84,105.81 - - 8.98 A 45583


Bi-O-Tm Tm0.25 Bi0.75 O1.5 CaF2 ,cF12,225 Fm-3m 0.54763,0.54763,0.54763,90,90,90 fluorite family - 9.02 X 46125
Bi-O-Tm Tm7 Bi17O36 rt Yb7Bi17O36,oP72,47 Pmmm 0.5513,1.0754,1.6271,90,90,90 - - 9.14 A 45583
Bi-O-U UBi2O6 mon UBi2O6,mS18,5 C121 0.6872,0.4009,0.969,90,90.16,90 - - 9.36 X 8732
Bi-O-U UBi2O6 trig UBi2O6,hP9,164 P-3m1 0.4045,0.4045,0.99,90,90,120 - - 8.90 X 8732
Bi-O-U U0.5 Bi0.5 O1.75 CaF2 ,cF12,225 Fm-3m 0.5483,0.5483,0.5483,90,90,90 fluorite family brown red 10.13 X 2415
Bi-O-V Bi[VO4] dre Zr[SiO4],tI24,141 I41/amd 0.7303,0.7303,0.6458,90,90,90 dreyerite orange 6.25 X 14507
Bi-O-V Bi[VO4] ht Ca[WO4],tI24,88 I41/a 0.5105,0.5105,1.1577,90,90,90 - - 7.13 X 19448
Bi-O-V Bi[VO4] puc Bi[VO4],oP24,60 Pbcn 0.5052,1.2003,0.5328,90,90,90 pucherite brown light 6.66 X 17689
Bi-O-V Bi[VO4] rt LaNbO4,mS24,15 C12/c1 0.73001,1.17044,0.51956,90,135.756,90 clinobisvanite yellow 6.95 X 12603
Bi-O-V Bi1.67 [VO4]O Bi1.67 [VO4]O,aP32,2 P-1 0.7114,0.7844,0.9372,106.09,94.468,112.506 - yellow 7.02 X 57052
Bi-O-V Bi46 [VO4]8O57 Bi46 [VO4]8O57,mP292,14 P121/c1 2.001,1.16445,2.04136,90,107.27,90 - yellow pale 8.37 X 45145
Bi-O-V VBi2O5 ht1 VBi2 O5,oP48,18 P21212 0.5473,1.5473,0.5537,90,90,90 - - 7.78 A 32104
Bi-O-V VBi2O5 ht2 VBi2 O5,oP48,18 P21212 0.5494,1.5449,0.5504,90,90,90 - black 7.80 X 32104
Bi-O-V VBi2O5 rt VBi2 O5,oP96,62 Pnma 0.54704,1.72471,1.49219,90,90,90 - - 7.77 X 36394
Bi-O-V VBi2O5.5 ht2 VBi2 O5.5 ,tI64,139 I4/mmm 0.39918,0.39918,1.54309,90,90,90 - - 7.52 X 42298
Bi-O-V V0.14 Bi0.86 O1.57 V0.14 Bi0.86 O1.83 ,cF96,225 Fm-3m 0.55496,0.55496,0.55496,90,90,90 fluorite family yellow 8.24 X 44761
Bi-O-V V0.2 Bi0.8 O1.7 Pr0.7 Bi0.3 O1.5 ,hR9,166 R-3m 0.3815,0.3815,0.999,90,90,120 fluorite family - 8.09 X 47217
Bi-O-V V0.8 Bi3.2 O6.8 (V0.27 Bi0.73 )3BiO6.8,tP24,113 P-421m 0.7934,0.7934,0.5215,90,90,90 - yellow 8.28 X 44761
Bi-O-V V0.9 Bi8.1 O14 (V0.9 Bi0.1 )Bi8O14,hR207,160 R3m 1.17239,1.17239,2.88612,90,90,120 fluorite family yellowish 8.54 X 29220
Bi-O-V V0.98 Bi11.72 O20 Bi12 SiO20,cI66,197 I23 1.01943,1.01943,1.01943,90,90,90 - orange 8.84 X 56040
Bi-O-V V1.2 Bi3.5 O8.25 *,aP*,* - 0.70914,1.6452,1.6886,96.031,91.33,95.186 - - - N 39198
Bi-O-V V2Bi1.33 O6 *,oP*,* - 0.704,0.755,1.07,90,90,90 - - - N 18282
Bi-O-V V2Bi2O6.4 Ca2Nb2O7,cF88,227 Fd-3m 1.099,1.099,1.099,90,90,90 pyrochlore family - 6.23 A 9385
Bi-O-V V2Bi4O10.5 V2Bi4O10.5 ,oS88,63 Cmcm 1.5351,0.5574,0.5527,90,90,90 - black 7.77 X 36185
Bi-O-V V2Bi4O11 ht1 V2Bi4O11,oS76,63 Cmcm 1.53469,0.56491,1.12331,90,90,90 - - 7.60 X 42228
Bi-O-V V2Bi4O11 rt V2Bi4O11,mS108,5 C121 0.561,1.52699,1.65942,90,90.267,90 - brown red 7.81 X 42228
Bi-O-V V3Bi6O16 rt V3Bi6O16,oP100,62 Pnma 0.54721,1.72542,1.49174,90,90,90 - - 7.84 X 30808
Bi-O-V V4Bi0.85 O8 Ba(Ti0.67 Al0.33 )4O8,tI28,87 I4/m 0.993,0.993,0.2914,90,90,90 - black 5.89 X 29047
Bi-O-V V4Bi50O85 *,mS*,12 C12/m1 2.02518,1.17548,1.18144,90,125.418,90 - - - N 45159
Bi-O-V V6Bi13O34 *,oP53,19 P212121 0.5549,0.5608,3.085,90,90,90 - - - N 20069
Bi-O-V V8Bi46O89 mon V8Bi46O89,mS308,12 C12/m1 2.00294,1.15962,2.11286,90,111.337,90 fluorite family - 8.32 X 57921
Bi-O-V V8Bi46O89 tricl *,aP108,2 P-1 1.1668,2.0023,2.0472,107.13,90.,90. - - - P 32019
Bi-O-W Bi14 [WO4]O20 ht Bi14 [WO4]O20,tI82,87 I4/m 0.87108,0.87108,1.7322,90,90,90 - white 8.83 X 35553
Bi-O-W Bi14 [WO4]O20 rt Bi14 [WO4]O20,mS96,12 C12/m1 1.2292,1.73807,0.86952,90,134.79,90 - - 8.80 X 57310
Bi-O-W Bi14 [WO4]O20 *,oP468,56 Pccn 1.73201,2.6132,1.74206,90,90,90 - - 8.83 N 45548
Bi-O-W Bi2[WO4]3 *,oP51,52 Pnna 0.543,2.372,0.542,90,90,90 - - - N 2955
Bi-O-W WBi1.5O5.25 WBi1.5 O5.25 ,tI18,87 I4/m 0.3839,0.3839,1.6382,90,90,90 - yellow 8.00 X 46813
Bi-O-W WBi2O6 ht1 VBi2 O5.5 ,oS36,41 Aea2 0.54999,1.65504,0.55342,90,90,90 - yellow pale 9.20 X 46160
Bi-O-W WBi2O6 ht2 WBi2O6,mS36,12 C12/m1 1.64403,0.38544,0.83744,90,102.334,90 - yellow 8.94 X 46160
Bi-O-W WBi2O6 rt MoBi2O6,oP36,29 Pca21 0.5436,1.64298,0.54559,90,90,90 russellite yellow pale 9.51 X 24530
Bi-O-W W0.067 Bi0.933 O1.6 CaF2 ,cF12,225 Fm-3m 0.56,0.56,0.56,90,90,90 fluorite family yellow 8.81 X 45548
Bi-O-W W0.60 Bi0.40 O2.4 *,cF*,225 Fm-3m 0.543,0.543,0.543,90,90,90 - - 9.64 N 2955
Bi-O-W W1.085 Bi8.897 O16.6 W1.085 Bi8.897 O16.6 ,tI140,80 I41 1.25576,1.25576,1.1274,90,90,90 - yellow 8.68 X 53838
Bi-O-W W2Bi2O9 rt W2Bi2O9,oP52,33 Pna21 0.544,0.5413,2.374,90,90,90 - white 8.83 X 36030
Bi-O-W W4Bi23O46.5 *,cF*,* - 1.66877,1.66877,1.66877,90,90,90 - - - N 34794
Bi-O-Y YBiO3 hp CaTiO3,cP5,221 Pm-3m 0.5428,0.5428,0.5428,90,90,90 perovskite family - 3.59 X 30952
Bi-O-Y YBiO3 rt (K0.5 [H2O]0.5 )(Ta0.5 ...,cF80,227 Fd-3m 1.155,1.155,1.155,90,90,90 pyrochlore family - 5.96 A 4853
Bi-O-Y Y0.25 Bi3.75 O6 (Y0.06 Bi0.94 )4O6,tP22,137 P42/nmc 0.77451,0.77451,0.56361,90,90,90 fluorite family orange 8.86 X 31321
Bi-O-Y Y0.34 Bi0.66 O1.5 (Y0.27 Bi0.73 )O1.5 ,cF112,225 Fm-3m 0.5465,0.5465,0.5465,90,90,90 fluorite family - 7.82 X 19296
Bi-O-Y Y0.480 Bi0.520 O1.5 *,aP*,* - 0.8504,0.857,1.0015,111.34,93.76,105.87 - - - N 32070
Bi-O-Y Y0.575 Bi0.425 O1.5 *,hP*,* - 2.2865,2.2865,1.9036,90,90,120 - - - N 32350
Bi-O-Y Y0.6 Bi2.4 O4.5 rt (Sr0.78 Bi0.22 )Bi2O4.11 ,hR27,166 R-3m 0.3949,0.3949,2.7261,90,90,120 - yellow pale 8.48 X 54883
Bi-O-Y Y0.625 Bi0.375 O1.5 (La0.67 Bi0.33)O1.5 ,hR9,160 R3m 0.3755,0.3755,0.9515,90,90,120 - - 6.77 A 30615
Bi-O-Y Y1.32 Bi2.68 O6 Gd(Gd0.17 Bi0.83)3O6,cI80,199 I213 1.0968,1.0968,1.0968,90,90,90 - - 7.79 A 32350
Bi-O-Y Y2BiO2 Cu2TlSe 2,tI10,139 I4/mmm 0.38734,0.38734,1.32469,90,90,90 - - 7.00 X 56443
Bi-O-Yb YbBiO3 rt YbBiO3,aP48,2 P-1 0.84195,0.84882,0.99306,111.26,93.99,105.76 - - 9.14 X 45583
Bi-O-Yb Yb0.2 Bi0.8 O1.5 (Y0.1 Nb0.15 Bi0.75)O1.65 ,cF92,225 Fm-3m 0.54927,0.54927,0.54927,90,90,90 fluorite family yellow 9.05 X 59612
Bi-O-Yb Yb0.2 Bi1.8 O3 Bi2O3,tP20,114 P-421c 0.77731,0.77731,0.56013,90,90,90 - - 9.00 X 34833
Bi-O-Yb Yb0.3 Bi0.7 O1.5 ht CaF2 ,cF12,225 Fm-3m 0.54822,0.54822,0.54822,90,90,90 fluorite family - 8.96 X 44367
Bi-O-Yb Yb7Bi17O36 rt Yb7Bi17O36,oP72,47 Pmmm 0.5493,1.0713,1.6245,90,90,90 - - 9.28 X 45583
Bi-O-Zn ZnBi2O6 Ta2FeO6,tP18,136 P42/mnm 0.48386,0.48386,0.97422,90,90,90 - brown dark 8.44 A 33576
Bi-O-Zn Zn0.33 Bi12.67 O20 rt Bi12 SiO20,cI66,197 I23 1.01939,1.01939,1.01939,90,90,90 - yellow 9.37 X 9174
Bi-O-Zr Zr0.075 Bi0.925 O1.504 ht CaF2 ,cF12,225 Fm-3m 0.56277,0.56277,0.56277,90,90,90 fluorite family orange 8.36 X 38994
Bi-O-Zr Zr0.15 Bi1.85 O3.075 rt Zr0.15 Bi1.85 O3.075 ,tP40,137 P42/nmc 0.77206,0.77206,0.5637,90,90,90 fluorite family orange 8.89 X 38994
Bi-Os-Se OsBiSe FeAsS,mP12,14 P121/c1 0.652,0.646,0.657,90,113.8,90 pyrite-marcasite family - 12.54 A 3208
Bi-P-Pd Pd3Bi0.8P 0.2 m BiF3 ,cF16,225 Fm-3m 0.6286,0.6286,0.6286,90,90,90 b.c.c. family - 13.17 X 23068
Bi-P-S BiPS4 BiPS4,oI96,73 Ibca 1.0601,1.1112,1.9661,90,90,90 - gray 4.22 X 8776
Bi-P-Se Bi2P3Se9 mon Sb2P 3Se9,mP56,14 P121/c1 0.95923,0.74745,2.27033,90,113.251,90 - black 5.43 X 31038
Bi-P-Se Bi2P3Se9 tricl Bi2P3Se9,aP56,2 P-1 0.6764,1.22303,1.7866,94.133,90.493,91.163 - black 5.51 X 35766
Bi-Pb-Pd Pd2PbBi rt Pd2PbBi,oS32,36 Cmc21 0.8681,0.715,1.0535,90,90,90 - - 12.78 X 12455
Bi-Pb-Pd Pd3Pb0.2 Bi0.8 rt orth Pd3Bi,oP16,51 Pmma 0.9393,0.5752,0.4954,90,90,90 close-packed structure - 13.10 A 4696
Bi-Pb-Pd Pd3Pb0.2 Bi0.8 rt tet (Tl0.67Pb0.33)Pd3,tI24,139 I4/mmm 0.4036,0.4036,2.4666,90,90,90 close-packed structure - 13.09 A 4696
Bi-Pb-Pd Pd3Pb0.4 Bi0.6 Cu3Au,cP4,221 Pm-3m 0.4044,0.4044,0.4044,90,90,90 close-packed structure - 13.24 X 4696
Bi-Pb-Pd Pd4PbBi3 rt Pd4PbBi3,mS16,8 C1m1 0.7171,0.8677,0.5575,90,108.26,90 - - 12.70 X 12455
Bi-Pb-Pt PtPb0.3Bi1.7 ht Pt(Pb0.15Bi0.85)2,oP12,62 Pnma 0.5833,0.4121,1.2543,90,90,90 - - 13.49 X 13854
Bi-Pb-Pt PtPb0.5Bi0.5 NiAs,hP4,194 P63/mmc 0.43,0.43,0.548,90,90,120 AlB2 family - 15.26 X 1727
Bi-Pb-Pt PtPb0.5Bi1.5 rt FeS2 ,oP6,58 Pnnm 0.5593,0.6785,0.4106,90,90,90 pyrite-marcasite family - 13.05 A 4714
338 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Pb-Pt PtPb0.7 Bi1.3 PtPbBi,mS12,12 C12/m1 1.2752,0.3588,0.8269,90,126.868,90 - - 13.43 X 13318


Bi-Pb-Pt PtPb3Bi PtPb3Bi,tP20,136 P42 /mnm 1.145,1.145,0.4077,90,90,90 - - 12.75 X 11614
Bi-Pb-Pt PtPb3.5 Bi0.5 PtSn4,oS20,68 Ccce 0.664,1.217,0.664,90,90,90 - - 12.69 A 4714
Bi-Pb-S PbBi2S4 PbBi2S4,oP28,62 Pnma 1.15609,0.401,1.42968,90,90,90 galenobismutite gray 7.55 X 49247
Bi-Pb-S PbBi4S7 ht (Pb0.2Bi0.8)5S7,mS26,12 C12/m1 1.3247,0.403,1.2042,90,105.02,90 - - 6.78 X 8661
Bi-Pb-S Pb0.73 Bi0.18 S NaCl,cF8,225 Fm-3m 0.59051,0.59051,0.59051,90,90,90 rocksalt family white 7.13 X 4817
Bi-Pb-S Pb2Bi2S5 rt Pb2Bi2S5,oP72,62 Pnma 2.3913,0.4061,1.9101,90,90,90 cosalite - 7.11 X 1342
Bi-Pb-S Pb2Bi6S11 *,oP*,* - 0.4034,1.3278,3.6768,90,90,90 - - - N 19333
Bi-Pb-S Pb2.325 Bi10.45 S18 Pb2.325 Bi10.45 S18,oS128,63 Cmcm 0.4033,1.3343,6.0022,90,90,90 - white silver6.67 X 12845
Bi-Pb-S Pb3Bi2S6 hp Pb(Pb0.5 Bi0.5 )4S6,oP44,62 Pnma 2.3023,0.40233,1.1026,90,90,90 - - 8.01 X 50452
Bi-Pb-S Pb3Bi2S6 ht Pb(Pb0.5 Bi0.5 )4S6,oS44,63 Cmcm 0.41103,1.354,2.0637,90,90,90 - black 7.12 X 50452
Bi-Pb-S Pb3Bi2S6 rt Pb3Bi2S6,mS44,12 C12/m1 1.3511,0.4085,2.0649,90,92.15,90 xilingolite white silver7.19 X 38508
Bi-Pb-S Pb46Bi54S127 Pb46Bi54S127 ,mP454,11 P121/m1 5.35735,0.409,5.43292,90,93.318,90 cannizzarite - 6.96 X 12076
Bi-Pb-S Pb6Bi2S9 asc Pb3(Pb0.6Bi0.4)5S9,mS68,12 C12/m1 1.3719,0.4132,3.1419,90,90.94,90 aschamalmite gray lead 7.27 X 53060
Bi-Pb-S Pb6Bi2S9 hey (Ag0.65 Bi0.35)2Pb(Pb...,oS68,63 Cmcm 0.41319,1.3719,3.1393,90,90,90 heyrovskyite black 7.28 X 57076
Bi-Pb-S Pb6Bi2S9 hp Pb6Bi2S9,oP136,33 Pna21 2.5302,3.0819,0.4064,90,90,90 heyrovskyite hp - 8.17 X 57076
Bi-Pb-Se PbBiSe2 *,tP*,* - 0.526,0.526,0.384,90,90,90 - - - N 1500
Bi-Pb-Se PbBi2Se4 In3 Te4,hR21,166 R-3m 0.416,0.416,3.92,90,90,120 - - 7.98 A 4254
Bi-Pb-Se Pb0.57 Bi0.285 Se NaCl,cF8,225 Fm-3m 0.602,0.602,0.602,90,90,90 rocksalt family - 7.81 X 2002
Bi-Pb-Se Pb0.9 Bi0.1 Se2 SrS2,tI12,140 I4/mcm 0.64262,0.64262,0.77024,90,90,90 - gray 7.63 X 57337
Bi-Pb-Se Pb2Bi2Se5 Pb2Bi2Se5 ,hP9,164 P-3m1 0.422,0.422,1.642,90,90,120 - - 8.05 X 3731
Bi-Pb-Se Pb5Bi6Se14 *,mP*,11 P121/m1 1.60096,0.42015,2.15689,90,97.537,90 - - - N 44771
Bi-Pb-Te PbBi4Te7 trig3 *,hP48,164 P-3m1 0.444,0.444,10.74,90,90,120 - - - N 2376
Bi-Pb-Te PbBi4Te7 GeBi4Te7,hP12,164 P-3m1 0.4426,0.4426,2.3892,90,90,120 - - 7.93 X 43672
Bi-Pb-Te PbBi6Te10 GeSb6Te10 ,hR51,166 R-3m 0.4406,0.4406,10.254,90,90,120 - - 7.91 X 40091
Bi-Pb-Te PbBi8Te13 *,hR66,166 R-3m 0.4398,0.4398,13.289,90,90,120 - - - N 40091
Bi-Pb-Te Pb0.57 Bi2.29 Te4 In3 Te4,hR21,166 R-3m 0.4451,0.4451,4.1532,90,90,120 - - 7.74 X 6986
Bi-Pb-Te Pb0.75 Bi3Te 5.25 trig1 (Pb0.19 Te0.81)4Bi3Te2,hP9,164 P-3m1 0.45,0.45,1.76,90,90,120 - - 7.81 X 1742
Bi-Pb-Te Pb0.75 Bi3Te 5.25 trig2 (Pb0.375 Te0.625)2Bi3Te4,hP36,164 P-3m1 0.444,0.444,7.17,90,90,120 - - 7.88 X 1757
Bi-Pb-Te Pb2Bi2Te5 Pb2Bi2Se5 ,hP9,164 P-3m1 0.446,0.446,1.75,90,90,120 - - 8.10 X 5542
Bi-Pb-Te Pb2Bi6Te11 *,h*57,* - 0.4426,0.4426,11.27,90,90,120 - - - N 43672
Bi-Pb-Tl Tl0.50 Pb0.35 Bi0.15 Cu,cF4,225 Fm-3m 0.493,0.493,0.493,90,90,90 close-packed structure - 11.42 X 25837
Bi-Pd-Pr PrPdBi MgAgAs,cF12,216 F-43m 0.6797,0.6797,0.6797,90,90,90 - - 9.65 X 40552
Bi-Pd-Pt Pt0.7Pd0.3 Bi NiAs,hP4,194 P63 /mmc 0.43,0.43,0.56,90,90,120 AlB2 family - 13.98 X 1727
Bi-Pd-S Pd3Bi2S2 cub Hg3S2Cl2,cI28,199 I213 0.83097,0.83097,0.83097,90,90,90 - gray 9.28 X 47657
Bi-Pd-S Pd3Bi2S2 mon Ni3Bi2S2,mS28,12 C12/m1 1.1745,0.8312,0.8306,90,134.99,90 - - 9.28 X 16553
Bi-Pd-Sb PdBi0.2 Sb0.8 NiAs,hP4,194 P63 /mmc 0.407,0.407,0.555,90,90,120 AlB2 family - 10.24 X 1727
Bi-Pd-Sc ScPdBi MgAgAs,cF12,216 F-43m 0.6435,0.6435,0.6435,90,90,90 - - 8.98 X 40552
Bi-Pd-Se PdBiSe NiSbS,cP12,198 P213 0.6432,0.6432,0.6432,90,90,90 pyrite-marcasite family - 9.84 A 1975
Bi-Pd-Se Pd3Bi0.6 Se 0.4 m BiF3,cF16,225 Fm-3m 0.6313,0.6313,0.6313,90,90,90 b.c.c. family - 12.57 X 23068
Bi-Pd-Se Pd3Bi2Se2 Ni3Bi2S2,mS28,12 C12/m1 1.1743,0.8431,0.8423,90,133.95,90 - - 9.90 X 55548
Bi-Pd-Sm SmPdBi MgAgAs,cF12,216 F-43m 0.6719,0.6719,0.6719,90,90,90 - - 10.20 X 40552
Bi-Pd-Sr SrPd2Bi2 ht CaBe2Ge2 ,tP10,129 P4/nmm 0.4798,0.4798,1.0543,90,90,90 - - 9.83 A 18318
Bi-Pd-Sr SrPd2Bi2 rt SrPd2Bi2,mP10,11 P121/m1 0.4886,0.4778,1.0679,90,91.8,90 - red copper 9.57 X 47590
Bi-Pd-Tb TbPdBi MgAgAs,cF12,216 F-43m 0.666,0.666,0.666,90,90,90 - - 10.66 X 40552
Bi-Pd-Tb Tb5Pd2Bi Mo5SiB2,tI32,140 I4/mcm 0.782,0.782,1.3585,90,90,90 - - 9.73 A 37652
Bi-Pd-Te PdBi0.3 Te 1.7 CdI2,hP3,164 P-3m1 0.405,0.405,0.5186,90,90,120 merenskyite - 8.70 A 9817
Bi-Pd-Te Pd0.99 Bi0.79 Te1.22 NiSbS,cP12,198 P213 0.6646,0.6646,0.6646,90,90,90 michenerite - 9.64 A 9817
Bi-Pd-Te Pd4.9 Bi1.24 Te0.76 Pd5Sb2,hP42,185 P63 cm 0.7736,0.7736,1.3996,90,90,120 - - 12.05 A 6342
Bi-Pd-Te Pd7.9 Bi2.1 Te Pd8Sb3,hR132,161 R3c 0.7744,0.7744,4.2089,90,90,120 - - 12.83 A 6342
Bi-Pd-Te Pd8Bi1.87 Te 1.13 Pd8Sb3,hR132,161 R3c 0.7768,0.7768,4.2967,90,90,120 - - 12.30 A 6342
Bi-Pd-Tl Tl0.5 Pd3Bi0.5 Cu3Au,cP4,221 Pm-3m 0.4044,0.4044,0.4044,90,90,90 close-packed structure - 13.20 X 5603
Bi-Pd-Tm TmPdBi MgAgAs,cF12,216 F-43m 0.6564,0.6564,0.6564,90,90,90 - - 11.37 X 40552
Bi-Pd-Tm Tm5Pd2Bi Mo5SiB2,tI32,140 I4/mcm 0.7652,0.7652,1.3474,90,90,90 - - 10.66 A 37652
Bi-Pd-Y YPd2Bi Cu2MnAl,cF16,225 Fm-3m 0.6825,0.6825,0.6825,90,90,90 b.c.c. family - 10.67 X 14818
Bi-Pd-Y Y5Pd2Bi Mo5SiB2,tI32,140 I4/mcm 0.7779,0.7779,1.3699,90,90,90 - - 6.94 A 37652
Bi-Pd-Yb YbPdBi MgAgAs,cF12,216 F-43m 0.6592,0.6592,0.6592,90,90,90 - - 11.33 X 36472
Bi-Pr-Pt Pr3Pt3Bi4 Au3 Y3Sb4,cI40,220 I-43d 1.0025,1.0025,1.0025,90,90,90 - - 12.16 A 38029
Bi-Pr-Rh PrRhBi TiNiSi,oP12,62 Pnma 0.7417,0.4728,0.8009,90,90,90 AlB2 family - 10.71 A 40552
Bi-Pr-S PrBiS3 Sb2S3,oP20,62 Pnma 1.12,0.396,1.128,90,90,90 - - 5.92 A 28036
Bi-Pr-S Pr0.2 Bi1.8 S3 Sb2S3,oP20,62 Pnma 1.134,0.416,1.13,90,90,90 - - 6.24 A 33698
Bi-Pr-S Pr1.66 Bi0.34 S3 Cr3C2-b,oP20,62 Pnma 0.746,0.408,1.554,90,90,90 - - 5.63 A 33698
Bi-Pr-S Pr4Bi2S9 La4Bi2S9,oP60,62 Pnma 2.84,0.402,1.274,90,90,90 - - 5.80 A 33698
Bi-Pr-S Pr8.2 Bi1.8 S15 rt Pr10S14O,tI200,142 I41/acd 1.532,1.532,2.02,90,90,90 - - 5.64 A 33698
Bi-Pr-Si Pr5Bi1.7Si1.3 Y2HfS5,oP32,62 Pnma 1.2528,0.9449,0.8248,90,90,90 - - 7.46 A 56869
Bi-Pr-Zn Zn0.49PrBi2 Zn0.5 PrBi2 ,tP10,129 P4/nmm 0.4554,0.4554,0.9745,90,90,90 - - 9.71 X 50569
Bi-Pt-Sb PtBiSb FeS2,cP12,205 Pa-3 0.657,0.657,0.657,90,90,90 geversite/insizwaite - 12.32 A 3417
Bi-Pt-Sb PtBi0.5 Sb0.5 NiAs,hP4,194 P63 /mmc 0.4225,0.4225,0.5485,90,90,120 stumpflite - 14.12 X 1727
Bi-Pt-Se PtBiSe NiSbS,cP12,198 P213 0.642,0.642,0.642,90,90,90 pyrite-marcasite family - 12.13 A 1975
Bi-Pt-Tb TbPtBi MgAgAs,cF12,216 F-43m 0.6662,0.6662,0.6662,90,90,90 - - 12.65 X 40552
Bi-Pt-Tb Tb5Pt2Bi Mo5SiB2,tI32,140 I4/mcm 0.7783,0.7783,1.3599,90,90,90 - - 11.24 A 38900
Bi-Pt-Te PtBiTe NiSbS,cP12,198 P213 0.659,0.659,0.659,90,90,90 pyrite-marcasite family - 12.34 A 1975
Bi-Pt-Tl Tl0.5 Pt3Bi0.5 Cu3Au,cP4,221 Pm-3m 0.404,0.404,0.404,90,90,90 close-packed structure - 19.94 X 5603
Bi-Pt-Tm TmPtBi MgAgAs,cF12,216 F-43m 0.6588,0.6588,0.6588,90,90,90 - - 13.31 X 40552
Bi-Pt-Tm Tm5Pt2Bi Mo5SiB2,tI32,140 I4/mcm 0.7642,0.7642,1.3491,90,90,90 - - 12.17 A 38900
Bi-Pt-Y YPtBi MgAgAs,cF12,216 F-43m 0.664,0.664,0.664,90,90,90 - - 11.19 X 40552
Bi-Pt-Y Y5Pt2Bi Mo5SiB2,tI32,140 I4/mcm 0.7735,0.7735,1.3661,90,90,90 - - 8.48 A 38900
Bi-Pt-Yb YbPtBi MgAgAs,cF12,216 F-43m 0.65953,0.65953,0.65953,90,90,90 - - 13.36 X 29376
Handbook of Inorganic Substances – Edition 2015 : Data 339

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Rb-S RbBiS2 NaFeO2,hR12,166 R-3m 0.4189,0.4189,2.351,90,90,120 rocksalt family - 5.00 X 6698


Bi-Rb-S RbBi3S5 ht CsBi3S5,oP36,62 Pnma 1.1744,0.40519,2.1081,90,90,90 - gray silver 5.78 X 41602
Bi-Rb-S RbBi3S5 rt RbBi3S5,oP36,58 Pnnm 1.2902,1.8478,0.4161,90,90,90 - - 5.84 X 8676
Bi-Rb-Sb Rb11 Bi0.6 Sb5.4 Rb11 (Bi0.15 Sb0.85 )4Sb2,oI34,71 Immm 0.7667,1.0522,1.7327,90,90,90 - black 4.09 X 44113
Bi-Rb-Se RbBiSe 2 *,tI8,107 I4mm 0.392,0.392,1.235,90,90,90 - - - N 6698
Bi-Rb-Se RbBi3Se5 mon1 RbBi3Se5,mP44,11 P121/m1 1.3537,0.41431,2.1545,90,91.297,90 - - 6.09 X 41602
Bi-Rb-Se RbBi3Se5 mon2 RbBi3Se5,mS108,12 C12/m1 3.6779,0.4148,2.5363,90,120.403,90 - black silver 6.61 X 41602
Bi-Rb-Se RbBi3Se5 orth RbBi3Se5,oP36,62 Pnma 2.1956,0.4136,1.2357,90,90,90 - - 6.55 A 46179
Bi-Rb-Se RbBi3Se5 rt RbBi3Se5,oP36,62 Pnma 2.1956,0.4136,1.2357,90,90,90 - black silver 6.55 X 41602
Bi-Rb-Se RbBi4Se7 RbBi4Se7,mS52,12 C12/m1 2.2286,0.4176,1.9794,90,116.89,90 - - 5.96 X 36803
Bi-Rb-Se Rb2Bi4Se7 Rb2Bi4Se7,mP28,11 P121/m1 1.3062,0.42072,1.5301,90,93.137,90 - gray silver 6.17 X 36803
Bi-Rb-Se Rb2Bi8Se13 Rb2Bi8Se13,mP46,11 P121/m1 1.34931,0.41558,2.4876,90,96.571,90 - - 6.88 X 38568
Bi-Rb-Se Rb3BiSe 3 Na3AsS3,cP28,198 P213 1.0144,1.0144,1.0144,90,90,90 - black 4.47 X 33774
Bi-Rh-S RhBiS NiSbS,cP12,198 P213 0.6138,0.6138,0.6138,90,90,90 pyrite-marcasite family - 9.88 A 1975
Bi-Rh-S Rh3Bi2S2 Ni3Bi2S2,mS28,12 C12/m1 1.1277,0.83701,0.82109,90,135.318,90 - - 9.64 X 53464
Bi-Rh-Se RhBiSe NiSbS,cP12,198 P213 0.6283,0.6283,0.6283,90,90,90 pyrite-marcasite family - 10.47 A 1975
Bi-Rh-Se Rh3Bi2Se2 Ni3Bi2S2,mS28,12 C12/m1 1.1414,0.83709,0.82154,90,133.148,90 - - 10.26 A 49317
Bi-Rh-Sm SmRhBi TiNiSi,oP12,62 Pnma 0.728,0.4679,0.7957,90,90,90 AlB2 family - 11.33 X 40552
Bi-Rh-Tb TbRhBi ZrNiAl,hP9,189 P-62m 0.7596,0.7596,0.3938,90,90,120 Fe2P family - 11.92 A 40552
Bi-Rh-Te RhBi0.7 Te1.3 FeS2 ,cP12,205 Pa-3 0.6458,0.6458,0.6458,90,90,90 pyrite-marcasite family - 10.24 A 6345
Bi-Rh-Tm TmRhBi MgAgAs,cF12,216 F-43m 0.6568,0.6568,0.6568,90,90,90 - - 11.27 X 38029
Bi-Rh-U U3Rh3Bi4 Au3 Y3Sb4,cI40,220 I-43d 0.97273,0.97273,0.97273,90,90,90 - - 13.41 X 51260
Bi-Rh-Zr ZrRhBi MgAgAs,cF12,216 F-43m 0.6368,0.6368,0.6368,90,90,90 - - 10.37 X 38029
Bi-S-Sb Bi0.065 Sb1.935 S3 Sb2S3,oP20,62 Pnma 1.13122,0.38428,1.1221,90,90,90 - gray steel 4.70 X 42697
Bi-S-Se Bi2Se 1.5S1.5 Sb2S3,oP20,62 Pnma 1.15,0.405,1.137,90,90,90 bismuthinite - 7.33 A 339
Bi-S-Se Bi2Se 2S Sb2S3,oP20,62 Pnma 1.172,0.408,1.149,90,90,90 guanajuatite - 7.35 A 21106
Bi-S-Se Bi4Se 0.24S2.76 Bi4Se3,hR21,166 R-3m 0.415,0.415,3.919,90,90,120 laitakarite gray 8.04 X 1124
Bi-S-Sm SmBiS3 Sb2S3,oP20,62 Pnma 1.077,0.385,1.115,90,90,90 - - 6.55 A 22824
Bi-S-Sm Sm0.4 Bi1.6 S2.8 Sb2S3,oP20,62 Pnma 1.42,0.47,1.261,90,90,90 - - 3.82 A 22824
Bi-S-Sm Sm0.67 Bi1.33 S2.67 Sb2S3,oP20,62 Pnma 1.411,0.412,1.255,90,90,90 - - 4.23 A 22824
Bi-S-Sn SnBi2S4 rt *,hP*,173 P63 1.35,1.35,0.4,90,90,120 - - - N 17980
Bi-S-Sn Sn0.22 Bi1.78 S2.88 Sb2S3,oP20,62 Pnma 1.123,0.398,1.135,90,90,90 - - 6.42 A 5970
Bi-S-Sn Sn0.86 Bi0.09 S rt GeS,oP8,62 Pnma 1.123,0.398,0.436,90,90,90 - - 5.21 A 5970
Bi-S-Sr SrBi2S4 Ba1.1 Bi2S4,hP86,176 P63/m 2.4925,2.4925,0.40954,90,90,120 - - 5.73 A 15790
Bi-S-Ta Ta3Bi2S6 Nb3Bi2S6,hP22,193 P63/mcm 0.5698,0.5698,1.743,90,90,120 - - 7.81 X 13610
Bi-S-Tb Tb0.8 Bi1.2S3 Sb2S3,oP20,62 Pnma 1.1091,0.3973,1.122,90,90,90 - - 6.37 A 22821
Bi-S-Tb Tb1.4 Bi0.6S3 Sb2S3,oP20,62 Pnma 1.0529,0.3906,1.0702,90,90,90 - - 6.70 A 22821
Bi-S-Te BiTe 0.55 S0.45 BiSe,hP12,164 P-3m1 0.4246,0.4246,2.326,90,90,120 ingodite - 8.05 X 24476
Bi-S-Te Bi14 Te15S6 *,h**,* - 0.4255,0.4255,2.959,90,90,120 - - - N 8884
Bi-S-Te Bi2Te 1.58 S1.42 Bi2Te1.6 S1.4,hR21,166 R-3m 0.41968,0.41968,2.9467,90,90,120 tetradymite γ - 7.37 X 57759
Bi-S-Te Bi2Te 1.6 S1.4 Bi2Te2S,hR15,166 R-3m 0.4196,0.4196,2.944,90,90,120 tetradymite β - 7.40 X 59242
Bi-S-Te Bi2Te 2.88 S0.12 Bi2Te3,hR15,166 R-3m 0.4379,0.4379,3.046,90,90,120 - - 7.77 A 3427
Bi-S-Te Bi3.5 Te1.5 S2 *,h**,* - 0.4258,0.4258,3.954,90,90,120 - - - N 24476
Bi-S-Te Bi4.1 Te1.0 S1.9 *,hR*,166 R-3m 0.42415,0.42415,3.9769,90,90,120 joséite-A - - N 24476
Bi-S-Te Bi5.5 Te1.9 S1.6 *,hP*,164 P-3m1 0.43386,0.43386,5.7804,90,90,120 proto-joséite - - N 24476
Bi-S-Ti TiBi0.10 S2 *,hP*,164 P-3m1 0.3412,0.3412,0.5712,90,90,120 - - - N 47202
Bi-S-Ti TiBi0.25 S2 *,hP*,* - 0.34156,0.34156,1.1466,90,90,120 - - - N 47202
Bi-S-Tl TlBiS2 NaFeO2,hR12,166 R-3m 0.41041,0.41041,2.1872,90,90,120 rocksalt family black 7.46 X 45975
Bi-S-Tl Tl0.5 Bi0.5 S tf NaCl,cF8,225 Fm-3m 0.59,0.59,0.59,90,90,90 rocksalt family - 7.72 X 6987
Bi-S-Tl Tl4Bi2S5 Tl4Bi2S5,oP44,62 Pnma 1.676,0.409,1.7396,90,90,90 - black 7.77 X 12072
Bi-S-Yb YbBi2S4 PbBi2S4,oP28,62 Pnma 1.247,0.405,1.4,90,90,90 - - 6.76 A 18997
Bi-Sb-Se Bi1.5 Sb1.5 Se3 Sb2S3,oP20,62 Pnma 1.1471,0.4012,1.1632,90,90,90 - - 9.09 A 4063
Bi-Sb-Se Bi1.74 Sb0.26 Se3 Bi2Te3,hR15,166 R-3m 0.412,0.412,2.862,90,90,120 - - 7.49 A 4063
Bi-Sb-Tb Tb4BiSb2 Th3P 4,cI28,220 I-43d 0.9186,0.9186,0.9186,90,90,90 - - 9.32 X 52492
Bi-Sb-Te BiSbTe 3 Bi2Te3,hR15,166 R-3m 0.433,0.433,3.04,90,90,120 - - 7.20 X 5288
Bi-Sb-Te Bi0.5 Sb0.5 Te BiSe,hP12,164 P-3m1 0.433,0.433,2.395,90,90,120 - - 7.51 X 5288
Bi-Sb-Te Bi2Sb2Te3 Bi4Se3,hR21,166 R-3m 0.434,0.434,4.172,90,90,120 - - 7.64 X 5288
Bi-Sb-Ti Ti2.08 Bi0.46Sb0.46 Ti2Bi,tI12,139 I4/mmm 0.404,0.404,1.45,90,90,90 - - 7.07 A 993
Bi-Sb-U UBiSb PbClF,tP6,129 P4/nmm 0.428,0.428,0.872,90,90,90 - - 11.83 A 23407
Bi-Sb-Zn Zn6.74Bi0.13 Sb4.87 *,hR*,167 R-3c 1.2241,1.2241,1.2451,90,90,120 - - 6.54 N 49027
Bi-Sc-Te Sc6Bi1.682Te0.797 K2UF6,hP9,189 P-62m 0.76821,0.76821,0.40815,90,90,120 Fe2P family - 5.76 X 42989
Bi-Se-Sm SmBiSe 3 Sb2S3,oP20,62 Pnma 1.184,0.41,1.171,90,90,90 - - 6.97 A 28068
Bi-Se-Sm SmBi2Se4 FeSb2S4,oP28,62 Pnma 1.159,0.412,1.418,90,90,90 - - 8.67 A 28068
Bi-Se-Sm SmBi4Se7 ht *,oP24,62 Pnma 1.424,0.413,1.195,90,90,90 - - - N 28068
Bi-Se-Sm Sm0.4 Bi1.6 Se3 Bi2Te3,hR15,166 R-3m 0.4108,0.4108,2.862,90,90,120 - black 7.52 A 57440
Bi-Se-Sn SnBi4Se5 *,hP*,* - 0.4223,0.4223,5.67,90,90,120 - - - N 19525
Bi-Se-Sn Sn0.08 Bi1.92 Se2.96 Bi2Te3,hR15,166 R-3m 0.418,0.418,2.88,90,90,120 - - 7.37 A 11554
Bi-Se-Sn Sn0.57 Bi2.29 Se4 GeAs2Te4,hR21,166 R-3m 0.41602,0.41602,3.8934,90,90,120 - - 7.36 X 35732
Bi-Se-Sn Sn0.571 Bi0.286 Se ht NaCl,cF8,225 Fm-3m 0.59478,0.59478,0.59478,90,90,90 rocksalt family - 6.52 X 35242
Bi-Se-Sn Sn0.889 Bi0.074 Se rt GeS,oP8,62 Pnma 1.1524,0.4153,0.4464,90,90,90 - - 6.22 A 50579
Bi-Se-Sn Sn0.92 Bi0.1 Se2 CdI2 ,hP3,164 P-3m1 0.3831,0.3831,0.617,90,90,120 CdI2-PbI2 polytype - 6.10 A 11554
Bi-Se-Sn Sn3Bi2Se6 Sn(Sn0.5 Bi0.5 )4Se6,oP44,62 Pnma 2.1213,0.4162,1.364,90,90,90 - - 6.88 X 55043
Bi-Se-Sn Sn6Bi2Se9 (Ag0.65 Bi0.35)2Pb(Pb...,oS68,63 Cmcm 0.4206,1.3903,3.212,90,90,90 - - 6.51 X 54978
Bi-Se-Sr SrBiSe 3 SrBiSe 3,oP80,19 P212121 0.42609,1.5755,3.3552,90,90,90 - - 6.29 X 15550
Bi-Se-Sr SrBi2Se4 Ba1.1 Bi2S4,hP86,176 P63/m 2.597,2.597,0.42437,90,90,120 - black 6.60 X 39077
Bi-Se-Sr Sr4Bi6Se13 Sr4Bi6Se13,mP46,11 P121/m1 1.7037,0.4241,1.8398,90,90.58,90 - black 6.57 X 18501
Bi-Se-Tb Tb0.5 Bi1.5Se3 Bi2Te3,hR15,166 R-3m 0.4121,0.4121,2.852,90,90,120 - black 7.48 A 57440
Bi-Se-Te Bi2TeSe 2 m *,cP*,* - 0.875,0.875,0.875,90,90,90 - - - N 17175
340 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Bi-Se-Te Bi2TeSe2 rt Bi2Te2S,hR15,166 R-3m 0.4183,0.4183,2.9137,90,90,120 kawazulite/skippenite gray steel 7.94 X 42755
Bi-Se-Tl TlBiSe2 NaFeO2,hR12,166 R-3m 0.424,0.424,2.233,90,90,120 rocksalt family - 8.19 X 2007
Bi-Se-Tl Tl0.5 Bi0.5 Se m NaCl,cF8,225 Fm-3m 0.618,0.618,0.618,90,90,90 rocksalt family - 8.04 X 17032
Bi-Se-Tl Tl4.5 Bi0.5 Se 3 rt Tl4PbTe3,tI32,140 I4/mcm 0.849,0.849,1.2693,90,90,90 - - 9.16 X 21184
Bi-Se-Tm TmBiSe3 Sb2S3,oP20,62 Pnma 1.171,0.404,1.162,90,90,90 - - 7.43 A 39685
Bi-Se-Zn Zn0.04 Bi1.96 Se3 Bi2Te3,hR15,166 R-3m 0.411,0.411,2.88,90,90,120 - - 7.68 A 16466
Bi-Si-Tb Tb5Bi1.8 Si1.2 Y2HfS5,oP32,62 Pnma 1.1981,0.9126,0.7998,90,90,90 - - 9.15 A 56869
Bi-Sm-Te SmBiTe3 Bi2Te3,hR15,166 R-3m 0.422,0.422,3.291,90,90,120 - - 7.28 A 12377
Bi-Sm-Te SmBi2Te4 Th3P 4,cI28,220 I-43d 1.057,1.057,1.057,90,90,90 - - 6.07 A 21730
Bi-Sm-Te Sm0.57 Bi2.29 Te4 Th3P 4,cI28,220 I-43d 1.081,1.081,1.081,90,90,90 - - 5.65 A 21730
Bi-Sm-Te Sm4Bi2Te Th3P 4,cI28,220 I-43d 0.9899,0.9899,0.9899,90,90,90 - - 7.86 A 12608
Bi-Sn-Sr Sr3Sn3.36 Bi1.64 Tl4PbTe3,tI32,140 I4/mcm 0.8968,0.8968,1.2859,90,90,90 - gray dark 6.45 X 49581
Bi-Sn-Te SnBi2Te4 In3 Te4,hR21,166 R-3m 0.44037,0.44037,4.16042,90,90,120 - - 7.47 X 59488
Bi-Sn-Te SnBi4Te7 GeBi4Te7,hP12,164 P-3m1 0.4402,0.4402,2.4066,90,90,120 - - 7.60 X 59488
Bi-Sn-Te SnBi6Te10 GeSb6Te10 ,hR51,166 R-3m 0.43835,0.43835,10.242,90,90,120 - - 7.74 A 59488
Bi-Sn-Te Sn0.25 Bi0.75 Te BiSe,hP12,164 P-3m1 0.4395,0.4395,2.436,90,90,120 - - 7.68 A 9019
Bi-Sn-Te Sn0.984 Bi0.004 Te rt NaCl,cF8,225 Fm-3m 0.632,0.632,0.632,90,90,90 rocksalt family - 6.45 X 16059
Bi-Sn-Yb Yb11Sn2Bi8 Sc11Al2Ge8,tI84,139 I4/mmm 1.2108,1.2108,1.7516,90,90,90 - black gray 9.86 X 59546
Bi-Sr-Zn SrZnBi2 SrZnBi2,tI16,139 I4/mmm 0.464,0.464,2.196,90,90,90 - gray 8.02 X 10251
Bi-Sr-Zn SrZn0.5 Bi BeZrSi,hP6,194 P63 /mmc 0.4728,0.4728,0.8546,90,90,120 AlB2 family - 6.61 X 57420
Bi-Tb-Te TbBiTe3 Bi2Te3,hR15,166 R-3m 0.43,0.43,3.16,90,90,120 - - 7.39 A 12377
Bi-Tb-Te Tb3Bi4Te9 *,o**,* - 0.4147,1.7622,2.477,90,90,90 - - - N 18457
Bi-Te-Th ThBiTe PbClF,tP6,129 P4/nmm 0.4468,0.4468,0.9174,90,90,90 - - 10.31 A 4101
Bi-Te-Tl TlBiTe2 rt NaFeO2,hR12,166 R-3m 0.45267,0.45267,2.31176,90,90,120 rocksalt family - 8.12 X 1372
Bi-Te-Tl TlBiTe3 rt *,hR*,* - 0.452,0.452,5.757,90,90,120 - - - N 1882
Bi-Te-Tl TlBi2Te3 rt *,hR*,* - 0.454,0.454,1.143,90,90,120 - - - N 1991
Bi-Te-Tl Tl4.5 Bi0.5 Te 3 Tl4PbTe3,tI32,140 I4/mcm 0.8855,0.8855,1.3048,90,90,90 - gray 9.13 X 29666
Bi-Te-Tm TmBiTe3 Bi2Te3,hR15,166 R-3m 0.42,0.42,3.111,90,90,120 - - 7.97 A 12377
Bi-Te-Tm TmBi2 Te4 *,cP*,* - 0.946,0.946,0.946,90,90,90 - - - N 32319
Bi-Te-Tm TmBi4 Te7 *,cP*,* - 0.994,0.994,0.994,90,90,90 - - - N 32319
Bi-Te-U UBiTe PbClF,tP6,129 P4/nmm 0.4434,0.4434,0.9157,90,90,90 - - 10.60 A 4101
Bi-Te-Y YBiTe3 Bi2Te3,hR15,166 R-3m 0.446,0.446,3.165,90,90,120 - - 6.22 A 12377
Bi-Te-Yb YbBi2 Te4 rt Th3P 4,cI28,220 I-43d 1.048,1.048,1.048,90,90,90 - - 6.36 A 18997
Bi-Te-Yb Yb0.57 Bi2.29 Te4 Th3P 4,cI28,220 I-43d 1.062,1.062,1.062,90,90,90 - - 6.03 A 18997
Bi-Te-Yb Yb4Bi2Te Th3P 4,cI28,220 I-43d 0.9571,0.9571,0.9571,90,90,90 - - 9.38 A 12608
Bi-Te-Zn Zn0.04 Bi1.96 Te3 Bi2Te3,hR15,166 R-3m 0.437,0.437,3.057,90,90,120 - - 7.83 A 16466
Bi-Ti-Zn Zn1.14 Ti4.44 Bi3.04 CuHf5Sn3,hP18,193 P63 /mcm 0.8135,0.8135,0.5677,90,90,120 AlB2 family - 9.42 X 39505
Bi-Yb-Zn Zn4.03 Yb9Bi9 Zn4.23 Yb9Sb9,oP48,55 Pbam 1.25243,2.1997,0.46283,90,90,90 - black 9.64 X 48508
Bk-Cf-O Bk0.76 Cf0.24 O2 CaF2,cF12,225 Fm-3m 0.5327,0.5327,0.5327,90,90,90 fluorite family - 12.30 X 13376
Bk-O-S Bk2SO2 Ce2SO2,hP5,164 P-3m1 0.3861,0.3861,0.6686,90,90,120 - - 10.74 A 10776
Bk-O-S Bk2[SO4]O2 *,oI18,71 Immm 0.4083,0.4195,1.311,90,90,90 - - - N 10776
Br-C-Ce Ce2C2Br La2C2Cl,mS20,15 C12/c1 1.512,0.4179,0.6743,90,101.09,90 - - 6.10 A 57382
Br-C-Ce Ce3C2Br3 La3C2Br3,oS128,20 C222 1 1.1412,1.6933,1.6941,90,90,90 - - 5.55 A 39490
Br-C-Ce Ce4CBr5 Ce4CBr5,mS24,12 C12/m1 1.8306,0.3974,0.8378,90,104.91,90 - golden 5.48 X 51555
Br-C-Ce Ce4C1.5 Br5 La4C1.5 I5,mS28,12 C12/m1 1.8996,0.3931,0.8282,90,106.74,90 - gray silver 5.48 X 51555
Br-C-Ce Ce4C2Br5 La4C2Br5,oI22,71 Immm 0.3997,0.8198,1.7993,90,90,90 - violet 5.54 X 51556
Br-C-Ce Ce4C4Br3 Ce4C4Br3,aP22,2 P-1 0.4227,1.1034,1.1268,102.85,90.13,95.58 - golden 5.53 X 38228
Br-C-Ce Ce5C2Br9 La5C2Br9,oP64,62 Pnma 1.1215,0.98543,1.6395,90,90,90 - red 5.29 X 31572
Br-C-Ce Ce5C6Br3 La5C6Br3,mS56,12 C12/m1 2.2483,0.39253,1.6375,90,123.15,90 - bronze 5.56 X 53425
Br-C-Cl CBrCl3 lt1 CBr4,cF516,225 Fm-3m 0.8507,0.8507,0.8507,90,90,90 - - 2.14 A 44476
Br-C-Cl CBrCl3 lt2 *,hR*,* - 2.06012,2.06012,2.56021,90,90,120 - - - N 44476
Br-C-Cl CBrCl3 lt3 CBr4,mS160,15 C12/c1 2.062,1.1613,2.0195,90,111.223,90 - - 2.34 A 44476
Br-C-Cl [C60]Br0.85 Cl5.15 [C60]Br0.85 Cl5.15,oP1104,61 Pbca 1.7226,4.00522,1.96088,90,90,90 fullerene family orange 1.91 X 52055
Br-C-Cl [C60]Cl24[Br2]2 [C60]Br24[Br2]2,aP88,2 P-1 1.22,1.2484,1.2591,60.433,62.908,84.406 fullerene family orange 2.14 X 44424
Br-C-Cl [C60]Cl30[Br2]1.5 [C60]Cl30[Br2]1.5 ,aP186,2 P-1 1.3023,1.3226,2.0523,87.692,73.942,62.424 fullerene family - 2.24 X 44169
Br-C-Cl [C60]3Br1.18 Cl16 [C60]3Br1.18 Cl16,oS1808,64 Cmce 1.97711,3.38821,2.98685,90,90,90 fullerene family red 1.87 X 52055
Br-C-Cl [C70]Br1.6 Cl8.4 [C70]Br10,mP320,14 P121/c1 1.8254,1.20702,1.9563,90,98.85,90 fullerene family orange 1.98 X 50240
Br-C-Cl [C70]Cl16[Br2]0.5 [C70]Cl16[Br2]0.5 ,hP550,176 P63 /m 2.1631,2.1631,1.9019,90,90,120 fullerene family yellow 1.92 X 44168
Br-C-Cl [C70]Cl16[Br2]3 [C70]Cl16[Br2]3,oS420,40 Ama2 1.8743,2.4595,1.3117,90,90,90 fullerene family - 2.07 X 44168
Br-C-Cl [C70]Cl28[Br2]1.76 [C70]Cl28[Br2]1.76 ,mP250,13 P12/c1 1.3003,1.7362,1.76186,90,123.65,90 fullerene family - 2.12 X 44442
Br-C-Dy Dy5C2Br9 Gd5C2Cl9,mP64,14 P121/c1 0.97399,1.63398,1.32469,90,120.869,90 - - 5.71 X 49872
Br-C-Er Er5C2Br9 Gd5C2Cl9,mP64,14 P121/c1 0.9718,1.6234,1.32348,90,121.436,90 - black 5.89 X 29518
Br-C-F C12BrF9 C12BrF9,oP176,61 Pbca 0.8029,1.261,2.3565,90,90,90 - colorless 2.20 X 18803
Br-C-F C12Br2F8 C12Br2F8,mP88,14 P121/c1 1.229,0.82,1.2905,90,102.64,90 - - 2.39 X 12960
Br-C-F C18BrF13 orth C18BrF13,oP128,62 Pnma 2.1164,1.514,0.5632,90,90,90 - colorless 2.00 X 13063
Br-C-F C18BrF13 tricl C18BrF13,aP64,2 P-1 0.729,1.0547,1.17691,82.009,85.794,78. - colorless 2.06 X 15880
Br-C-F C2Br2F4 C2Br2F4,mP16,14 P121/c1 0.5963,0.6252,0.8656,90,114.64,90 - - 2.94 X 20945
Br-C-F [CBr3]F lt CBr3F,oP20,62 Pnma 0.88671,0.97582,0.62196,90,90,90 - - 3.34 X 26939
Br-C-F [C6Br5]F rt *,mP24,14 P121/c1 0.864,0.399,1.655,90,117.,90 - - - N 3734
Br-C-Gd GdCBr mon1 GdCBr-a,mS12,12 C12/m1 0.7025,0.38361,0.9868,90,94.47,90 - golden 6.24 X 18733
Br-C-Gd GdCBr mon2 GdCBr-b,mS12,12 C12/m1 0.7066,0.3827,0.9967,90,99.95,90 - golden 6.23 X 26793
Br-C-Gd Gd2CBr Cr2AlC,hP8,194 P63 /mmc 0.37858,0.37858,1.4209,90,90,120 - gray dark 7.65 X 23606
Br-C-Gd Gd2CBr2 *,hP4,164 P-3m1 0.38209,0.38209,0.9824,90,90,120 - black - P 18733
Br-C-Gd Gd4C2Br3 Gd4C2Cl3,oP36,62 Pnma 1.0844,0.373,2.0361,90,90,90 - bronze 7.20 X 31047
Br-C-La LaCBr GdCBr-a,mS12,12 C12/m1 0.74609,0.40493,1.00116,90,94.163,90 - brownish 5.08 X 36086
Br-C-La La2C2Br La2C2Cl,mS20,15 C12/c1 1.5313,0.4193,0.6842,90,100.53,90 - - 5.87 A 57382
Br-C-La La3CBr5 La3CBr5,mS72,15 C12/c1 1.4234,1.0858,1.4588,90,106.8,90 - yellow 5.10 X 49739
Br-C-La La3C2Br3 La3C2Br3,oS128,20 C222 1 1.1533,1.70698,1.7054,90,90,90 - bronze 5.38 X 39490
Handbook of Inorganic Substances – Edition 2015 : Data 341

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-C-La La4C2Br5 La4C2Br5,oI22,71 Immm 0.3995,0.8277,1.8101,90,90,90 - black 5.43 X 51556


Br-C-La La5C2Br9 La5C2Br9,oP64,62 Pnma 1.1309,0.99477,1.64911,90,90,90 - red 5.15 X 31572
Br-C-La La5C6Br3 La5C6Br3,mS56,12 C12/m1 2.2809,0.39855,1.6599,90,123.32,90 - bronze 5.30 X 53425
Br-C-Lu Lu2CBr2 Ta2CS2,hR15,166 R-3m 0.36663,0.36663,2.8799,90,90,120 - golden 7.75 A 31015
Br-C-N C2Br[CN] C2[CN]Cl,mP10,11 P121/m1 0.516,0.635,0.628,90,94.4,90 - - 2.10 X 3881
Br-C-N [BrCN] [ClCN],oP6,59 Pmmn 0.412,0.602,0.58,90,90,90 - - 2.45 X 687
Br-C-N [CC3N3]Br [CC3 N3]Br,oP64,61 Pbca 0.609,1.149,1.762,90,90,90 - white 1.83 X 6494
Br-C-O C3Br2O C3Cl2O,mP24,14 P121/c1 0.9027,0.6173,0.8624,90,105.8,90 - - 3.04 X 1471
Br-C-Pr Pr10 C4Br15 Pr10C4Br15,aP29,2 P-1 0.9098,1.0127,1.0965,70.38,66.31,70.84 - gray silver 5.19 X 53612
Br-C-Pr Pr2CBr Cr2AlC,hP8,194 P63/mmc 0.38071,0.38071,1.47787,90,90,120 - black 6.69 X 53594
Br-C-Pr Pr2C2Br La2C2Cl,mS20,15 C12/c1 1.5054,0.4139,0.6713,90,101.08,90 - - 6.24 A 57382
Br-C-Pr Pr3CBr3 Ca3PI3,cI56,214 I4132 1.161,1.161,1.161,90,90,90 - - 5.73 A 39490
Br-C-Pr Pr3CBr5 La3CI5,aP18,2 P-1 0.7571,0.9004,0.9062,108.57,97.77,106.28 - black 5.09 X 53612
Br-C-Pr Pr4C1.3Br5 La4C1.5 I5,mS28,12 C12/m1 1.8476,0.3911,0.8258,90,105.25,90 - black 5.65 X 51555
Br-C-Pr Pr5C2Br8 Pr5C2Br8,aP60,2 P-1 0.9096,1.2185,1.6688,79.57,89.86,84.38 - black 5.02 X 51522
Br-C-Pr Pr5C2Br9 Pr5C2Br9,mP64,14 P121/c1 1.0069,1.8861,1.20513,90,124.434,90 - red dark 5.09 X 31044
Br-C-Pr Pr5C6Br3 La5C6Br3,mS56,12 C12/m1 2.236,0.3895,1.6269,90,123.44,90 - - 5.71 A 53425
Br-C-Pr Pr7C3Br10 La7C3I10,aP40,2 P-1 0.9054,1.11265,1.3352,79.641,72.57,64.67 - black 5.22 X 53612
Br-C-S C4SBr4 mon C4SBr4,mP18,7 P1c1 0.8816,0.4004,1.25785,90,111.915,90 - - 3.22 X 48092
Br-C-S C4SBr4 orth1 C4SBr4,oP36,29 Pca21 1.25599,0.39973,1.63267,90,90,90 - - 3.24 X 48092
Br-C-S C4SBr4 orth2 C4SBr4,oP72,29 Pca21 1.26511,0.40371,1.63449,90,90,90 - - 3.18 X 48092
Br-C-Sc Sc7CBr12 Sc7CI12,hR60,146 R3 1.3628,1.3628,0.9203,90,90,120 - - 4.33 X 18959
Br-C-Se SeC4Br4 SeC4Br4,mP36,14 P121/c1 1.48645,0.4079,1.39043,90,96.35,90 - - 3.54 X 48092
Br-C-Se Se4CBr2 rt Se4CBr2,oP28,33 Pna21 2.1169,0.4176,0.8496,90,90,90 - brown 4.31 X 16786
Br-C-Tb TbCBr GdCBr-b,mS12,12 C12/m1 0.7015,0.3801,0.9948,90,100.05,90 - - 6.38 A 26793
Br-C-Tb Tb2CBr Cr2AlC,hP8,194 P63/mmc 0.36915,0.36915,1.4043,90,90,120 - - 8.21 A 26858
Br-C-Tb Tb4C2Br3 Gd4C2Cl3,oP36,62 Pnma 1.0743,0.3706,2.0194,90,90,90 - bronze 7.43 A 31047
Br-C-Tb Tb5C2Br9 Gd5C2Cl9,mP64,14 P121/c1 0.97562,1.64254,1.33043,90,120.675,90 - red dark 5.57 X 41053
Br-C-Th Th6CBr14 Zr6CI14,oS84,64 Cmce 1.5764,1.416,1.3124,90,90,90 - green 5.72 X 25535
Br-C-Ti Ti[C60]Br12[Br2] Ti[C60]Br12[Br2],oP316,54 Pcca 1.96802,1.1264,2.09761,90,90,90 fullerene family brown 2.70 X 46295
Br-C-Y YCBr GdCBr-b,mS12,12 C12/m1 0.6953,0.3764,0.9938,90,99.98,90 - bronze 4.69 X 32386
Br-C-Y Y2CBr2 rt Ta2CS2,hR15,166 R-3m 0.37545,0.37545,2.9125,90,90,120 - bronze 4.90 A 31015
Br-C-Y Y2C0.7 Br2 ht Ta2CS2,hP5,164 P-3m1 0.373,0.373,0.9864,90,90,120 - gray silver 4.83 X 31015
Br-C-Zr Zr6CBr14 *,oS*,64 Cmce 1.469,1.3229,1.1991,90,90,90 - - - N 22583
Br-Ca-Cs CsCaBr3 CaTiO3,cP5,221 Pm-3m 0.569,0.569,0.569,90,90,90 perovskite family - 3.72 X 15673
Br-Ca-Cs Cs2CaBr4 K2NiF4,tI14,139 I4/mmm 0.567,0.567,1.801,90,90,90 high-Tc family - 3.59 A 15673
Br-Ca-Cs Cs3Ca2Br7 *,tI24,139 I4/mmm 0.569,0.569,2.928,90,90,90 - - - N 15673
Br-Ca-Cs Cs4Ca3Br10 *,tI34,139 I4/mmm 0.568,0.568,4.052,90,90,90 - - - N 15673
Br-Ca-F CaBrF PbClF,tP6,129 P4/nmm 0.3883,0.3883,0.8051,90,90,90 - - 3.80 A 9976
Br-Ca-H CaBrH PbClF,tP6,129 P4/nmm 0.3858,0.3858,0.7911,90,90,90 - colorless 3.41 X 820
Br-Ca-H Ca2BrH3 Li3LaSb2,hP6,164 P-3m1 0.39137,0.39137,0.69704,90,90,120 - red 2.93 X 55600
Br-Ca-In CaInBr3 Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.42549,1.40781,1.08924,90,90,90 - - 4.02 X 31512
Br-Ca-K KCaBr3 ht GdFeO3,oP20,62 Pnma 0.79865,1.0995,0.75885,90,90,90 perovskite family - 3.18 A 32489
Br-Ca-K KCaBr3 rt *,oS20,63 Cmcm 0.427,1.407,1.076,90,90,90 - - - N 15673
Br-Ca-N Ca2BrN NaFeO2,hR12,166 R-3m 0.37166,0.37166,2.0558,90,90,120 rocksalt family yellow pale 3.53 X 20784
Br-Ca-Na NaCaBr3 ht TiFeO3,hR30,148 R-3 0.736,0.736,1.997,90,90,120 - - 3.22 A 15673
Br-Ca-Na Na0.6 Ca0.2 Br NaCl,cF8,225 Fm-3m 0.499,0.499,0.499,90,90,90 rocksalt family - 5.44 X 15673
Br-Ca-Na Na6CaBr8 rt *,cF60,225 Fm-3m 1.201,1.201,1.201,90,90,90 - - - N 15673
Br-Ca-O Ca[BrO3]2 rt *,o**,* - 0.6623,0.7178,1.1284,90,90,90 - - - N 26784
Br-Ca-Rb RbCaBr3 ht1 *,tP10,127 P4/mbm 0.795,0.795,0.566,90,90,90 - - - N 15673
Br-Ca-Rb RbCaBr3 ht2 CaTiO3,cP5,221 Pm-3m 0.569,0.569,0.569,90,90,90 perovskite family - 3.29 X 15673
Br-Ca-Rb RbCaBr3 rt GdFeO3,oP20,62 Pnma 0.807,1.128,0.783,90,90,90 perovskite family - 3.40 A 15673
Br-Ca-Rb Rb4CaBr6 rt K4CdCl6,hR66,167 R-3c 1.32,1.32,1.64,90,90,120 - - 3.47 A 15673
Br-Ca-Tc CaTcBr6 *,oP16,59 Pmmn 0.734,1.039,0.745,90,90,90 - - - N 20671
Br-Ca-Th CaThBr6 BaThBr6,oP16,51 Pmma 0.9764,0.4169,1.2104,90,90,90 - - 5.07 X 31057
Br-Ca-Tl CaTlBr3 UFeS3,oS20,63 Cmcm 0.42591,1.40606,1.08627,90,90,90 - - 4.94 A 32489
Br-Ca-W CaW6Br14 HgMo 6Cl14,cP84,201 Pn-3 1.347,1.347,1.347,90,90,90 Chevrel phase - 6.15 A 29929
Br-Cd-Cs CsCdBr3 BaNiO3,hP10,194 P63/mmc 0.7675,0.7675,0.6722,90,90,120 perovskite family colorless 4.70 X 13420
Br-Cd-Cs Cs2CdBr4 lt1 K2[SO4],oP28,62 Pnma 1.0205,0.7887,1.3925,90,90,90 - - 4.14 X 22156
Br-Cd-Cs Cs2CdBr4 lt2 Cs2CdBr4,mP28,14 P121/c1 1.0201,0.7856,1.72811,90,126.178,90 - - 4.15 X 16905
Br-Cd-Cs Cs2CdBr4 lt3 *,aP28,2 P-1 0.7788,1.02,1.3898,90.,90.,90. - - - N 16905
Br-Cd-Cs Cs2CdBr4 lt4 K2[SO4],oP28,62 Pnma 1.0235,0.7946,1.3977,90,90,90 - - 4.08 X 12594
Br-Cd-Cs Cs3CdBr5 Cs3CoCl5,tI36,140 I4/mcm 0.9563,0.9563,1.58619,90,90,90 - colorless 4.17 X 26704
Br-Cd-Cs Cs7Cd3Br13 Cs7Cd3Br13,tI92,120 I-4c2 1.8003,1.8003,1.1203,90,90,90 - white 4.22 X 26315
Br-Cd-I CdIBr dis PbI2 ,hR18,166 R-3m 0.41091,0.41091,3.97478,90,90,120 CdI2-PbI2 polytype - 5.47 X 232
Br-Cd-I CdIBr ord CdIBr,hR18,160 R3m 0.41091,0.41091,3.97478,90,90,120 - - 5.47 X 232
Br-Cd-In CdInBr3 [NH4]CdCl3,oP20,62 Pnma 0.9447,0.41047,1.5455,90,90,90 - colorless 5.18 X 30613
Br-Cd-K K4CdBr6 K4CdCl6,hR66,167 R-3c 1.274,1.274,1.547,90,90,120 - - 3.43 A 3187
Br-Cd-O Cd[BrO3]2 *,hP*,* - 1.119,1.119,0.871,90,90,120 - - - N 21495
Br-Cd-P Cd2P 3Br Cd2As3I,mS24,15 C12/c1 0.8088,0.9094,0.7536,90,100.38,90 - brown red 4.84 X 11394
Br-Cd-P Cd4P 2Br3 Cd4As2I3,cP72,205 Pa-3 1.2365,1.2365,1.2365,90,90,90 - red 5.28 X 29171
Br-Cd-P Cd5P 2Br4 Cd5P 2Br4,oP44,33 Pna21 1.2189,1.3664,0.7708,90,90,90 - green 4.88 X 38021
Br-Cd-Rb RbCdBr3 rt [NH4]CdCl3,oP20,62 Pnma 0.9436,0.4202,1.5607,90,90,90 - - 4.70 X 10348
Br-Cd-Rb Rb4CdBr6 K4CdCl6,hR66,167 R-3c 1.3033,1.3033,1.6268,90,90,120 - colorless 3.89 X 26710
Br-Cd-Tl TlCdBr3 [NH4]CdCl3,oP20,62 Pnma 0.9379,0.413,1.519,90,90,90 - - 6.28 X 27347
Br-Cd-W CdW6Br14 HgMo 6Cl14,cP84,201 Pn-3 1.33126,1.33126,1.33126,90,90,90 Chevrel phase - 6.57 X 29929
Br-Ce-Cl CeBr1.08 Cl1.92 UCl3,hP8,176 P63/m 0.7637,0.7637,0.4371,90,90,120 - - 4.43 X 24620
Br-Ce-Ga Ce10 Ga5Br4 La10 Ga5Cl4,tI76,140 I4/mcm 0.80937,0.80937,3.2129,90,90,90 - - 6.53 X 45826
342 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Ce-Ga Ce3GaBr3 Mg3NF3,cP7,221 Pm-3m 0.60043,0.60043,0.60043,90,90,90 rocksalt family golden 5.60 X 45817
Br-Ce-Ga Ce4Ga5Br2 La4Al5Br2 ,oS44,65 Cmmm 1.5796,1.6795,0.42344,90,90,90 - golden 6.32 X 42352
Br-Ce-H CeBr2H0.87 CeBr2H0.87 ,hR18,160 R3m 0.406,0.406,2.0973,90,90,120 - colorless 5.01 X 26778
Br-Ce-K K2CeBr5 K2PrCl5,oP32,62 Pnma 1.3336,0.9226,0.8437,90,90,90 - - 3.95 A 18593
Br-Ce-N Ce2Br3N Ce2Br3N,tI96,88 I41/a 1.4635,1.4635,1.2071,90,90,90 - yellow 5.49 X 32540
Br-Ce-N Ce3Br6N Ce3NCl6,oP80,61 Pbca 1.1112,1.1724,1.702,90,90,90 - yellow 5.47 X 32539
Br-Ce-O CeBrO PbClF,tP6,129 P4/nmm 0.4138,0.4138,0.7487,90,90,90 - - 6.11 A 2606
Br-Ce-P Ce3PBr3 Ca3PI3,cI56,214 I4132 1.1839,1.1839,1.1839,90,90,90 - - 5.53 A 39490
Br-Ce-Rb Rb2CeBr5 K2PrCl5,oP32,62 Pnma 1.3669,0.9403,0.8615,90,90,90 - - 4.26 A 18593
Br-Ce-S CeSBr CeSI,oP24,61 Pbca 0.694,1.382,0.712,90,90,90 - green 4.90 A 5179
Br-Cl-Cs CsBr0.5 Cl0.5 CsCl,cP2,221 Pm-3m 0.4204,0.4204,0.4204,90,90,90 b.c.c. family - 4.26 X 5792
Br-Cl-Cu CuBr0.5 Cl0.5 ZnS,cF8,216 F-43m 0.55445,0.55445,0.55445,90,90,90 adamantane structure - 4.72 X 210
Br-Cl-Eu EuBrCl BiSCl,oP12,62 Pnma 0.7822,0.454,0.9075,90,90,90 - gray faint 5.51 A 16307
Br-Cl-Eu EuBr1.90 Cl0.10 SrBr2,tP30,85 P4/n 1.1507,1.1507,0.702,90,90,90 - - 5.49 A 16307
Br-Cl-Gd GdBr0.51 Cl2.49 UCl3,hP8,176 P63 /m 0.7455,0.7455,0.41134,90,90,120 - - 4.80 A 21462
Br-Cl-Gd GdBr1.09 Cl1.91 PuBr3,oS16,63 Cmcm 0.39191,1.2316,0.8775,90,90,90 - - 4.89 X 24620
Br-Cl-Gd GdBr1.8 Cl1.2 AlCl3,mS16,12 C12/m1 0.713,1.24,0.675,90,110.9,90 - - 4.09 A 21462
Br-Cl-Hg HgBrCl orth Hg(Br0.5 Cl0.5 )2,oP12,19 P212121 0.41,0.678,1.317,90,90,90 - - 5.73 X 209
Br-Cl-Hg HgBr1.4 Cl0.6 rt *,oP12,53 Pmna 0.6795,1.3175,0.4164,90,90,90 - - - N 30122
Br-Cl-K KBr0.5 Cl0.5 NaCl,cF8,225 Fm-3m 0.644,0.644,0.644,90,90,90 rocksalt family - 2.41 X 15595
Br-Cl-Na NaBr0.493 Cl0.507 NaCl,cF8,225 Fm-3m 0.58125,0.58125,0.58125,90,90,90 rocksalt family - 2.72 X 320
Br-Cl-Nb NbBr2.5 Cl2.5 NbCl5,mS72,12 C12/m1 1.875,1.815,0.599,90,90.1,90 - - 3.73 A 3442
Br-Cl-Nd NdBr1.97 Cl1.03 UCl3,hP8,176 P63 /m 0.77592,0.77592,0.43181,90,90,120 - - 4.99 X 24620
Br-Cl-P P 3BrCl14 P 3BrCl14,tI36,79 I4 0.8739,0.8739,1.232,90,90,90 - - 2.36 X 30337
Br-Cl-Pb PbBrCl BiSeCl,oP12,62 Pnma 0.7804,0.4578,0.9209,90,90,90 - - 6.51 X 4440
Br-Cl-Pb PbBr1.40 Cl0.60 PbCl2,oP12,62 Pnma 0.79071,0.46513,0.9335,90,90,90 - - 6.58 X 19634
Br-Cl-Pr PrBr1.07 Cl1.93 UCl3,hP8,176 P63 /m 0.76093,0.76093,0.4323,90,90,120 - - 4.52 X 24620
Br-Cl-Pu PuBr2.4 Cl0.6 UCl3,hP8,176 P63 /m 0.7806,0.7806,0.4302,90,90,120 - - 6.69 X 322
Br-Cl-Rb RbBr0.5 Cl0.5 NaCl,cF8,225 Fm-3m 0.675,0.675,0.675,90,90,90 rocksalt family - 3.09 X 5792
Br-Cl-Re Re3Br8Cl Re3Br8Cl,mS48,12 C12/m1 1.556,1.05,0.937,90,116.83,90 - - 6.00 X 6726
Br-Cl-Sm SmBr1.12 Cl1.88 UCl3,hP8,176 P63 /m 0.7589,0.7589,0.41985,90,90,120 - - 4.86 X 24620
Br-Cl-Sn SnBrCl BiSCl,oP12,62 Pnma 0.827,0.477,1.001,90,90,90 - gray 3.94 A 6227
Br-Cl-Sn SnBr1.3 Cl0.7 PbCl2,oP12,62 Pnma 0.828,0.4243,1.012,90,90,90 - - 4.62 A 11401
Br-Cl-Sr SrBr0.14 Cl1.86 CaF2,cF12,225 Fm-3m 0.7007,0.7007,0.7007,90,90,90 fluorite family - 3.18 X 4747
Br-Cl-Sr SrBr0.30 Cl1.70 PbCl2,oP12,62 Pnma 0.7704,0.4584,0.9054,90,90,90 - - 3.57 X 15359
Br-Cl-Sr SrBr1.40 Cl0.60 PbCl2,oP12,62 Pnma 0.7964,0.467,0.9308,90,90,90 - - 4.24 X 15359
Br-Cl-Sr SrBr1.60 Cl0.40 SrBr2,tP30,85 P4/n 1.1503,1.1503,0.7018,90,90,90 - - 4.11 X 15359
Br-Cl-Tb TbBr0.3 Cl2.7 PuBr3,oS16,63 Cmcm 0.3854,1.185,0.8574,90,90,90 - - 4.73 A 21462
Br-Cl-Tb TbBr2.1 Cl0.9 AlCl3,mS16,12 C12/m1 0.71,1.23,0.665,90,110.3,90 - - 4.37 A 21462
Br-Cl-Tl TlBr0.08 Cl1.92 TlCl2,tI24,88 I41/a 0.69757,0.69757,1.5586,90,90,90 - yellow 4.88 A 9424
Br-Cl-Tl TlBr0.5 Cl0.5 CsCl,cP2,221 Pm-3m 0.39117,0.39117,0.39117,90,90,90 b.c.c. family - 7.27 X 3225
Br-Cl-Tl TlBr1.83 Cl0.17 GaCl2,oP24,52 Pnna 0.8007,1.0319,1.042,90,90,90 - brown 5.50 A 9424
Br-Cl-Tl Tl2Br1.67 Cl2.33 Tl2Br(Br0.33 Cl0.67)2Cl,oP24,19 P212121 0.6823,0.9506,1.1891,90,90,90 - brown 5.38 X 9424
Br-Cl-V VBrCl2 BiI3,hR24,148 R-3 0.624,0.624,1.81,90,90,120 - - 3.29 A 2201
Br-Cl-Yb YbBr0.6 Cl2.4 AlCl3,mS16,12 C12/m1 0.6781,1.1755,0.649,90,110.34,90 - - 4.19 A 21462
Br-Cl-Yb YbBr2.1 Cl0.9 BiI3,hR24,148 R-3 0.6902,0.6902,1.89,90,90,120 - - 4.76 A 21462
Br-Co-Cr CrCoBr3 BaNiO3,hP10,194 P63 /mmc 0.745,0.745,0.626,90,90,120 perovskite family - 3.87 A 16432
Br-Co-Cs Cs2CoBr4 K2[SO4],oP28,62 Pnma 1.0181,0.7723,1.3492,90,90,90 - - 4.03 A 9117
Br-Co-Cs Cs3CoBr5 Cs3CoCl5,tI36,140 I4/mcm 0.946,0.946,1.504,90,90,90 - - 4.23 X 14054
Br-Co-Er Er6CoBr10 Y6RuI10,aP17,2 P-1 0.71796,0.8916,0.8959,108.21,97.122,105.797 - black 6.06 X 59447
Br-Co-Gd Gd6CoBr10 Y6RuI10,aP17,2 P-1 0.73051,0.904,0.909,108.868,97.26,106.299 - - 5.65 X 45809
Br-Co-Ho Ho7CoBr12 Sc7NCl12,hR60,148 R-3 1.441,1.441,1.0182,90,90,120 - black 5.91 X 59447
Br-Co-K K2CoBr4 ht K2[SO4],oP28,62 Pnma 0.961,0.777,1.343,90,90,90 - - 3.03 A 9117
Br-Co-Pr Pr3CoBr3 Ca3PI3,cI56,214 I4132 1.1833,1.1833,1.1833,90,90,90 - - 5.78 A 28698
Br-Co-Pr Pr6CoBr10 Y6RuI10,aP17,2 P-1 0.7538,0.9359,0.9243,110.17,97.37,107.31 - black 5.01 X 28698
Br-Co-Rb RbCoBr3 lt1 RbCoBr3,hP30,158 P3c1 1.264,1.264,0.626,90,90,120 perovskite family - 4.42 X 51080
Br-Co-Rb RbCoBr3 lt2 KNiCl3,hP30,185 P63 cm 1.263,1.263,0.626,90,90,120 perovskite family - 4.43 X 51080
Br-Co-Rb RbCoBr3 rt BaNiO3,hP10,194 P63 /mmc 0.737,0.737,0.63,90,90,120 perovskite family - 4.30 X 51080
Br-Co-Rb Rb2CoBr4 K2[SO4],oP28,62 Pnma 0.9691,0.763,1.3278,90,90,90 - blue 3.72 X 36929
Br-Co-Sc Sc7CoBr12 Sc7NCl12,hR60,148 R-3 1.38066,1.38066,0.95806,90,90,120 - black 4.20 X 59447
Br-Co-Tb Tb6CoBr10 Y6RuI10,aP17,2 P-1 0.72734,0.902,0.90649,108.668,97.192,106.087 - black 5.72 X 59447
Br-Co-Th Th6CoBr15 Zr6CoCl15 ,cI44,229 Im-3m 1.15068,1.15068,1.15068,90,90,90 - black 5.78 X 25535
Br-Co-W W6CoBr14 HgMo6Cl14 ,cP84,201 Pn-3 1.316,1.316,1.316,90,90,90 Chevrel phase - 6.65 A 29929
Br-Co-Y Y6CoBr10 Y6RuI10,aP17,2 P-1 0.72284,0.89398,0.90127,108.46,97.1,105.94 - black 4.47 X 59447
Br-Cr-Cs CsCrBr3 BaNiO3,hP10,186 P63 mc 0.7588,0.7588,0.6506,90,90,120 - brown 4.35 X 7114
Br-Cr-Cs Cs3CrBr6 m Cs3CrCl6,oP74,58 Pnnm 1.1703,2.4036,0.7767,90,90,90 - green 4.24 A 39421
Br-Cr-Cs Cs3Cr2Br9 Cs3Cr2Cl9 ,hP28,194 P63 /mmc 0.7508,0.7508,1.87,90,90,120 perovskite family green 4.45 X 19316
Br-Cr-In CrInBr3 KCuCl3,mP20,14 P121/c1 0.41209,1.5006,0.93765,90,94.386,90 - yellow 4.67 X 35739
Br-Cr-O CrBrO FeClO,oP6,59 Pmmn 0.3232,0.3863,0.836,90,90,90 - - 4.71 X 3026
Br-Cr-S CrSBr FeClO,oP6,59 Pmmn 0.3506,0.4767,0.7965,90,90,90 - black 4.09 X 24175
Br-Cs-Cu CsCuBr3 CsCuBr3,oS40,20 C222 1 0.7666,1.2776,1.2653,90,90,90 - red dark 4.68 X 7387
Br-Cs-Cu CsCu2Br3 CsCu2Cl3,oS24,63 Cmcm 0.98712,1.23478,0.58132,90,90,90 - colorless 4.68 X 43452
Br-Cs-Cu Cs2CuBr4 K2[SO4],oP28,62 Pnma 1.0168,0.7954,1.2914,90,90,90 - red dark 4.13 X 7387
Br-Cs-Cu Cs3Cu2Br5 Cs3Cu2I5,oP40,62 Pnma 0.9524,1.0979,1.3648,90,90,90 - - 4.31 X 43452
Br-Cs-Dy CsDyBr3 NaNbO3,tP10,127 P4/mbm 0.8149,0.8149,0.58127,90,90,90 perovskite family - 4.60 X 28128
Br-Cs-Dy Cs3Dy2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.3623,1.3623,1.936,90,90,120 - colorless 4.62 A 22593
Br-Cs-Er Cs3Er2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.3571,1.3571,1.935,90,90,120 - pink light 4.69 X 22593
Br-Cs-Eu CsEuBr3 orth GdFeO3,oP20,62 Pnma 0.83027,1.1785,0.8242,90,90,90 perovskite family colorless 4.32 X 48068
Handbook of Inorganic Substances – Edition 2015 : Data 343

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Cs-Eu CsEuBr3 tet BaTiO3,tP5,99 P4mm 0.5844,0.5844,0.5888,90,90,90 perovskite family - 4.33 A 14158
Br-Cs-F CsBrF6 *,hR24,148 R-3 0.77993,0.77993,0.79627,90,90,120 - - - N 22143
Br-Cs-F CsF[Br2] CsF[Br2],tP4,123 P4/mmm 0.4177,0.4177,0.7634,90,90,90 - orange 3.89 X 31478
Br-Cs-F Cs2F2[Br2] Cs2F2[Br2],tI12,139 I4/mmm 0.42579,0.42579,2.0325,90,90,90 - - 4.18 X 31478
Br-Cs-Fe CsFeBr3 BaNiO3,hP10,194 P63/mmc 0.751,0.751,0.6315,90,90,120 perovskite family brown 4.61 X 8409
Br-Cs-Fe CsFeBr4 Ba[SO4],oP24,62 Pnma 1.21905,0.751,0.98832,90,90,90 - red dark 3.73 A 26841
Br-Cs-Fe Cs3FeBr5 Cs3CoCl5,tI36,140 I4/mcm 0.96,0.96,1.535,90,90,90 - gray green 4.01 X 7429
Br-Cs-Ga CsGaBr4 Ba[SO4],oP24,62 Pnma 1.215,0.748,0.988,90,90,90 - - 3.86 X 9009
Br-Cs-Gd Cs3Gd2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.3721,1.3721,1.939,90,90,120 - colorless 4.51 A 13586
Br-Cs-Ge CsGeBr3 ht-hp CaTiO3,cP5,221 Pm-3m 0.536,0.536,0.536,90,90,90 perovskite family yellow 4.80 X 30650
Br-Cs-Ge CsGeBr3 K[BrO3],hR15,160 R3m 0.78221,0.78221,0.98321,90,90,120 perovskite family yellow 4.26 X 30650
Br-Cs-Hf Cs2HfBr6 K2PtCl6,cF36,225 Fm-3m 1.0834,1.0834,1.0834,90,90,90 fluorite family colorless 4.83 A 17345
Br-Cs-Hg CsHgBr3 rt CsHgBr3,mS60,15 C12/c1 2.3673,0.8019,1.42766,90,125.303,90 - - 5.16 X 14465
Br-Cs-Hg CsHg2Br5 CsHg2Br5,mP16,11 P121/m1 0.8358,0.6302,1.117,90,106.88,90 - - 5.51 X 12727
Br-Cs-Hg Cs2HgBr4 lt1 [NH4]2ZnCl4,oP44,62 Pnma 1.024,0.79,1.3888,90,90,90 - - 4.65 X 34140
Br-Cs-Hg Cs2HgBr4 lt2 Ca2[SiO4],mP28,14 P121/c1 0.7873,1.0231,1.59799,90,119.517,90 - - 4.66 X 34140
Br-Cs-Hg Cs2HgBr4 lt3 *,aP28,2 P-1 0.7754,1.0148,1.3837,90.,90.,90. - - - N 16905
Br-Cs-Hg Cs2HgBr4 lt4 *,aP56,2 P-1 1.01,1.38,1.54,90.,90.,90. - - - N 16905
Br-Cs-Hg Cs2HgBr4 rt [NH4]2ZnCl4,oP44,62 Pnma 1.027,0.7946,1.3935,90,90,90 - - 4.59 X 34140
Br-Cs-Hg Cs3HgBr5 [NH4]3ZnCl5,oP36,62 Pnma 0.933,1.1152,1.4003,90,90,90 - - 4.55 X 11888
Br-Cs-Ho Cs3Ho2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.3603,1.3603,1.936,90,90,120 - colorless 4.65 X 22593
Br-Cs-I CsI0.06 Br0.94 CsCl,cP2,221 Pm-3m 0.42985,0.42985,0.42985,90,90,90 b.c.c. family - 4.51 X 21195
Br-Cs-I Cs[IBr2] Cs[I3],oP16,62 Pnma 1.072,0.6612,0.9232,90,90,90 - - 4.26 A 10126
Br-Cs-I Cs[I2Br] Cs[I3],oP16,62 Pnma 1.0958,0.6634,0.9567,90,90,90 - - 4.46 X 2895
Br-Cs-In Cs3In2Br9 Cs3Cr2Cl9,hP28,194 P63/mmc 0.7717,0.7717,1.932,90,90,120 perovskite family colorless 4.49 A 11968
Br-Cs-La CsLa2Br7 ht RbDy2Cl7,oP40,62 Pnma 1.386,0.7633,1.4051,90,90,90 - - 4.33 A 24849
Br-Cs-La Cs2LaBr5 K2PrCl5,oP32,62 Pnma 1.43,0.9673,0.8957,90,90,90 - - 4.31 A 24849
Br-Cs-La Cs3LaBr6 ht [NH4]3FeF6,cF40,225 Fm-3m 1.2409,1.2409,1.2409,90,90,90 perovskite family - 3.54 A 24849
Br-Cs-La Cs3LaBr6 rt K3MoCl6,mP40,14 P121/c1 1.4786,0.8463,1.4157,90,107.33,90 - - 3.99 A 24849
Br-Cs-Li CsLiBr2 BaNiS2,tP8,129 P4/nmm 0.5187,0.5187,0.9924,90,90,90 - colorless 3.73 A 17594
Br-Cs-Lu Cs3Lu2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.35,1.35,1.931,90,90,120 - colorless 4.80 A 13586
Br-Cs-Mg CsMgBr3 BaNiO3,hP10,194 P63/mmc 0.761,0.761,0.6502,90,90,120 perovskite family - 4.04 X 13420
Br-Cs-Mn CsMnBr3 BaNiO3,hP10,194 P63/mmc 0.7609,0.7609,0.652,90,90,120 perovskite family rose 4.34 X 6395
Br-Cs-Mn Cs2MnBr4 K2[SO4],oP28,62 Pnma 1.015,0.7806,1.37,90,90,90 - - 3.92 X 6381
Br-Cs-Mn Cs3MnBr5 Cs3CoCl5,tI36,140 I4/mcm 0.9596,0.9596,1.557,90,90,90 - green 3.95 X 7429
Br-Cs-Mo CsMo3Br7 CsMo3Br7,hP48,163 P-31c 1.01925,1.01925,1.5069,90,90,120 Chevrel phase yellow 4.80 X 45729
Br-Cs-Mo Cs2MoBr6 K2PtCl6,cF36,225 Fm-3m 1.069,1.069,1.069,90,90,90 fluorite family - 4.57 A 4231
Br-Cs-Mo Cs3Mo 2Br8 Cs3Cr2Cl9,hP28,194 P63/mmc 0.7757,0.7757,1.7804,90,90,120 perovskite family yellow 4.40 X 7113
Br-Cs-N Cs2Br[N3] Rb2I[N3],tP12,127 P4/mbm 0.6321,0.6321,0.8293,90,90,90 - yellowish 3.89 A 19164
Br-Cs-Nb CsNb4Br11 CsNb4Cl11,oP32,51 Pmma 1.704,0.731,0.701,90,90,90 - black 5.26 X 4893
Br-Cs-Ni CsNiBr3 BaNiO3,hP10,194 P63/mmc 0.74312,0.74312,0.62023,90,90,120 perovskite family brown 4.83 X 58947
Br-Cs-Np Cs2NpBr6 K2PtCl6,cF36,225 Fm-3m 1.1082,1.1082,1.1082,90,90,90 fluorite family - 4.79 X 10697
Br-Cs-O Cs[BrO3] K[BrO3],hR15,160 R3m 0.65074,0.65074,0.82324,90,90,120 perovskite family - 4.30 X 29635
Br-Cs-O Cs[BrO4] tet1 Cs[ReO4],tI24,141 I41/amd 0.5751,0.5751,1.4821,90,90,90 - - 3.75 X 28350
Br-Cs-O Cs[BrO4] tet2 Cs[BrO4],tI24,88 I41/a 0.5751,0.5751,1.4821,90,90,90 - - 3.75 X 14321
Br-Cs-O Cs3BrO BaNiO3,hP10,194 P63/mmc 0.78,0.78,0.7122,90,90,120 perovskite family yellow 4.38 X 31066
Br-Cs-Pb CsPbBr3 ht1 ZnMn3C,tP5,123 P4/mmm 0.5859,0.5859,0.5895,90,90,90 - orange 4.76 X 1122
Br-Cs-Pb CsPbBr3 ht2 CaTiO3,cP5,221 Pm-3m 0.5874,0.5874,0.5874,90,90,90 perovskite family orange 4.75 X 12918
Br-Cs-Pb CsPbBr3 rt GdFeO3,oP20,62 Pnma 0.8255,1.1759,0.8207,90,90,90 perovskite family orange 4.83 X 42025
Br-Cs-Pb CsPb2Br5 *,t*32,* - 0.6002,0.6002,1.5204,90,90,90 - - 11.48 N 39696
Br-Cs-Pb Cs4PbBr6 orth *,o**,* - 0.4005,0.9749,2.0407,90,90,90 - - - N 39696
Br-Cs-Pb Cs4PbBr6 rhom K4CdCl6,hR66,167 R-3c 1.37219,1.37219,1.73153,90,90,120 - colorless 4.30 X 50762
Br-Cs-Pd Cs2PdBr6 K2PtCl6,cF36,225 Fm-3m 1.064,1.064,1.064,90,90,90 fluorite family - 4.70 A 150
Br-Cs-Po Cs2PoBr6 K2PtCl6,cF36,225 Fm-3m 1.101,1.101,1.101,90,90,90 fluorite family - 4.75 X 689
Br-Cs-Pt Cs2PtBr6 K2PtCl6,cF36,225 Fm-3m 1.065,1.065,1.065,90,90,90 fluorite family - 5.17 X 195
Br-Cs-Rb Cs0.65 Rb0.35 Br NaCl,cF8,225 Fm-3m 0.7112,0.7112,0.7112,90,90,90 rocksalt family - 3.62 X 3939
Br-Cs-Rb Cs0.9 Rb0.1 Br CsCl,cP2,221 Pm-3m 0.427,0.427,0.427,90,90,90 b.c.c. family - 4.44 X 3939
Br-Cs-Re CsReBr4 CsReBr4,oP48,61 Pbca 1.0141,1.2625,1.2953,90,90,90 - black 5.12 X 5239
Br-Cs-Re Cs2Re3Br11 Cs2Re3Br11,oP64,62 Pnma 0.95551,1.61029,1.3727,90,90,90 - black 5.36 X 29485
Br-Cs-S CsSBr FeClO,oP6,59 Pmmn 0.3506,0.4767,0.7965,90,90,90 - black 6.11 A 23671
Br-Cs-Sb Cs2SbBr6 [NH4]2SbBr6,tI72,141 I41/amd 1.0732,1.0732,2.17442,90,90,90 - - 4.60 X 17959
Br-Cs-Sb Cs3Sb2Br9 rt Cs3Fe2Cl9,hP14,164 P-3m1 0.793,0.793,0.9716,90,90,120 - - 4.27 X 27341
Br-Cs-Sc CsScBr3 BaNiO3,hP10,194 P63/mmc 0.76868,0.76868,0.6364,90,90,120 perovskite family - 4.26 A 14158
Br-Cs-Sc Cs3Sc2Br9 Cs3Cr2Cl9,hP28,194 P63/mmc 0.768,0.768,1.926,90,90,120 perovskite family colorless 4.08 A 13586
Br-Cs-Sm CsSmBr3 GdFeO3,oP20,62 Pnma 0.8329,1.1814,0.8236,90,90,90 perovskite family - 4.29 A 32489
Br-Cs-Sm Cs3Sm2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.3797,1.3797,1.937,90,90,120 - colorless 4.43 A 13586
Br-Cs-Sn CsSnBr3 ht CaTiO3,cP5,221 Pm-3m 0.58,0.58,0.58,90,90,90 perovskite family black 4.18 X 8392
Br-Cs-Sn CsSn2Br5 [NH4]Pb2Br5,tI32,140 I4/mcm 0.8483,0.8483,1.528,90,90,90 - colorless 4.65 X 39169
Br-Cs-Sn Cs2SnBr6 K2PtCl6,cF36,225 Fm-3m 1.081,1.081,1.081,90,90,90 fluorite family - 4.54 X 157
Br-Cs-Sn Cs4SnBr6 K4CdCl6,hR66,167 R-3c 1.358,1.358,1.695,90,90,120 - - 4.16 A 16133
Br-Cs-Sr CsSrBr3 GdFeO3,oP20,62 Pnma 0.83344,1.18238,0.82417,90,90,90 perovskite family - 3.76 A 32489
Br-Cs-Tb Cs3Tb2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.3668,1.3668,1.936,90,90,120 - colorless 4.57 X 22593
Br-Cs-Te Cs2TeBr6 K2PtCl6,cF36,225 Fm-3m 1.0934,1.0934,1.0934,90,90,90 fluorite family orange 4.44 X 20908
Br-Cs-Ti CsTiBr3 BaNiO3,hP10,194 P63/mmc 0.7656,0.7656,0.6357,90,90,120 perovskite family black 4.33 X 28310
Br-Cs-Ti Cs3Ti2Br9 Cs3Cr2Cl9,hP28,194 P63/mmc 0.7656,0.7656,1.8958,90,90,120 perovskite family - 4.19 X 58381
Br-Cs-Tl CsTlBr4 rt CsTlBr4,oP24,19 P212121 0.67778,0.76077,1.76899,90,90,90 - yellowish 4.78 X 18643
Br-Cs-Tl Cs2TlBr5 rt Cs2TlBr5,oP64,62 Pnma 1.33018,0.77698,2.34925,90,90,90 - yellow 4.76 X 20847
Br-Cs-Tl Cs3Tl2Br9 ht Cs3Fe2Cl9,hP14,164 P-3m1 0.7969,0.7969,0.98298,90,90,120 - - 4.69 A 20926
344 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Cs-Tl Cs3Tl2Br9 rt Cs3Tl2Br9 ,mP30,11 P121/m1 0.96498,0.77949,1.38216,90,92.68,90 - - 4.88 X 20926


Br-Cs-Tm CsTmBr3 NaNbO3,tP10,127 P4/mbm 0.80817,0.80817,0.57452,90,90,90 perovskite family - 4.79 A 26873
Br-Cs-Tm Cs3Tm2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.3551,1.3551,1.934,90,90,120 - colorless 4.72 A 13586
Br-Cs-U Cs2UBr6 K2PtCl6,cF36,225 Fm-3m 1.107,1.107,1.107,90,90,90 fluorite family green 4.81 X 7790
Br-Cs-V CsVBr3 BaNiO3,hP10,194 P63 /mmc 0.757,0.757,0.632,90,90,120 perovskite family - 4.49 X 18214
Br-Cs-W CsW3Br7 CsW3Br7,hP44,163 P-31c 1.018,1.018,1.5125,90,90,120 Chevrel phase red 6.09 X 35201
Br-Cs-W Cs2WBr6 K2PtCl6,cF36,225 Fm-3m 1.0733,1.0733,1.0733,90,90,90 fluorite family black 4.99 X 33872
Br-Cs-Y Cs3Y2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.3638,1.3638,1.938,90,90,120 - - 4.14 X 16683
Br-Cs-Yb CsYbBr3 CaTiO3,cP5,221 Pm-3m 0.57165,0.57165,0.57165,90,90,90 perovskite family - 4.85 X 26873
Br-Cs-Yb Cs3Yb2Br9 Cs3Tl2Cl9,hR84,167 R-3c 1.3515,1.3515,1.933,90,90,120 - colorless 4.77 A 22593
Br-Cs-Zn Cs2ZnBr4 rt K2[SO4],oP28,62 Pnma 1.0202,0.7738,1.3539,90,90,90 - colorless 4.04 X 14814
Br-Cs-Zn Cs3ZnBr5 Cs3CoCl5,tI36,140 I4/mcm 0.96325,0.96325,1.5141,90,90,90 - colorless 4.08 X 55324
Br-Cs-Zr CsZr6Br14 *,oS*,64 Cmce 1.4737,1.3297,1.2108,90,90,90 - - - N 22583
Br-Cu-Ga CuGaBr4 CuAlCl4,tP12,112 P-42c 0.5707,0.5707,1.0669,90,90,90 - - 4.33 A 34326
Br-Cu-I CuI0.5 Br0.5 ZnS,cF8,216 F-43m 0.5865,0.5865,0.5865,90,90,90 adamantane structure - 5.50 X 210
Br-Cu-K K2CuBr3 rt K2CuCl3,oP24,62 Pnma 1.26066,0.43361,1.3247,90,90,90 - colorless 3.50 X 43452
Br-Cu-Mo CuMo3Br7 CuMo3Cl7 ,cP88,201 Pn-3 1.335,1.335,1.335,90,90,90 - orange red 5.08 X 32482
Br-Cu-P Cu6P 10Br5 Cu6P 10Br5 ,aP98,2 P-1 0.9886,1.319,1.4763,70.83,82.68,80.13 - - 4.06 X 33844
Br-Cu-Pb CuPb3Br7 orth CuPb3Br7,oP96,62 Pnma 0.79,2.3805,0.6934,90,90,90 - orange 6.34 X 45763
Br-Cu-Pb CuPb3Br7 tricl CuPb3Br7,aP94,1 P1 0.7841,1.377,2.3671,90.04,90.,90.28 - orange 6.47 X 45763
Br-Cu-Rb RbCu2Br3 CsCu2Cl3,oS24,63 Cmcm 0.98563,1.2412,0.55522,90,90,90 - - 4.42 X 43452
Br-Cu-Rb Rb2CuBr3 K2CuCl3,oP24,62 Pnma 1.30729,0.44515,1.36414,90,90,90 - - 3.97 X 43452
Br-Cu-Se CuSe2Br CuTe2Cl,mP16,14 P121/c1 0.78838,0.46439,1.20926,90,115.913,90 - black 5.03 X 36610
Br-Cu-Se CuSe3Br CuSe3Br,oP20,30 Pnc2 0.4481,0.7672,1.4329,90,90,90 - red deep 5.13 X 25149
Br-Cu-Te CuTeBr ht CuTeBr,tI80,141 I41/amd 1.6335,1.6335,0.4786,90,90,90 - black 5.64 X 11941
Br-Cu-Te CuTeBr lt *,oP*,48 Pnnn 1.416,1.6228,1.6593,90,90,90 - - - N 39237
Br-Cu-Te CuTeBr rt CuTeBr,oF288,70 Fddd 1.417,2.322,2.322,90,90,90 - - 5.66 X 39237
Br-Cu-Te CuTe2Br CuTe2Cl,mP16,14 P121/c1 0.8345,0.4928,1.2361,90,116.456,90 - black 5.82 X 23101
Br-Cu-W CuW3Br7 cub CuMo3Cl7 ,cP88,201 Pn-3 1.3391,1.3391,1.3391,90,90,90 - brown dark 6.50 X 35223
Br-Cu-W CuW3Br7 orth CuMo3I7,oP88,61 Pbca 0.9887,1.5954,1.5126,90,90,90 - yellow 6.54 X 35223
Br-Cu-W CuW6Br14 HgMo6Cl14 ,cP84,201 Pn-3 1.339,1.339,1.339,90,90,90 Chevrel phase - 6.32 A 29929
Br-D-Gd GdBrD0.69 ZrClO0.29 ,hR18,166 R-3m 0.38668,0.38668,2.9128,90,90,120 - - 6.30 A 22382
Br-D-La LaBr2D0.90 LaBr2H0.90 ,hP8,194 P63 /mmc 0.4104,0.4104,1.3969,90,90,120 - black blue 4.90 X 26778
Br-D-N [ND4]Br hp-lt2 [NH4]Br,cP6,215 P-43m 0.401,0.401,0.401,90,90,90 - - 2.63 X 511
Br-D-N [ND4]Br ht [NH4]Br,cF136,225 Fm-3m 0.69,0.69,0.69,90,90,90 - - 2.06 X 511
Br-D-N [ND4]Br lt1 [NH4]Br,tP4,129 P4/nmm 0.5818,0.5818,0.413,90,90,90 - - 2.42 X 511
Br-D-N [ND4]Br rt [NH4]Br,cP10,221 Pm-3m 0.406,0.406,0.406,90,90,90 - - 2.53 X 511
Br-D-Tb TbBrD0.81 ZrClO0.29 ,hR18,166 R-3m 0.38363,0.38363,2.89833,90,90,120 - - 6.49 X 22382
Br-D-Tb TbBrD2 TbBrH2,hR24,166 R-3m 0.3781,0.3781,3.0883,90,90,120 - green olive 6.33 X 18126
Br-D-Th Th6Br15D7 Th6Br15H7 ,cI58,229 Im-3m 1.13761,1.13761,1.13761,90,90,90 - black 5.88 X 24494
Br-D-Y YBrD0.79 SmSI,hR18,166 R-3m 0.38047,0.38047,2.88193,90,90,120 - - 4.70 X 28916
Br-D-Zr ZrBrD ZrBrH-b,hP6,164 P-3m1 0.34854,0.34854,0.97517,90,90,120 - - 5.60 X 18558
Br-D-Zr Zr2Br2D Zr2Br2H,mS20,12 C12/m1 1.9437,0.35253,0.59036,90,100.98,90 - - 5.76 X 18969
Br-Dy-K KDyBr3 GdFeO3,oP20,62 Pnma 0.81078,1.11201,0.77485,90,90,90 perovskite family - 4.20 A 28128
Br-Dy-Li LiDy2Br5 U2FeS5,mS32,15 C12/c1 1.6434,0.6958,0.7686,90,95.65,90 - black 5.56 X 32526
Br-Dy-Li Li3DyBr6 Li3ErBr6,mS22,12 C12/m1 0.6926,1.2002,0.6859,90,109.69,90 - - 4.10 A 33747
Br-Dy-Na Na3DyBr6 rt Na3AlF6,mP20,14 P121/c1 0.7226,0.772,1.28977,90,123.411,90 - - 3.93 A 31081
Br-Dy-O DyBrO PbClF,tP6,129 P4/nmm 0.3867,0.3867,0.8219,90,90,90 - - 6.98 A 2606
Br-Dy-Rb RbDyBr3 GdFeO3,oP20,62 Pnma 0.81402,1.1403,0.79667,90,90,90 perovskite family - 4.38 A 28128
Br-Dy-Rb Rb5Dy3Br12 K5Dy3I12,hP20,189 P-62m 1.4525,1.4525,0.4753,90,90,120 - - 3.58 A 39436
Br-Dy-S DySBr FeClO,oP6,59 Pmmn 0.4079,0.5349,0.8066,90,90,90 - white 5.18 X 31109
Br-Dy-Sr Sr4DyBr11 *,oP*,62 Pnma 0.721,3.518,0.6768,90,90,90 - - - N 21984
Br-Er-Li Li3ErBr6 Li3ErBr6,mS22,12 C12/m1 0.689,1.1916,0.6842,90,109.77,90 - rose 4.19 X 33747
Br-Er-Na Na3ErBr6 rt Na3AlF6,mP20,14 P121/c1 0.7191,0.7683,1.28406,90,123.445,90 - - 4.02 A 31081
Br-Er-O ErBrO PbClF,tP6,129 P4/nmm 0.3821,0.3821,0.8264,90,90,90 - - 7.24 X 2606
Br-Er-Os Er4OsBr4 Y4OsBr4,mS36,15 C12/c1 1.2434,1.2321,0.6492,90,90.92,90 - - 7.87 A 26017
Br-Er-S ErSBr FeClO,oP6,59 Pmmn 0.401,0.532,0.808,90,90,90 - rose 5.38 A 5179
Br-Er-Se ErSeBr FeClO,oP6,59 Pmmn 0.4063,0.5592,0.795,90,90,90 - - 6.00 A 33767
Br-Eu-F EuBrF PbClF,tP6,129 P4/nmm 0.4219,0.4219,0.7312,90,90,90 - white 6.40 A 11683
Br-Eu-I EuIBr BiSCl,oP12,62 Pnma 0.83723,0.47404,0.9799,90,90,90 - pink 6.13 X 42645
Br-Eu-I EuI0.2 Br1.8 SrBr2,tP30,85 P4/n 1.1652,1.1652,0.714,90,90,90 - - 5.50 A 17216
Br-Eu-I EuI1.6 Br0.4 m *,mP*,* - 0.7985,0.7654,1.5004,90,95.4,90 - - - N 17216
Br-Eu-I EuI1.8 Br0.2 SrI2,oP24,61 Pbca 0.7786,1.5065,0.8167,90,90,90 - - 5.50 A 17216
Br-Eu-Li Li3EuBr6 Li3ErBr6,mS22,12 C12/m1 0.6966,1.2101,0.6872,90,109.6,90 - - 3.97 A 33747
Br-Eu-Na Na3EuBr6 rt Na3GdCl6 ,hR36,148 R-3 0.7398,0.7398,1.9951,90,90,120 - - 3.69 A 31081
Br-Eu-O EuBrO PbClF,tP6,129 P4/nmm 0.3924,0.3924,0.8015,90,90,90 - white 6.67 X 2841
Br-Eu-O Eu2BrO2 Eu2BrO2,mS20,12 C12/m1 1.25826,0.40301,0.9552,90,121.151,90 - red 6.66 X 47586
Br-Eu-O Eu3BrO4 Eu3BrO4,oS32,63 Cmcm 0.4124,1.1986,1.1854,90,90,90 - white ivory 6.80 X 5631
Br-Eu-O Eu4Br6O Ba4Cl6O,hP22,186 P63 mc 0.98204,0.98204,0.74969,90,90,120 - yellow pale 5.85 X 20851
Br-Eu-P Eu2PBr NaFeO2,hR12,166 R-3m 0.4385,0.4385,2.19,90,90,120 rocksalt family brown 5.67 X 19144
Br-Eu-W EuW6Br14 HgMo6Cl14 ,cP84,201 Pn-3 1.361,1.361,1.361,90,90,90 Chevrel phase - 6.25 A 29929
Br-F-Ge [BrF2]2GeF6 [BrF2]2GeF6,mP26,14 P121/c1 0.507,1.383,0.645,90,116.6,90 - - 3.47 X 9891
Br-F-K KBrF4 KBrF4-b,tI24,140 I4/mcm 0.617,0.617,1.11,90,90,90 - - 3.07 X 4738
Br-F-K KBrF6 BaSiF6,hR24,166 R-3m 0.735,0.735,0.7386,90,90,120 - - 3.36 A 5857
Br-F-Na NaBrF4 KBrF4-b,tI24,140 I4/mcm 0.5762,0.5762,1.0327,90,90,90 - - 3.47 A 20660
Br-F-Nb Nb2Br2.67 F2.33 Nb2Br2.67 F2.33 ,hR162,167 R-3c 0.96373,0.96373,3.5415,90,90,120 - black 4.65 X 39127
Br-F-O BrO2F Br(O0.67 F0.33 )3,hR42,167 R-3c 0.51977,0.51977,1.73346,90,90,120 - - 3.22 X 33802
Br-F-Pb PbBrF PbClF,tP6,129 P4/nmm 0.41916,0.41916,0.76003,90,90,90 - colorless 7.61 X 57870
Handbook of Inorganic Substances – Edition 2015 : Data 345

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-F-Pb Pb3BrF5 Pb3BrF5,mS20,12 C12/m1 0.72801,0.425,1.12753,90,102.313,90 - - 7.76 X 13162


Br-F-Pb Pb7Br2F12 Zr2Fe12P 7,hP21,174 P-6 1.0356,1.0356,0.40224,90,90,120 - - 8.17 X 38067
Br-F-Rb RbBrF4 KBrF4-b,tI24,140 I4/mcm 0.6401,0.6401,1.1538,90,90,90 - - 3.39 A 20660
Br-F-Rb RbBrF6 BaSiF6,hR24,166 R-3m 0.7636,0.7636,0.7663,90,90,120 - - 3.60 A 5857
Br-F-Sb [BrF2]SbF6 [BrF2]SbF6,oP40,54 Pcca 1.012,0.581,1.095,90,90,90 - - 3.65 X 4735
Br-F-Sb [BrF4]Sb2F11 [BrF4]Sb2F11-b,mP72,14 P121/c1 0.52289,1.451,1.4194,90,90.28,90 - colorless 3.75 X 40076
Br-F-Sb [BrF6]Sb2F11 [ClF6]Sb2F11,mP80,14 P121/c1 1.1931,0.8492,1.58381,90,130.753,90 - - 3.53 X 43015
Br-F-Sb [Br2 ]Sb3F16 [Br2 ]Sb3F16,mS84,15 C12/c1 1.358,0.771,1.433,90,93.7,90 - - 3.68 X 6051
Br-F-Sb [Br5 ]SbF6 *,mS48,15 C12/c1 1.2821,0.8884,1.0136,90,115.,90 - - - N 24491
Br-F-Sm SmBrF PbClF,tP6,129 P4/nmm 0.4235,0.4235,0.7316,90,90,90 - brown red 6.31 A 11683
Br-F-Sn SnBrF *,oP48,62 Pnma 2.2563,0.4315,1.4934,90,90,90 - - - N 8951
Br-F-Sn Sn3BrF5 Sn3BrF5,mP36,14 P121/c1 0.4295,1.2639,1.34606,90,108.247,90 - - 5.08 X 11290
Br-F-Sn Sn5Br4F6 Sn5Br4F6,oP64,62 Pnma 2.2563,0.4315,1.4934,90,90,90 - - 4.69 X 10959
Br-F-Sr SrBrF PbClF,tP6,129 P4/nmm 0.4217,0.4217,0.7337,90,90,90 - - 4.75 A 16320
Br-F-Tm TmBrF PbClF,tP6,129 P4/nmm 0.4015,0.4015,0.746,90,90,90 - black green 7.40 A 11683
Br-F-Yb YbBrF PbClF,tP6,129 P4/nmm 0.3983,0.3983,0.7546,90,90,90 - yellow 7.54 A 11683
Br-Fe-Gd Gd2 Fe2Br Gd2Fe2I,hP10,194 P63/mmc 0.3962,0.3962,1.6561,90,90,120 - - 7.47 A 28174
Br-Fe-Gd Gd7 FeBr12 Sc7NCl12,hR60,148 R-3 1.46124,1.46124,1.01659,90,90,120 - black 5.61 X 59447
Br-Fe-In FeInBr3 [NH4]CdCl3,oP20,62 Pnma 0.93481,0.39435,1.5141,90,90,90 - yellow 4.88 X 28694
Br-Fe-K KFeBr3 [NH4]CdCl3,oP20,62 Pnma 0.922,0.4026,1.4899,90,90,90 - - 4.02 X 14947
Br-Fe-K KFeBr4 rt KTlBr4,oP24,52 Pnna 0.7688,1.0373,1.0206,90,90,90 - red dark 3.38 A 26841
Br-Fe-La La6FeBr10 La6FeBr10,tP68,76 P41 0.8255,0.8255,3.0033,90,90,90 - black 5.48 X 50409
Br-Fe-Li LiFeBr4 rt LiAlCl4,mP24,14 P121/c1 0.7478,0.6801,1.3606,90,93.21,90 - red dark 3.68 A 26841
Br-Fe-Li Li2FeBr4 ht1 Yb2FeS4,cF72,227 Fd-3m 1.1152,1.1152,1.1152,90,90,90 spinel family - 3.73 X 32071
Br-Fe-Li Li2FeBr4 ht2 Mn2 SnS4,oS14,65 Cmmm 0.7735,1.0936,0.3826,90,90,90 - brown 4.00 X 32071
Br-Fe-Na NaFeBr4 rt NaGaBr4,oP24,62 Pnma 1.39261,0.747,0.74016,90,90,90 - red dark 3.44 A 26841
Br-Fe-Rb RbFeBr4 rt Ba[SO4],oP24,62 Pnma 1.1659,0.7495,0.9896,90,90,90 - red dark 3.54 A 26841
Br-Fe-Sc Sc4FeBr5 Y4RuI5,tP80,134 P42/nnm 1.0996,1.0996,1.6021,90,90,90 - - 4.36 A 31649
Br-Fe-Sc Sc4.75 FeBr7 Sc4.75 OsBr7,cP52,215 P-43m 1.09053,1.09053,1.09053,90,90,90 - - 4.24 A 33064
Br-Fe-Se FeSeBr7 AlSCl7,mP18,7 P1c1 0.6657,0.6604,1.4192,90,100.89,90 - - 3.76 X 25328
Br-Fe-Tb Tb7FeBr12 Sc7NCl12,hR60,148 R-3 1.4555,1.4555,1.01801,90,90,120 - black 5.67 X 59447
Br-Fe-Te FeTeBr7 AlSeCl7,aP18,1 P1 0.6796,0.8769,1.0435,85.71,77.37,82.94 - - 4.10 X 25328
Br-Fe-Th Th6FeBr15 Zr6CoCl15,cI44,229 Im-3m 1.14881,1.14881,1.14881,90,90,90 - black 5.80 X 25535
Br-Fe-Tl TlFeBr3 ht [NH4]CdCl3,oP20,62 Pnma 0.9279,0.3984,1.507,90,90,90 - green 5.96 X 16384
Br-Fe-Tl TlFeBr3 rt KNiCl3,hP30,185 P63cm 1.2444,1.2444,0.623,90,90,120 perovskite family red dark 5.96 X 15435
Br-Fe-Tl TlFeBr4 KTlBr4,oP24,52 Pnna 0.7773,1.0275,1.0191,90,90,90 - red dark 4.73 X 31176
Br-Fe-Y Y2Fe 2.23 Br2 Y2Fe2.23 Br2,hR21,166 R-3m 0.39066,0.39066,3.402,90,90,120 - - 5.12 X 28174
Br-Fe-Zr Zr6FeBr14 Zr6CI14,oS84,64 Cmce 1.4988,1.3408,1.2232,90,90,90 - - 4.65 A 19032
Br-Ga-In GaInBr4 GaInBr4,mP24,13 P12/c1 0.9061,0.7356,1.3006,90,106.35,90 - - 4.03 X 24177
Br-Ga-K KGaBr4 KGaBr4,hR108,161 R3c 2.2161,2.2161,0.8829,90,90,120 - - 3.41 X 24177
Br-Ga-La La10 Ga5Br4 La10 Ga5Cl4,tI76,140 I4/mcm 0.82009,0.82009,3.2516,90,90,90 - gray silver 6.25 X 40181
Br-Ga-La La3GaBr3 Mg3 NF3,cP7,221 Pm-3m 0.6075,0.6075,0.6075,90,90,90 rocksalt family golden 5.38 X 40181
Br-Ga-La La4.15 Ga4.69 Br2 La4.15 Ga4.69 Br2,oS54,65 Cmmm 1.59015,1.70341,0.42612,90,90,90 - golden 6.12 X 42352
Br-Ga-Li LiGaBr3 LiGaBr3,mP20,11 P121/m1 0.6535,1.0489,0.8007,90,93.24,90 - - 3.84 X 19779
Br-Ga-Li LiGaBr4 LiAlCl4,mP24,14 P121/c1 0.7416,0.6854,1.3696,90,93.14,90 - colorless 3.79 X 19779
Br-Ga-Na NaGaBr4 NaGaBr4,oP24,62 Pnma 1.4044,0.7452,0.7449,90,90,90 - - 3.51 X 24177
Br-Ga-Pd PdGa2Br8 PdGa2Br8,mS22,12 C12/m1 1.267,0.808,0.722,90,94.5,90 - red 3.99 X 44000
Br-Ga-Rb RbGaBr4 Ba[SO4],oP24,62 Pnma 1.165,0.7519,0.9934,90,90,90 - - 3.62 A 24177
Br-Ga-S Ga9S8Br11 *,mP560,10 P12/m1 1.815,5.965,1.86435,90,114.606,90 - colorless - N 3032
Br-Ga-Sb GaSb4Br4 GaSb4Cl4,oP72,33 Pna21 1.8096,1.01572,1.32168,90,90,90 - orange 4.79 X 44559
Br-Ga-Se GaSeBr7 AlSCl7,mP18,7 P1c1 0.6601,0.6553,1.4313,90,101.17,90 - yellow 3.87 X 32421
Br-Ga-Te GaTeBr GaTeCl,oP12,58 Pnnm 0.607,1.518,0.413,90,90,90 - - 4.84 A 16386
Br-Ga-Te Ga2Te 2Br7 Ga2Te2Br7,mP44,14 P121/c1 1.016,1.08314,1.38922,90,99.182,90 - violet 4.20 X 44559
Br-Ga-Te Ga3Te 3Br rt Al3Te3I,oP28,62 Pnma 1.0868,0.4081,1.9012,90,90,90 - red light 5.29 A 24326
Br-Ga-Tl TlGaBr4 TlGaBr4,mP48,14 P121/c1 1.22949,1.10566,1.26512,90,107.943,90 - colorless 4.82 X 53503
Br-Gd-Ge Gd2 GeBr2 Ta2CS2,hP5,164 P-3m1 0.41668,0.41668,0.98173,90,90,120 - - 6.15 X 48417
Br-Gd-H GdBrH0.69 GdBrH0.69 ,hP14,186 P63mc 0.38707,0.38707,1.9463,90,90,120 - - 6.26 X 18649
Br-Gd-H GdBrH0.87 GdIH0.80 ,hR21,166 R-3m 0.38742,0.38742,2.9085,90,90,120 - gray 6.27 A 18649
Br-Gd-H GdBrH2 *,hR*,166 R-3m 0.38186,0.38186,3.1003,90,90,120 - green light - N 20816
Br-Gd-Ir Gd11 Ir3Br15 Gd11 Ir3Br15,hP58,176 P63/m 1.27679,1.27679,1.28692,90,90,120 - black 6.41 X 54136
Br-Gd-Ir Gd5 Ir2Br5 Gd5Ir2Br5,oP48,62 Pnma 1.2554,0.41405,2.6338,90,90,90 - black 7.62 X 59428
Br-Gd-Ir Gd6 IrBr10 Y6RuI10,aP17,2 P-1 0.73494,0.9139,0.91782,109.206,97.104,106.552 - black 5.93 X 59447
Br-Gd-K K2GdBr5 K2PrCl5,oP32,62 Pnma 1.3233,0.9111,0.8374,90,90,90 - - 4.18 A 18593
Br-Gd-Li Li3GdBr6 Li3ErBr6,mS22,12 C12/m1 0.6953,1.2064,0.6869,90,109.75,90 - - 4.03 A 33747
Br-Gd-Mn Gd7 MnBr12 Sc7NCl12,hR60,148 R-3 1.4656,1.4656,1.00243,90,90,120 - black 5.65 X 59447
Br-Gd-N Gd2 Br3N Gd2Br3N,aP24,2 P-1 0.8266,0.8288,1.0255,106.97,103.72,98.61 - colorless 5.95 X 32541
Br-Gd-Na Na3GdBr6 lt Na3GdCl6,hR36,148 R-3 0.7371,0.7371,1.887,90,90,120 - - 3.96 X 31081
Br-Gd-Na Na3GdBr6 rt Na3AlF6,mP20,14 P121/c1 0.72522,0.7741,1.29297,90,123.354,90 - - 3.87 X 31081
Br-Gd-O Gd0.975 BrO PbClF,tP6,129 P4/nmm 0.3895,0.3895,0.81,90,90,90 - - 6.74 A 26624
Br-Gd-Os Gd6 OsBr10 Y6RuI10,aP17,2 P-1 0.73475,0.91357,0.91486,109.026,97.241,106.542 - black 5.94 X 59447
Br-Gd-Re Gd4 ReBr4 Gd4ReBr4,tP36,130 P4/ncc 1.26956,1.26956,0.65859,90,90,90 - black 7.10 X 54137
Br-Gd-Rh Gd6 RhBr10 Y6RuI10,aP17,2 P-1 0.73734,0.9132,0.9136,108.894,97.21,106.49 - black 5.66 X 59447
Br-Gd-Ru Gd6 RuBr10 Y6RuI10,aP17,2 P-1 0.73601,0.91189,0.91138,108.978,97.177,106.556 - black 5.69 X 59447
Br-Gd-S GdSBr NdSBr,mP12,14 P121/c1 0.68,0.696,0.681,90,99.23,90 - - 5.62 A 7115
Br-Gd-Si Gd3 SiBr3 Ca3PI3,cI56,214 I4132 1.147,1.147,1.147,90,90,90 - - 6.51 A 39490
Br-Gd-Si Gd4 SiBr6 Sc4BCl6,oP22,55 Pbam 1.3172,1.3982,0.4083,90,90,90 - black blue 5.02 X 45816
Br-Ge-La La3Ge 3Br2 La3Si3Cl2,mS32,12 C12/m1 1.8622,0.43263,1.0897,90,98.,90 - - 6.07 X 45720
Br-Ge-P Ge19P4Br4 Ge19P4I4,cP54,218 P-43n 1.04074,1.04074,1.04074,90,90,90 clathrate gray silver 5.37 X 7795
346 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Ge-Rb RbGeBr3 ht1 K[BrO3],hR15,160 R3m 0.78511,0.78511,1.01084,90,90,120 perovskite family - 3.67 A 21932
Br-Ge-Rb RbGeBr3 ht2 CaTiO3,cP5,221 Pm-3m 0.5659,0.5659,0.5659,90,90,90 perovskite family - 3.64 X 21932
Br-Ge-Rb RbGeBr3 rt YScS3,oP20,33 Pna21 0.8129,0.7611,1.1249,90,90,90 perovskite family brown 3.80 X 21932
Br-Ge-Rb Rb3Ge2Br7 rt Rb3Ge2Br7,mP48,14 P121/c1 1.0126,1.2777,1.3189,90,102.08,90 - white 3.83 X 23020
Br-Ge-S Ge2S3Br2 Ge2S3Br2,aP28,2 P-1 0.8806,0.9934,1.00823,93.845,115.722,90.13 - colorless 3.36 X 14790
Br-Ge-Sb Ge19Sb4Br4 Ge19P4I4,cP54,218 P-43n 1.07893,1.07893,1.07893,90,90,90 clathrate gray silver 5.78 A 7795
Br-H-La LaBr2H0.9 LaBr2H0.90 ,hP8,194 P63 /mmc 0.4109,0.4109,1.3962,90,90,120 - blue 4.87 A 26801
Br-H-N [NH4]Br ht NaCl,cF8,225 Fm-3m 0.679,0.679,0.679,90,90,90 rocksalt family - 2.08 X 2997
Br-H-N [NH4]Br lt1 [NH4]Br,tP4,129 P4/nmm 0.5809,0.5809,0.413,90,90,90 - - 2.33 X 3238
Br-H-N [NH4]Br lt2 CuTi,tP2,123 P4/mmm 0.40374,0.40374,0.4054,90,90,90 b.c.c. family - 2.46 X 4949
Br-H-N [NH4]Br rt [NH4]Br,cP10,221 Pm-3m 0.40603,0.40603,0.40603,90,90,90 - colorless 2.43 X 4977
Br-H-N [NH4]Br[NH3]3 [NH4]Cl[NH3]3,oP20,19 P212121 0.8996,0.896,0.9263,90,90,90 - - 1.33 X 1209
Br-H-N [N2H5]Br [N2H5]Br,mS24,15 C12/c1 1.285,0.454,1.194,90,110.27,90 - - 2.30 X 417
Br-H-O HBr[H2O]2 HCl[H2O]2,mP12,14 P121/c1 0.4164,1.2422,0.6946,90,101.21,90 - - 2.20 X 4996
Br-H-O HBr[H2O]3 rt HBr[H2O]3,oS16,41 Aea2 0.6228,0.5961,1.1722,90,90,90 - - 2.06 X 4996
Br-H-O HBr[H2O]4 HBr[H2O]4,mP20,4 P1211 0.7043,1.1466,0.7339,90,110.85,90 - - 1.83 X 4116
Br-H-O [Br2][H2O]8.6 *,t**,* - 2.38,2.38,1.22,90,90,90 clathrate red - N 1924
Br-H-O [Br2]3[H2O]23 [Br2]3[H2O]23,cP52,223 Pm-3n 1.201,1.201,1.201,90,90,90 - - 1.71 X 649
Br-H-O [H3O]Br [H3O]Cl,hR6,160 R3m 0.5058,0.5058,0.8906,90,90,120 - - 2.50 X 4996
Br-H-P [PH4]Br [NH4]Br,tP4,129 P4/nmm 0.6042,0.6042,0.4378,90,90,90 - - 2.39 X 6035
Br-H-Si H3SiBr lt H3GeCl,oS8,36 Cmc21 0.7262,0.5703,0.8456,90,90,90 - - 2.11 A 20950
Br-H-Sr SrBrH PbClF,tP6,129 P4/nmm 0.4255,0.4255,0.7291,90,90,90 - colorless 4.24 X 820
Br-H-Sr Sr7Br2H12 Zr2Fe12P 7,hP21,174 P-6 1.00462,1.00462,0.39968,90,90,120 - purple 3.73 X 51643
Br-H-Th Th6Br15H7 *,cI42,229 Im-3m 1.139,1.139,1.139,90,90,90 - black - P 25535
Br-H-Zr ZrBrH ZrBrH-a,hP6,164 P-3m1 0.34886,0.34886,0.9753,90,90,120 - - 5.56 X 16135
Br-H-Zr ZrBrH0.5 *,mS8,12 C12/m1 0.5913,0.35395,0.963,90,96.78,90 - - 5.70 P 16135
Br-Hf-N HfBrN hp YOF,hR18,166 R-3m 0.361,0.361,2.9294,90,90,120 fluorite family green 8.21 X 40454
Br-Hf-N HfBrN orth FeClO,oP6,59 Pmmn 0.35609,0.41165,0.8644,90,90,90 - - 7.14 X 40783
Br-Hf-N HfBrN rhom SmSI,hR18,166 R-3m 0.35725,0.35725,2.77362,90,90,120 - - 8.85 X 36031
Br-Hg-I HgI1.5 Br0.5 HgBr2,oS12,36 Cmc21 0.4698,0.72246,1.352,90,90,90 - yellow 6.24 X 58075
Br-Hg-I HgI1.8 Br0.2 rt HgI2,tP6,137 P42 /nmc 0.4156,0.4156,1.148,90,90,90 - - 7.45 A 8560
Br-Hg-K KHg5Br11 TlHg5Cl11 ,mS34,12 C12/m1 1.2293,1.519,0.6789,90,118.62,90 - - 5.73 A 13879
Br-Hg-N Hg2BrN Hg2BrN,hP16,194 P63 /mmc 0.665,0.665,1.126,90,90,120 - yellow 7.63 X 550
Br-Hg-O Hg2[BrO3 ]2 Hg2[BrO3]2,mS40,15 C12/c1 1.8806,0.447,0.8595,90,107.19,90 - colorless 6.32 X 3413
Br-Hg-O Hg5Br2O4 Hg5Cl2O4,oI44,72 Ibam 0.6185,1.1888,1.1746,90,90,90 - brown 9.44 X 3901
Br-Hg-O Hg8Br3O4 Hg8Br3O4 ,mP60,14 P121/c1 0.68554,0.63033,3.11214,90,96.562,90 - brown 9.49 X 19813
Br-Hg-P Hg2P 3Br Hg2P 3Br,oP24,60 Pbcn 0.8014,0.8903,0.7823,90,90,90 - black 6.83 X 29639
Br-Hg-P Hg7P 4Br6 Hg7P 4Br6,mP34,14 P121/c1 0.60452,1.9848,0.75596,90,104.214,90 - brown 7.58 X 27692
Br-Hg-S Hg3S2Br2 mon1 Hg3Se2Br2 ,mS56,12 C12/m1 1.7273,0.9374,0.9473,90,90.22,90 - - 7.15 X 31662
Br-Hg-S Hg3S2Br2 mon2 Hg3S2Br2,mS56,12 C12/m1 1.7996,0.9281,1.0289,90,116.14,90 - - 7.11 X 31662
Br-Hg-S Hg3S2Br2 tet *,t**,* - 1.314,1.314,0.889,90,90,90 - - - N 7428
Br-Hg-Sb HgSbBr rt *,cP*,198 P213 1.2992,1.2992,1.2992,90,90,90 - brown dark - N 2834
Br-Hg-Sb Hg2SbBr2 rt *,mP40,14 P121/c1 0.89,0.991,1.4,90,92.92,90 - brown dark - N 2834
Br-Hg-Sb Hg6Sb5Br7 rt Hg6Sb5Br7 ,cP72,205 Pa-3 1.3003,1.3003,1.3003,90,90,90 - black 7.17 X 37701
Br-Hg-Sb Hg7Sb4Br6 Hg7Sb4Br6 ,cP72,205 Pa-3 1.2994,1.2994,1.2994,90,90,90 - black 7.18 X 26411
Br-Hg-Se Hg3Se2Br2 Hg3Se2Br2 ,mS56,12 C12/m1 1.7529,0.9408,0.9775,90,90.49,90 - yellow 7.58 X 43084
Br-Hg-Te HgTeBr HgTeBr,tP56,92 P41212 1.02388,1.02388,1.448,90,90,90 - orange 7.14 X 47059
Br-Hg-Te Hg2TeBr3 Hg2TeBr3,mP24,14 P121/c1 0.74865,1.0025,1.17619,90,122.677,90 - brown 6.87 X 48355
Br-Hg-Te Hg3TeBr4 Hg3TeCl4,oP64,61 Pbca 1.236,1.2523,1.2868,90,90,90 - - 7.00 X 31662
Br-Hg-Te Hg3Te2Br2 Hg3S2Cl2,cI28,199 I213 0.953,0.953,0.953,90,90,90 - yellow 7.80 X 14184
Br-Hg-Tl TlHg5Br11 TlHg5Cl11 ,mS34,12 C12/m1 1.225,1.5082,0.6756,90,118.6,90 - - 6.32 A 13879
Br-Hg-Tl Tl4HgBr6 Tl4HgBr6,tP22,128 P4/mnc 0.8978,0.8978,0.8812,90,90,90 - - 7.00 X 7821
Br-Ho-Li Li3HoBr6 Li3ErBr6,mS22,12 C12/m1 0.6909,1.1967,0.6858,90,109.9,90 - - 4.14 A 33747
Br-Ho-Na Na3HoBr6 rt Na3AlF6,mP20,14 P121/c1 0.721,0.7703,1.28722,90,123.432,90 - - 3.97 A 31081
Br-Ho-Ni Ho7NiBr12 Sc7NCl12,hR60,148 R-3 1.44097,1.44097,1.02975,90,90,120 - black 5.84 X 59447
Br-Ho-O HoBrO PbClF,tP6,129 P4/nmm 0.3832,0.3832,0.8241,90,90,90 - - 7.16 A 2606
Br-Ho-S HoSBr FeClO,oP6,59 Pmmn 0.403,0.534,0.809,90,90,90 - white 5.28 A 5179
Br-I-In InI2Br rt In(I0.67 Br0.33)3,hR24,146 R3 0.7063,0.7063,2.0158,90,90,120 - - 5.13 X 16889
Br-I-K KI0.5 Br0.5 NaCl,cF8,225 Fm-3m 0.684,0.684,0.684,90,90,90 rocksalt family - 2.96 X 26460
Br-I-Li LiI0.1 Br0.9 NaCl,cF8,225 Fm-3m 0.557,0.557,0.557,90,90,90 rocksalt family - 3.52 X 43997
Br-I-Li LiI0.7 Br0.3 rt ZnO,hP4,186 P63 mc 0.44548,0.44548,0.7191,90,90,120 adamantane structure - 3.22 X 43997
Br-I-Li LiI0.88 Br0.12 NaCl,cF8,225 Fm-3m 0.595,0.595,0.595,90,90,90 rocksalt family - 4.04 X 43997
Br-I-Nb Nb6I10.5 Br0.5 lt Nb6I11H0.45 ,oP72,33 Pna21 1.3404,1.5287,1.1249,90,90,90 - - 5.56 X 29506
Br-I-Nb Nb6I10.5 Br0.5 rt Nb6I10.5 Br0.5 ,oP72,56 Pccn 1.128,1.5302,1.3524,90,90,90 - - 5.49 X 29506
Br-I-Nb Nb6I8.7 Br2.3 lt Nb6I8.7 Br2.3 ,oP80,33 Pna21 1.3346,1.5064,1.1136,90,90,90 - - 5.47 X 29506
Br-I-Nb Nb6I8.7 Br2.3 rt Nb6I8.7 Br2.3 ,oP80,56 Pccn 1.1167,1.5091,1.3431,90,90,90 - - 5.42 X 29506
Br-I-Pb PbI0.3 Br1.7 PbCl2,oP12,62 Pnma 0.8157,0.4762,0.9637,90,90,90 - - 6.76 A 14438
Br-I-Pb PbI0.8 Br1.2 BiSCl,oP12,62 Pnma 0.8639,0.4427,1.0452,90,90,90 - - 6.72 X 14438
Br-I-Pb PbI1.9 Br0.1 CdI2,hP6,186 P63 mc 0.4497,0.4497,1.3832,90,90,120 CdI2 -PbI2 polytype - 6.26 A 14438
Br-I-Rb RbI0.5 Br0.5 NaCl,cF8,225 Fm-3m 0.7109,0.7109,0.7109,90,90,90 rocksalt family - 3.49 X 4343
Br-I-Rb Rb[IBr2] Cs[I3],oP16,62 Pnma 1.034,0.6376,0.8884,90,90,90 - - 4.22 A 10126
Br-I-Sn SnIBr BiSCl,oP12,62 Pnma 0.874,0.432,1.075,90,90,90 - yellow 5.33 A 8074
Br-I-Sn SnI1.7 Br0.3 SnI2,mS18,12 C12/m1 1.416,0.454,1.076,90,92.,90 - - 5.17 A 8074
Br-I-Sn SnI2Br2 SnI4,cP40,205 Pa-3 1.214,1.214,1.214,90,90,90 - - 3.95 A 8074
Br-I-Sr SrI0.2 Br1.8 SrBr2,tP30,85 P4/n 1.1713,1.1713,0.7161,90,90,90 - - 4.34 A 4747
Br-I-Sr SrI0.64 Br1.36 PbCl2,oP12,62 Pnma 0.8314,0.4818,0.9651,90,90,90 - - 4.77 A 4747
Br-I-Sr SrI1.64 Br0.36 SrI2,oP24,61 Pbca 0.775,1.513,0.812,90,90,90 - - 4.53 A 4747
Br-I-Ti TiI2Br2 SnI4,cP40,205 Pa-3 1.179,1.179,1.179,90,90,90 - - 3.74 A 16477
Handbook of Inorganic Substances – Edition 2015 : Data 347

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-I-Tl TlI0.462 Br0.538 rt CsCl,cP2,221 Pm-3m 0.4091,0.4091,0.4091,90,90,90 b.c.c. family - 7.42 X 9


Br-I-Tl Tl0.50 I0.33 Br0.17 W,cI2,229 Im-3m 0.42012,0.42012,0.42012,90,90,90 b.c.c. family - 7.06 X 2775
Br-I-V VIBr2 BiI3,hR24,148 R-3 0.6859,0.6859,1.93,90,90,120 - green 4.28 A 2201
Br-In-K KInBr3 KInBr3,hP20,147 P-3 0.85324,0.85324,1.07776,90,90,120 - yellow 3.85 X 35157
Br-In-K KInBr4 KTlBr4,oP24,52 Pnna 0.7891,1.039,1.039,90,90,90 - - 3.69 X 16846
Br-In-La La5In3Br CuHf5Sn3,hP18,193 P63/mcm 0.9828,0.9828,0.6829,90,90,120 AlB2 family - 6.51 X 41045
Br-In-Li LiInBr4 MgAl2O4,cF56,227 Fd-3m 1.09769,1.09769,1.09769,90,90,90 spinel family - 4.43 X 47463
Br-In-Mg MgInBr3 [NH4]CdCl3,oP20,62 Pnma 0.94395,0.39538,1.53744,90,90,90 - - 4.39 X 33925
Br-In-Mn MnInBr3 [NH4]CdCl3,oP20,62 Pnma 0.9431,0.39895,1.5353,90,90,90 - pink 4.71 X 28694
Br-In-Na NaInBr4 NaAlCl4,oP24,19 P212121 0.6761,1.0507,1.1081,90,90,90 - colorless 3.86 X 22992
Br-In-O InBrO FeClO,oP6,59 Pmmn 0.3611,0.4049,0.8649,90,90,90 - - 5.53 X 755
Br-In-Rb RbInBr4 KTlBr4,oP24,52 Pnna 0.8109,1.0637,1.0537,90,90,90 - - 3.80 A 24177
Br-In-S InSBr CdCl2,hR9,166 R-3m 0.3832,0.3832,1.875,90,90,120 - - 4.74 A 18724
Br-In-S In5S5Br In5S5Br,oP22,31 Pmn21 0.39201,0.90562,1.4812,90,90,90 - brown 5.14 X 43977
Br-In-Se InSeBr CdCl2,hR9,166 R-3m 0.3935,0.3935,1.913,90,90,120 - brown 5.31 X 1771
Br-In-Se In5Se 5Br In5S5Br,oP22,31 Pmn21 0.40932,0.93331,1.5251,90,90,90 - brown dark 5.98 X 43977
Br-In-Sm Sm2 InBr5 U2PbSe5,mP32,14 P121/c1 0.93769,0.82804,1.32606,90,90.012,90 - - 5.26 A 32489
Br-In-Sn InSnBr3 ht InSnCl3,tI80,140 I4/mcm 1.2497,1.2497,1.6411,90,90,90 - yellow 4.91 X 36245
Br-In-Sn InSn2Br5 [NH4]Pb2Br5,tI32,140 I4/mcm 0.8285,0.8285,1.4438,90,90,90 - yellow 5.04 X 19685
Br-In-Sn In3SnBr5 Tl3PbBr5,oP36,19 P212121 0.8515,0.8945,1.544,90,90,90 - red 4.87 A 31090
Br-In-Sr Sr2InBr5 U2PbSe5,mP32,14 P121/c1 0.93796,0.82784,1.32693,90,90.001,90 - - 4.45 A 32489
Br-In-Te InTeBr InTeBr,mP12,14 P121/c1 0.735,0.7577,0.8343,90,117.61,90 - brown 5.20 X 13581
Br-In-Te In3 Te 3Br rt Al3Te3I,oP28,62 Pnma 1.1336,0.4291,1.9535,90,90,90 - red violet 5.64 A 24326
Br-In-Th ThIn2Br6 K2ZrF6,mS36,15 C12/c1 0.87912,1.467,0.90464,90,91.153,90 - white 5.36 X 30091
Br-In-Ti Ti2In3Br9 Ti2In3Br9,hP30,194 P63/mmc 0.7382,0.7382,1.8139,90,90,120 - green dark 4.50 X 29931
Br-In-Ti Ti3In4Br12 Ti3In4Br12,hR57,166 R-3m 0.73992,0.73992,3.6673,90,90,120 perovskite family black 4.47 X 58381
Br-In-Yb YbInBr3 UFeS3,oS20,63 Cmcm 0.42798,1.4064,1.09342,90,90,90 - - 5.32 A 32489
Br-In-Zr ZrIn2Br6 K2SnCl6,tP18,128 P4/mnc 0.74044,0.74044,1.06968,90,90,90 - - 4.53 X 30143
Br-Ir-La La3IrBr3 Ca3PI3,cI56,214 I4132 1.21738,1.21738,1.21738,90,90,90 - black 6.25 X 58230
Br-Ir-Pr Pr3IrBr3 Ca3PI3,cI56,214 I4132 1.1933,1.1933,1.1933,90,90,90 - - 6.68 A 28698
Br-Ir-Sc Sc12 Ir3Br16 Sc12 Ir3Br16,aP31,2 P-1 0.88872,1.0637,1.12344,116.964,102.019,101.745 - black 4.57 X 54137
Br-Ir-Tb Tb6IrBr10 Y6RuI10,aP17,2 P-1 0.73139,0.9098,0.9139,108.905,97.12,106.377 - black 6.02 X 59447
Br-Ir-Te IrTe 6Br3 RhTe 6Cl3,hR60,167 R-3c 1.4624,1.4624,0.9848,90,90,120 - - 6.54 X 59493
Br-Ir-Te IrTe 7Br7 IrTe 7Cl7,aP30,2 P-1 0.9524,1.01417,1.17939,67.957,65.619,67.967 - black 5.88 X 59727
Br-Ir-Y Y4IrBr6 Y4IrBr6,oF352,70 Fddd 1.1718,2.2361,4.4702,90,90,90 - black 4.66 X 31649
Br-Ir-Y Y5IrBr9 Y5IrBr9,tI240,88 I41/a 1.26986,1.26986,4.511,90,90,90 - black 4.95 X 31649
Br-K-La K2LaBr5 rt K2PrCl5,oP32,62 Pnma 1.336,0.9272,0.8462,90,90,90 - - 3.91 A 18593
Br-K-Mn KMnBr3 [NH4]CdCl3,oP20,62 Pnma 0.9185,0.4026,1.548,90,90,90 - rose 3.87 A 7051
Br-K-Mn K4MnBr6 K4CdCl6,hR66,167 R-3c 1.268,1.268,1.553,90,90,120 - rose 3.18 A 7051
Br-K-Mo KMo 3Br7 KW3Br7,cP90,201 Pn-3 1.38,1.38,1.38,90,90,90 - orange 4.48 X 47732
Br-K-Mo K2MoBr4 [NH4]2MoBr4,tI28,139 I4/mmm 1.0126,1.0126,0.7717,90,90,90 - - 4.14 A 10260
Br-K-Mo K3Mo2Br9 K3W2Cl9,hP28,176 P63/m 0.74808,0.74808,1.75678,90,90,120 - - 4.01 X 20385
Br-K-Nb K2Nb3Br9 K2Nb3Cl9,mS56,12 C12/m1 1.0427,1.7222,0.99314,90,114.669,90 - black 4.41 X 17802
Br-K-Nd KNd2Br5 U2PbSe5,mP32,14 P121/c1 0.93671,0.8349,1.33106,90,90.62,90 - - 4.64 A 28129
Br-K-Nd K1.5 Nd1.5 Br5 K2PrCl5,oP32,62 Pnma 1.32988,0.92731,0.83618,90,90,90 - black green 4.34 X 24621
Br-K-O K[BrO3] K[BrO3],hR15,160 R3m 0.60136,0.60136,0.81594,90,90,120 perovskite family - 3.26 X 29635
Br-K-O K[BrO4] Ba[SO4],oP24,62 Pnma 0.893,0.5921,0.7488,90,90,90 - - 3.07 X 4618
Br-K-O K3BrO CaTiO3,cP5,221 Pm-3m 0.5213,0.5213,0.5213,90,90,90 perovskite family - 2.50 X 25518
Br-K-O K4Br2O K2NiF4,tI14,139 I4/mmm 0.5145,0.5145,1.6527,90,90,90 high-Tc family yellow 2.52 X 23131
Br-K-Os K2OsBr6 K2PtCl6,cF36,225 Fm-3m 1.03373,1.03373,1.03373,90,90,90 fluorite family - 4.50 A 16684
Br-K-Pb KPb2Br5 mon U2PbSe5,mP32,14 P121/c1 0.9256,0.8365,1.3025,90,90,90 - - 5.62 X 45262
Br-K-Pb KPb2Br5 tet [NH4]Pb2Br5,tI32,140 I4/mcm 0.814,0.814,1.41,90,90,90 - - 6.06 A 131
Br-K-Pd K2PdBr4 K2PtCl4,tP7,123 P4/mmm 0.7409,0.7409,0.4309,90,90,90 - brown dark 3.54 X 8812
Br-K-Pd K2PdBr6 K2PtCl6,cF36,225 Fm-3m 1.0226,1.0226,1.0226,90,90,90 fluorite family - 4.12 A 48151
Br-K-Pr K2PrBr5 K2PrCl5,oP32,62 Pnma 1.3322,0.9186,0.8422,90,90,90 - green light 3.99 X 18593
Br-K-Pt K2PtBr4 K2PtCl4,tP7,123 P4/mmm 0.735,0.735,0.4326,90,90,90 - - 4.21 X 8195
Br-K-Pt K2PtBr6 K2PtCl6,cF36,225 Fm-3m 1.0278,1.0278,1.0278,90,90,90 fluorite family - 4.60 A 20666
Br-K-Re K2ReBr6 K2PtCl6,cF36,225 Fm-3m 1.0445,1.0445,1.0445,90,90,90 fluorite family red dark 4.34 X 386
Br-K-Se K2SeBr6 lt1 K2SnCl6,tP18,128 P4/mnc 0.7313,0.7313,1.0474,90,90,90 - - 3.77 A 23620
Br-K-Se K2SeBr6 lt2 *,oS36,63 Cmcm 1.032,1.035,1.0475,90,90,90 - - - N 13517
Br-K-Se K2SeBr6 lt3 K2TeBr6,mP18,14 P121/c1 0.7265,0.7265,1.2682,90,124.609,90 - - 3.84 A 23620
Br-K-Se K2SeBr6 rt K2PtCl6,cF36,225 Fm-3m 1.04224,1.04224,1.04224,90,90,90 fluorite family red dark 3.73 X 23620
Br-K-Sm KSm2Br5 U2PbSe5,mP32,14 P121/c1 0.9298,0.8282,1.327,90,90.1,90 - - 4.81 A 13767
Br-K-Sm K2SmBr5 K2PrCl5,oP32,62 Pnma 1.3266,0.9156,0.8398,90,90,90 - - 4.09 A 18593
Br-K-Sn KSn2Br5 [NH4]Pb2Br5,tI32,140 I4/mcm 0.83673,0.83673,1.44664,90,90,90 - - 4.43 X 43958
Br-K-Sn K2SnBr6 K2TeBr6,mP18,14 P121/c1 0.7442,0.7427,1.29496,90,124.898,90 - yellow 3.83 X 12089
Br-K-Sr KSr2Br5 U2PbSe5,mP32,14 P121/c1 0.9297,0.82974,1.32767,90,90.216,90 - - 3.98 A 32489
Br-K-Tb K0.951 Tb0.016 Br NaCl,cF8,225 Fm-3m 0.65897,0.65897,0.65897,90,90,90 rocksalt family - 2.78 X 54747
Br-K-Tc K2TcBr6 K2PtCl6,cF36,225 Fm-3m 1.0354,1.0354,1.0354,90,90,90 fluorite family - 3.92 A 6960
Br-K-Te K2TeBr6 ht1 K2SnCl6,tP18,128 P4/mnc 0.758,0.758,1.0812,90,90,90 - orange red 3.66 X 17328
Br-K-Te K2TeBr6 ht2 K2PtCl6,cF36,225 Fm-3m 1.078,1.078,1.078,90,90,90 fluorite family orange red 3.63 X 17328
Br-K-Te K2TeBr6 rt K2TeBr6,mP18,14 P121/c1 0.74908,0.75492,1.30272,90,124.793,90 - orange red 3.76 X 22162
Br-K-Ti KTiBr3 KTiCl3,hP30,173 P63 1.2775,1.2775,0.6344,90,90,120 - black 3.63 X 45743
Br-K-Ti K3Ti2Br9 K3W2Cl9,hP28,176 P63/m 0.7429,0.7429,1.8382,90,90,120 - - 3.52 X 58381
Br-K-Tl KTlBr4 rt KTlBr4,oP24,52 Pnna 0.7952,1.036,1.0421,90,90,90 - - 4.36 X 16662
Br-K-Tl K0.4 Tl0.6 Br NaCl,cF8,225 Fm-3m 0.6631,0.6631,0.6631,90,90,90 rocksalt family - 4.97 X 6952
Br-K-Tm KTmBr3 GdFeO3,oP20,62 Pnma 0.80668,1.10542,0.76069,90,90,90 perovskite family - 4.38 A 26873
Br-K-U K2UBr5 Y2HfS5,oP32,62 Pnma 1.3212,0.91642,0.83619,90,90,90 - blue violet 4.70 X 27660
348 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-K-W KW3Br7 KW3Br7,cP90,201 Pn-3 1.3808,1.3808,1.3808,90,90,90 - red 5.80 X 35201


Br-K-Yb KYbBr3 GdFeO3,oP20,62 Pnma 0.8044,1.10317,0.75906,90,90,90 perovskite family - 4.46 A 26873
Br-K-Zn K2ZnBr4 ht [NH4]2ZnCl4,oP44,62 Pnma 0.9513,0.7712,1.3344,90,90,90 - colorless 3.14 X 28647
Br-K-Zn K2ZnBr4 lt Eu2GeS4,mP14,4 P1211 0.7216,0.7417,0.8998,90,108.89,90 - colorless 3.38 X 42027
Br-K-Zn K2ZnBr4 rt K2ZnBr4,mP22,11 P121/m1 0.7218,0.7499,0.9181,90,108.99,90 - colorless 3.27 X 26463
Br-La-N La3Br6N Ce3NCl6,oP80,61 Pbca 1.1212,1.1828,1.7176,90,90,90 - yellow pale 5.31 X 34381
Br-La-Ni La3NiBr3 La3NiBr3,tI56,98 I4122 1.21758,1.21758,1.1744,90,90,90 - black 5.46 X 53465
Br-La-Ni La8Ni4Br7 La8Ni4Br7 ,mS38,12 C12/m1 2.9528,0.40249,0.8708,90,94.515,90 - - 6.13 X 50384
Br-La-O LaBrO PbClF,tP6,129 P4/nmm 0.4159,0.4159,0.7392,90,90,90 - - 6.10 X 19382
Br-La-Os La48Os8Br81 La48Os8Br81,mP548,14 P121/c1 3.3076,2.3466,2.3537,90,110.701,90 - - 5.70 X 37240
Br-La-P La2PBr2 Ta2CS2,hP5,164 P-3m1 0.4236,0.4236,1.0121,90,90,120 - - 4.95 X 49734
Br-La-P La3PBr3 Ca3PI3,cI56,214 I4132 1.1956,1.1956,1.1956,90,90,90 - - 5.34 A 39490
Br-La-Rb Rb2LaBr5 rt K2PrCl5,oP32,62 Pnma 1.369,0.9446,0.8621,90,90,90 - - 4.23 A 18593
Br-La-Rb Rb3LaBr6 ht [NH4]3FeF6,cF40,225 Fm-3m 1.1977,1.1977,1.1977,90,90,90 perovskite family - 3.38 A 24849
Br-La-Rb Rb3LaBr6 m K3MoCl6,mP40,14 P121/c1 1.4416,0.8413,1.3809,90,108.85,90 - - 3.67 A 24849
Br-La-Ru La3RuBr3 Ca3PI3,cI56,214 I4132 1.21247,1.21247,1.21247,90,90,90 - black 5.65 X 58230
Br-La-S LaSBr CeSI,oP24,61 Pbca 0.702,1.399,0.719,90,90,90 - white 4.72 A 5179
Br-La-Sb La5Sb3Br CuHf5Sn3,hP18,193 P63 /mcm 0.9602,0.9602,0.67331,90,90,120 AlB2 family black 7.04 X 36169
Br-La-Sb La7Sb11Br4 La7Sb11Br4,oP88,62 Pnma 3.0949,0.43042,1.9675,90,90,90 - - 6.67 X 45730
Br-La-Sb La9Sb16Br3 La9Sb16Br3,hP56,176 P63 /m 2.1232,2.1232,0.4323,90,90,120 - - 6.77 X 44685
Br-La-Si La3SiBr3 Ca3PI3,cI56,214 I4132 1.21563,1.21563,1.21563,90,90,90 - golden 5.06 X 39490
Br-La-Si La6Si3Br5 *,mS*,12 C12/m1 1.8892,0.4334,1.4537,90,130.06,90 - - - N 36629
Br-La-Si La6Si7Br3 La6Si7Br3,oP32,59 Pmmn 0.41293,1.6869,1.18515,90,90,90 - bronze 5.11 X 36629
Br-La-Sn La5Sn3Br CuHf5Sn3,hP18,193 P63 /mcm 0.9637,0.9637,0.6931,90,90,120 AlB2 family - 6.74 X 40288
Br-La-Te La3Te4Br La3Te4Br,oP32,62 Pnma 1.6343,0.43497,1.42664,90,90,90 - black 6.60 X 56023
Br-Li-Lu Li3LuBr6 Li3ErBr6,mS22,12 C12/m1 0.6841,1.1829,0.6814,90,109.94,90 - - 4.33 A 33747
Br-Li-Mg LiMg0.5 Br2 ht LiTiO2,cF64,227 Fd-3m 1.12455,1.12455,1.12455,90,90,90 rocksalt family - 3.34 X 28330
Br-Li-Mg Li2MgBr4 rt Mn2SnS4,oS14,65 Cmmm 0.77794,1.10425,0.38655,90,90,90 - - 3.58 X 28330
Br-Li-Mg Li6MgBr8 Mg6MnO8 ,cF60,225 Fm-3m 1.098,1.098,1.098,90,90,90 rocksalt family - 3.54 X 28330
Br-Li-Mn Li0.5 Mn0.25 Br ht1 Zr0.65 S,cF64,227 Fd-3m 1.12372,1.12372,1.12372,90,90,90 rocksalt family - 3.64 X 23865
Br-Li-Mn Li0.5 Mn0.25 Br ht2 NaCl,cF8,225 Fm-3m 0.56731,0.56731,0.56731,90,90,90 rocksalt family - 3.53 X 23865
Br-Li-Mn Li2MnBr4 rt orth1 Li2MnBr4 ,oI28,74 Imma 0.7768,0.77827,1.10728,90,90,90 - - 3.85 X 25484
Br-Li-Mn Li2MnBr4 rt orth2 Mn2SnS4,oS14,65 Cmmm 0.77778,1.10658,0.38818,90,90,90 - - 3.86 X 25484
Br-Li-Mn Li2MnBr4 rt tet CdMn2O4,tI28,141 I41/amd 0.7764,0.7764,1.108,90,90,90 spinel family - 3.86 A 18208
Br-Li-N Li10BrN3 Li10BrN3,hP14,187 P-6m2 0.7413,0.7413,0.38657,90,90,120 - - 1.73 X 31217
Br-Li-N Li5Br2N Li5Br2N,oI16,71 Immm 0.39014,0.60379,1.1813,90,90,90 - - 2.49 X 31233
Br-Li-N Li6Br3N lt1 Na3AlF6,mP20,14 P121/c1 0.62659,0.62984,1.09454,90,125.093,90 - - 2.78 X 33263
Br-Li-N Li6Br3N lt2 Li6Br3N,cF112,225 Fm-3m 0.8939,0.8939,0.8939,90,90,90 - - 2.75 X 33263
Br-Li-N Li6Br3N rt Li6Br3N,oI160,73 Ibca 1.15005,1.15835,2.24978,90,90,90 - - 2.62 X 33199
Br-Li-N Li6Br3N tet Li6Br3N,tI24,139 I4/mmm 0.58441,0.58441,1.10894,90,90,90 - - 2.59 X 33199
Br-Li-O Li[BrO3] *,oP*,* - 0.506,0.599,0.786,90,90,90 - - - N 1619
Br-Li-O Li3BrO CaTiO3,cP5,221 Pm-3m 0.4056,0.4056,0.4056,90,90,90 perovskite family colorless 2.90 X 23079
Br-Li-O Li7Br3O2 Sr3Ti2O7,tI24,139 I4/mmm 0.4035,0.4035,2.161,90,90,90 Ruddlesden-Popper colorless 3.02 X 23079
Br-Li-Rb RbLiBr2 RbLiCl2,oS16,63 Cmcm 0.4364,1.512,0.7654,90,90,90 - colorless 3.32 X 17594
Br-Li-Sm LiSm2Br5 U2FeS5,mS32,15 C12/c1 1.6589,0.70616,0.78613,90,95.855,90 - - 5.13 A 32526
Br-Li-Sm Li3SmBr6 Li3ErBr6,mS22,12 C12/m1 0.6984,1.2129,0.6877,90,109.77,90 - - 3.94 A 33747
Br-Li-Tb Li3TbBr6 Li3ErBr6,mS22,12 C12/m1 0.6942,1.2047,0.6863,90,109.89,90 - - 4.06 A 33747
Br-Li-Tm LiTm2Br5 U2FeS5,mS32,15 C12/c1 1.64537,0.68867,0.75688,90,95.533,90 - - 5.79 A 32526
Br-Li-Tm Li3TmBr6 Li3ErBr6,mS22,12 C12/m1 0.6876,1.1884,0.6833,90,109.64,90 - - 4.23 A 33747
Br-Li-U Li2UBr6 ht mon1 Li2UBr6,mS26,12 C12/m1 0.70442,1.2134,0.68977,90,110.29,90 - - 4.39 X 35090
Br-Li-U Li2UBr6 ht mon2 Li3ErBr6,mS22,12 C12/m1 0.7184,1.226,0.7065,90,111.11,90 - - 4.18 X 35090
Br-Li-U Li2UBr6 rt trig Li2UBr6,hP18,162 P-31m 0.68893,0.68893,1.26462,90,90,120 - - 4.67 X 35090
Br-Li-W LiW6Br14 HgMo6Cl14 ,cP84,201 Pn-3 1.331,1.331,1.331,90,90,90 Chevrel phase - 6.28 A 29929
Br-Li-Y Li3YBr6 Li3ErBr6,mS22,12 C12/m1 0.6926,1.1959,0.6843,90,109.54,90 - - 3.66 A 33747
Br-Li-Yb Li3YbBr6 Li3ErBr6,mS22,12 C12/m1 0.6849,1.1852,0.6812,90,109.75,90 - - 4.30 A 33747
Br-Li-Zn Li2ZnBr4 Mg2[SiO4],oP28,62 Pnma 1.36041,0.78847,0.64707,90,90,90 - - 3.82 X 28214
Br-Lu-Na Na3LuBr6 rt Na3AlF6,mP20,14 P121/c1 0.7148,0.7636,1.27674,90,123.484,90 - - 4.13 A 31081
Br-Lu-O LuBrO PbClF,tP6,129 P4/nmm 0.37646,0.37646,0.8354,90,90,90 - orange 7.60 X 47904
Br-Lu-S LuSBr FeClO,oP6,59 Pmmn 0.3955,0.5274,0.8085,90,90,90 - white 5.65 X 8078
Br-Mg-Tc MgTcBr6 *,oP16,59 Pmmn 0.73,1.032,0.74,90,90,90 - - - N 20671
Br-Mn-O Mn15Br6O20 Mn15Br6O20,tI82,139 I4/mmm 0.9327,0.9327,1.3104,90,90,90 - black 4.73 X 26511
Br-Mn-Rb RbMnBr3 ht BaNiO3,hP10,194 P63 /mmc 0.756,0.756,0.635,90,90,120 perovskite family rose 4.02 X 22168
Br-Mn-Rb RbMnBr3 rt KNiCl3,hP30,185 P63 cm 1.2924,1.2924,0.6547,90,90,120 perovskite family - 4.00 X 15013
Br-Mn-Rb Rb2MnBr4 ht K2[SO4],oP28,62 Pnma 0.9721,0.778,1.3507,90,90,90 - - 3.55 A 11062
Br-Mn-Rb Rb2MnBr4 rt K2NiF4,tI14,139 I4/mmm 0.537,0.537,1.732,90,90,90 high-Tc family pink 3.63 X 12200
Br-Mn-Rb Rb3MnBr5 ht Cs3CoCl5,tI36,140 I4/mcm 0.9213,0.9213,1.5332,90,90,90 - - 3.63 A 11062
Br-Mn-Rb Rb3Mn2Br7 Sr3Ti2O7,tI24,139 I4/mmm 0.537,0.537,2.78,90,90,90 Ruddlesden-Popper - 3.83 X 14989
Br-Mn-Rb Rb4MnBr6 rt K4CdCl6,hR66,167 R-3c 1.2993,1.2993,1.6256,90,90,120 - - 3.67 A 11062
Br-Mn-Sc Sc4.89 MnBr7 Sc4.75 OsBr7,cP52,215 P-43m 1.0941,1.0941,1.0941,90,90,90 - black 4.23 X 33064
Br-Mn-Tb Tb7MnBr12 Sc7NCl12,hR60,148 R-3 1.4374,1.4374,1.01328,90,90,120 - black 5.84 X 59447
Br-Mn-Th Th6MnBr15 Zr6CoCl15 ,cI44,229 Im-3m 1.15085,1.15085,1.15085,90,90,90 - black 5.76 A 25535
Br-Mn-W W6MnBr14 HgMo6Cl14 ,cP84,201 Pn-3 1.323,1.323,1.323,90,90,90 Chevrel phase - 6.53 A 29929
Br-Mo-Na NaMo6Br13 NaMo6Cl13 ,aP40,2 P-1 0.9299,0.9443,1.448,96.55,101.42,115.32 - orange 4.95 X 42285
Br-Mo-O MoBr2O2 MoBr2O2,mS20,9 C1c1 1.52233,0.39061,0.77109,90,104.394,90 - red 4.30 X 57390
Br-Mo-O MoBr3O MoBr3O,tP24,136 P42 /mnm 1.136,1.136,0.3948,90,90,90 - - 4.58 X 4966
Br-Mo-Pb Mo6PbBr14 HgMo6Cl14 ,cP84,201 Pn-3 1.3504,1.3504,1.3504,90,90,90 Chevrel phase orange 5.13 X 26907
Br-Mo-Rb RbMo3Br7 RbMo3Br7 ,mS92,15 C12/c1 2.0376,1.5297,0.9757,90,115.969,90 Chevrel phase yellow 4.53 X 45207
Br-Mo-Rb Rb2MoBr6 K2PtCl6,cF36,225 Fm-3m 1.048,1.048,1.048,90,90,90 fluorite family - 4.31 A 4231
Handbook of Inorganic Substances – Edition 2015 : Data 349

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Mo-Rb Rb3Mo 2Br9 Cs3Cr2Cl9,hP28,194 P63/mmc 0.75217,0.75217,1.793,90,90,120 perovskite family - 4.41 X 20385
Br-Mo-S MoSBr MoSBr,cF48,216 F-43m 0.9945,0.9945,0.9945,90,90,90 - - 5.62 X 8946
Br-Mo-S Mo2 SBr2 Mo2 SBr2,oS60,63 Cmcm 1.725,0.66,1.1929,90,90,90 Chevrel phase black 5.63 X 15857
Br-Mo-S Mo3 SBr4 Mo3 SeI4,hP96,173 P63 1.5298,1.5298,1.1706,90,90,120 Chevrel phase brown 5.37 A 16245
Br-Mo-S Mo3 S3Br Mo3 S3Br,hR42,148 R-3 0.95452,0.95452,1.03571,90,90,120 Chevrel phase - 5.66 X 12599
Br-Mo-S Mo6 SBr10 Nb6I11,oP68,56 Pccn 1.023,1.435,1.224,90,90,90 Chevrel phase - 5.20 A 7328
Br-Mo-Se Mo3 Se3Br Mo3 S3Br,hR42,148 R-3 0.98,0.98,1.09,90,90,120 Chevrel phase - 6.64 A 10830
Br-Mo-Se Mo6 SeBr10 Nb6I11,oP68,56 Pccn 1.028,1.428,1.229,90,90,90 Chevrel phase - 5.35 A 7328
Br-Mo-Te MoTe 4Br TaTe 4I,aP12,2 P-1 0.6821,0.7836,0.7931,113.25,102.97,101.37 - gray silver 6.34 X 32089
Br-Mo-Te MoTe 6Br3 MoTe 6Br3,aP40,2 P-1 0.8372,1.1414,1.442,81.7,83.07,74.34 - gray silver 5.59 X 32089
Br-Mo-Te Mo6 TeBr10 Nb6I11,oP68,56 Pccn 1.044,1.435,1.235,90,90,90 Chevrel phase - 5.39 A 7328
Br-Mo-Tl TlMo 3Br7 KW3Br7,cP90,201 Pn-3 1.3813,1.3813,1.3813,90,90,90 - orange 5.30 X 44094
Br-N-O Br[NO3] Br[NO3],oP20,19 P212121 0.4032,0.6849,1.2014,90,90,90 - - 2.84 X 33954
Br-N-P PBr2N orth PBr2 N,oP48,62 Pnma 1.4463,1.341,0.6601,90,90,90 - - 3.19 X 4992
Br-N-P PBr2N tet PNCl2,tP32,86 P42/n 1.1187,1.1187,0.6189,90,90,90 - colorless 3.51 X 6433
Br-N-P PBr2N tricl PBr2 N,aP40,2 P-1 0.9352,1.0329,1.18879,101.18,112.692,93.78 - - 3.31 X 6720
Br-N-S [S4N3][Br3] [S4N3][Br3],mP40,14 P121/c1 0.6105,0.8792,1.806,90,91.58,90 - - 2.81 X 12326
Br-N-Se Se2Br3N Se2Br3N,oP48,29 Pca21 1.347,0.8405,1.1844,90,90,90 - brown 4.08 X 31479
Br-N-Sr Sr2BrN NaFeO2,hR12,166 R-3m 0.39324,0.39324,2.1838,90,90,120 rocksalt family gray 4.58 X 46950
Br-N-Th ThBrN PbClF,tP6,129 P4/nmm 0.411,0.411,0.7468,90,90,90 - white 8.58 X 4307
Br-N-Ti TiBrN FeClO,oP6,59 Pmmn 0.3349,0.3927,0.8332,90,90,90 - black 4.30 X 2410
Br-N-U UBrN PbClF,tP6,129 P4/nmm 0.3944,0.3944,0.795,90,90,90 - brown dark 8.91 X 4892
Br-N-Zr ZrBrN ht SmSI,hR18,166 R-3m 0.36403,0.36403,2.927,90,90,120 - green dark 5.49 X 40454
Br-N-Zr ZrBrN rt FeClO,oP6,59 Pmmn 0.3581,0.4116,0.8701,90,90,90 - yellow 4.79 X 2410
Br-Na-O Na[BrO3] Na[ClO3]-b,cP20,198 P213 0.67072,0.67072,0.67072,90,90,90 - - 3.32 X 10462
Br-Na-O Na4Br2O K2NiF4,tI14,139 I4/mmm 0.4521,0.4521,1.4908,90,90,90 high-Tc family colorless 2.92 X 24305
Br-Na-Sc Na3ScBr6 Na3CrCl6,hP20,163 P-31c 0.72895,0.72895,1.30929,90,90,120 - - 3.27 X 32414
Br-Na-Sm Na3SmBr6 Na3GdCl6,hR36,148 R-3 0.7408,0.7408,1.9989,90,90,120 - - 3.66 X 31081
Br-Na-Tb Na3TbBr6 rt Na3AlF6,mP20,14 P121/c1 0.7242,0.7737,1.29203,90,123.378,90 - - 3.89 A 31081
Br-Na-Tm Na3TmBr6 rt Na3AlF6,mP20,14 P121/c1 0.7175,0.7666,1.28121,90,123.455,90 - - 4.05 A 31081
Br-Na-U Na2UBr6 rt Li2MnF6,hP27,164 P-3m1 1.24368,1.24368,0.66653,90,90,120 - - 4.26 X 13423
Br-Na-Y Na3YBr6 rt Na3AlF6,mP20,14 P121/c1 0.7213,0.7699,1.28811,90,123.451,90 - - 3.55 X 31081
Br-Na-Yb Na3YbBr6 rt Na3AlF6,mP20,14 P121/c1 0.716,0.7649,1.27877,90,123.468,90 - - 4.10 A 31081
Br-Na-Zn Na2ZnBr4 Mg2 [SiO4],oP28,62 Pnma 1.44631,0.85302,0.67661,90,90,90 - - 3.43 X 28214
Br-Nb-O NbBr2O NbI2 O,mS16,5 C121 1.3833,0.39079,0.7023,90,105.026,90 - black 4.87 X 47639
Br-Nb-O NbBr3O tet1 MoBr3O,tP24,136 P42/mnm 1.1593,1.1593,0.3945,90,90,90 - brown 4.37 X 51476
Br-Nb-O NbBr3O tet2 NbCl3O,tP20,113 P-421m 1.1635,1.1635,0.3953,90,90,90 - brown 4.33 X 51476
Br-Nb-Rb RbNb4Br11 CsNb4Cl11,oP32,51 Pmma 1.6995,0.7267,0.6945,90,90,90 - black 5.17 X 55510
Br-Nb-Rb Rb2Nb3Br9 K2Nb3Cl9,mS56,12 C12/m1 1.1173,1.6824,1.03164,90,117.895,90 - - 4.53 A 31107
Br-Nb-Rb Rb3Nb2Br9 Cs3Cr2Cl9,hP28,194 P63/mmc 0.7587,0.7587,1.797,90,90,120 perovskite family black 4.31 X 31163
Br-Nb-S NbSBr MoSBr,cF48,216 F-43m 1.0193,1.0193,1.0193,90,90,90 - - 5.14 A 14543
Br-Nb-S NbS2Br2 ht NbS2Cl2,mS20,12 C12/m1 0.654,1.132,0.691,90,110.54,90 - brown red 4.39 A 12550
Br-Nb-S NbS2Br2 rt NbSe2Cl2,aP10,2 P-1 0.6528,0.65538,0.7254,90.812,111.62,119.513 - brown red 4.32 A 12550
Br-Nb-S Nb3 SBr7 Nb3SBr7,hP11,156 P3m1 0.71012,0.71012,0.6304,90,90,120 - black 5.25 X 30719
Br-Nb-S Nb4 S16Br *,aP42,2 P-1 1.3405,1.7497,1.7843,83.535,75.54,73.509 - - - N 17191
Br-Nb-Se NbSeBr MoSBr,cF48,216 F-43m 1.0368,1.0368,1.0368,90,90,90 - - 6.00 A 14543
Br-Nb-Se NbSeBr3 NbSeBr3,mP20,13 P12/c1 0.66239,0.6901,1.2539,90,98.98,90 - gray 4.83 X 28612
Br-Nb-Se NbSe 2Br2 ht NbS2Cl2,mS20,12 C12/m1 0.6662,1.1677,0.7083,90,111.82,90 - black 5.33 X 21154
Br-Nb-Se NbSe 2Br2 rt NbSe2Cl2,aP10,2 P-1 0.6688,0.67202,0.7402,67.872,68.4,60.314 - black 5.23 X 21154
Br-Nb-Se Nb2 Se8Br Nb2Se8Br,mP92,14 P121/c1 1.2862,1.3862,1.6029,90,127.7,90 - - 5.27 X 20331
Br-Nb-Se Nb3 Se10Br3 mon1 Nb3Se10Br3,mP64,11 P121/m1 0.7305,1.9265,1.21131,90,94.48,90 - - 5.11 X 21139
Br-Nb-Se Nb3 Se10Br3 mon2 Nb3Se10Br3,mP128,14 P121/c1 1.937,1.3026,1.3598,90,90.062,90 - black 5.06 X 19249
Br-Nb-Se Nb3 Se12Br *,mP192,14 P121/c1 1.293,2.4937,2.26098,90,108.38,90 - - - N 17191
Br-Nb-Se Nb3 Se5Br7 Nb3Se5Cl7,mP30,11 P121/m1 0.7621,1.2833,0.8069,90,106.21,90 - black blue 5.40 A 12516
Br-Nb-Se Nb4 Se16Br *,mP252,14 P121/c1 1.293,2.4258,2.23102,90,108.309,90 - - - N 17191
Br-Nb-Se Nb6 Se20Br4 Nb6Se18(Se0.67 Br0.33)3Br3,oI480,73 Ibca 1.4205,2.3722,3.8243,90,90,90 - - 5.06 X 20419
Br-Nb-Te NbTeBr3 NbSeBr3,mP20,13 P12/c1 0.667,0.7135,1.2597,90,97.64,90 - gray 5.14 X 16639
Br-Nb-Tl Tl2Nb3Br9 K2Nb3Cl9,mS56,12 C12/m1 1.114,1.625,1.0067,90,117.68,90 - black 5.79 X 31162
Br-Nd-O NdBrO PbClF,tP6,129 P4/nmm 0.4024,0.4024,0.7597,90,90,90 - - 6.48 X 2606
Br-Nd-Rb RbNd2Br5 U2PbSe5,mP32,14 P121/c1 0.93996,0.83886,1.33491,90,90.609,90 - - 4.88 A 28129
Br-Nd-Rb Rb2NdBr5 K2PrCl5,oP32,62 Pnma 1.3642,0.9326,0.8592,90,90,90 - - 4.34 A 18593
Br-Nd-S NdSBr NdSBr,mP12,14 P121/c1 0.6941,0.7046,0.6906,90,99.28,90 - - 5.11 X 7115
Br-Nd-S Nd3 S2Br5 Nd3S2Br5,oP40,62 Pnma 0.7186,2.239,0.6814,90,90,90 - violet faint 5.43 X 17758
Br-Nd-S Nd4 S3Br6 Nd4S3Br6,mS52,15 C12/c1 2.9346,0.6837,0.7156,90,94.65,90 - red 5.35 X 13055
Br-Nd-Sr Sr4NdBr11 *,oP*,62 Pnma 0.721,3.518,0.6768,90,90,90 - - - N 21984
Br-Nd-Sr Sr5NdBr13 *,mS*,15 C12/c1 4.51235,0.7177,0.7642,90,98.639,90 - - - N 21984
Br-Nd-Ta NdTa6Br18 LuNb6Cl18,hR75,148 R-3 0.9751,0.9751,2.6729,90,90,120 - - 6.04 A 30658
Br-Ni-Rb RbNiBr3 BaNiO3,hP10,194 P63/mmc 0.7308,0.7308,0.6201,90,90,120 perovskite family brown red 4.45 A 8343
Br-Ni-Sc Sc7NiBr12 Sc7NCl12,hR60,148 R-3 1.3809,1.3809,0.9461,90,90,120 - black 4.25 X 59447
Br-Ni-Tb Tb6NiBr10 Y6RuI10,aP17,2 P-1 0.72581,0.90458,0.90512,108.776,97.14,106.192 - black 5.73 X 59447
Br-Ni-Th Th6NiBr15 Zr6CoCl15,cI44,229 Im-3m 1.15143,1.15143,1.15143,90,90,90 - black 5.76 A 25535
Br-Ni-Y Y6NiBr10 Y6RuI10,aP17,2 P-1 0.72236,0.8992,0.90065,108.517,97.082,105.992 - black 4.45 X 59447
Br-O-P PBr3O PBr3 O,oP20,62 Pnma 0.9467,0.9938,0.6192,90,90,90 - colorless 3.27 X 5664
Br-O-Pa PaBr3O PaBr3O,mS20,12 C12/m1 1.6911,0.3871,0.9334,90,113.67,90 - - 5.78 X 8737
Br-O-Pb Pb[BrO3]2 Sr[ClO3]2,oF72,43 Fdd2 1.1651,1.2828,0.76254,90,90,90 - - 5.40 A 18641
Br-O-Pb Pb13 Br14O6 *,mS*,* - 1.67,0.592,2.,90,113.5,90 - - - N 574
Br-O-Pb Pb13 Br6O10 Pb13 Br6O10,mS116,15 C12/c1 1.6439,0.7163,2.394,90,98.39,90 - yellow 7.94 X 22968
Br-O-Pb Pb3Br2O2 Pb3Br2O2,oP28,62 Pnma 1.2244,0.5872,0.9799,90,90,90 - yellowish 7.67 X 51586
350 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-O-Pb Pb9Br10O4 Pb9Br10O4 ,tP46,85 P4/n 1.2282,1.2282,0.8323,90,90,90 - colorless 7.22 X 15928


Br-O-Pr PrBrO PbClF,tP6,129 P4/nmm 0.40671,0.40671,0.74669,90,90,90 - green light 6.37 X 55733
Br-O-Pu PuBrO PbClF,tP6,129 P4/nmm 0.4014,0.4014,0.7556,90,90,90 - - 9.27 X 322
Br-O-Rb Rb[BrO3] K[BrO3],hR15,160 R3m 0.62183,0.62183,0.8096,90,90,120 perovskite family - 3.92 X 29635
Br-O-Rb Rb[BrO4] Ba[SO4],oP24,62 Pnma 0.934,0.611,0.771,90,90,90 - - 3.46 A 19526
Br-O-Rb Rb3BrO CaTiO3,cP5,221 Pm-3m 0.5465,0.5465,0.5465,90,90,90 perovskite family red 3.58 X 31066
Br-O-Rb Rb4Br2O K2NiF4,tI14,139 I4/mmm 0.5444,0.5444,1.725,90,90,90 high-Tc family orange red 3.36 X 39460
Br-O-Rb Rb6Br4O K4CdCl6,hR66,167 R-3c 1.3078,1.3078,1.6466,90,90,120 - orange 3.47 X 39460
Br-O-S SBr2O SBr2O,oP32,29 Pca21 1.1512,0.407,1.8166,90,90,90 - - 3.24 X 21018
Br-O-Sb Sb4Br2O5 Sb4Cl2O5,mP22,14 P121/c1 0.6606,0.5143,1.346,90,97.89,90 - - 5.33 X 264
Br-O-Sb Sb8Br2O11 Sb8Cl2O11 ,aP84,2 P-1 1.04875,1.13375,1.39831,79.43,76.471,73.061 - colorless 5.67 X 47534
Br-O-Sc ScBrO FeClO,oP6,59 Pmmn 0.35505,0.39543,0.87,90,90,90 - brown 3.83 X 44245
Br-O-Sm SmBrO PbClF,tP6,129 P4/nmm 0.3945,0.3945,0.7904,90,90,90 - white 6.65 X 19382
Br-O-Sm Sm3BrO4 *,o**,* - 0.4141,1.1928,1.2049,90,90,90 - white ivory - N 2841
Br-O-Sm Sm4Br6O Ba4Cl6O,hP22,186 P63 mc 0.98589,0.98589,0.7535,90,90,120 - black 5.74 X 47637
Br-O-Sr Sr[BrO3]2 Sr[BrO3]2,mS36,9 C1c1 0.75768,1.1723,0.74231,90,120.263,90 - - 4.01 X 18641
Br-O-Sr Sr4Br6O Ba4Cl6O,hP22,186 P63 mc 0.9822,0.9822,0.75041,90,90,120 - colorless 4.48 X 51644
Br-O-Tb TbBrO PbClF,tP6,129 P4/nmm 0.3891,0.3891,0.8219,90,90,90 - - 6.80 A 2606
Br-O-Te Te6Br2O11 Te6Br2O11 ,oS76,63 Cmcm 1.1816,0.688,1.5823,90,90,90 - colorless 5.69 X 10541
Br-O-Ti TiBrO lt TiBrO,mP12,11 P121/m1 0.69366,0.37852,0.8501,90,90.,90 - brown light 4.28 X 44203
Br-O-Ti TiBrO rt FeClO,oP6,59 Pmmn 0.34853,0.37846,0.85252,90,90,90 - brown 4.25 X 45280
Br-O-Tl Tl[BrO3] K[BrO3],hR15,160 R3m 0.61488,0.61488,0.80497,90,90,120 perovskite family - 6.28 X 292
Br-O-Tl Tl[BrO4] Ba[SO4],oP24,62 Pnma 0.9182,0.6095,0.7649,90,90,90 - colorless 5.40 X 22107
Br-O-Tm TmBrO PbClF,tP6,129 P4/nmm 0.3806,0.3806,0.8288,90,90,90 - - 7.33 A 2606
Br-O-U UBrO PbClF,tP6,129 P4/nmm 0.4063,0.4063,0.7447,90,90,90 - - 9.02 A 14318
Br-O-U UBrO2 UBrO2,oS16,63 Cmcm 0.4106,2.02,0.398,90,90,90 - brown 7.04 X 10408
Br-O-V VBrO FeClO,oP6,59 Pmmn 0.338,0.3775,0.8425,90,90,90 - violet 4.54 X 4533
Br-O-V [VO]Br2 [VO]Cl2,oI8,71 Immm 0.3542,0.3827,1.2696,90,90,90 - brown 4.38 X 14714
Br-O-W WBr4O WCl4O,tI12,79 I4 0.9002,0.9002,0.3935,90,90,90 - black 5.41 X 16876
Br-O-Y Y0.975 BrO PbClF,tP6,129 P4/nmm 0.384,0.384,0.828,90,90,90 - - 4.97 A 26624
Br-O-Yb YbBrO PbClF,tP6,129 P4/nmm 0.37847,0.37847,0.8309,90,90,90 - white 7.50 X 2841
Br-O-Yb Yb3BrO4 *,o**,* - 0.401,1.1406,1.1507,90,90,90 - white ivory - N 2841
Br-O-Zr ZrBrO0.23 ZrBrO0.23 ,hR18,166 R-3m 0.35594,0.35594,2.8418,90,90,120 - - 5.59 X 16050
Br-Os-Pr Pr3OsBr3 Ca3PI3,cI56,214 I4132 1.197,1.197,1.197,90,90,90 - - 6.60 A 28698
Br-Os-Pr Pr6OsBr10 Y6RuI10,aP17,2 P-1 0.7614,0.9272,0.9486,109.83,97.09,107.48 - - 5.24 A 28698
Br-Os-Rb Rb3Os2Br9 K3W2Cl9,hP28,176 P63 /m 0.7401,0.7401,1.8098,90,90,120 - - 5.25 X 28681
Br-Os-Sc Sc13Os3Br16 Sc13Os3Br16,oP64,58 Pnnm 1.0581,1.8804,0.89549,90,90,90 - black 4.54 X 54137
Br-Os-Sc Sc4OsBr5 Y4RuI5,tP80,134 P42 /nnm 1.1116,1.1116,1.6124,90,90,90 - - 5.13 A 31649
Br-Os-Sc Sc4.72 OsBr7 Sc4.75 OsBr7,cP52,215 P-43m 1.10032,1.10032,1.10032,90,90,90 - black 4.80 X 33064
Br-Os-Se OsSe2Br12 OsSe2Br12 ,mS30,12 C12/m1 1.40464,1.1054,0.65034,90,112.264,90 - - 4.64 X 57276
Br-Os-Y Y4OsBr4 Y4OsBr4,mS36,15 C12/c1 1.2514,1.2381,0.6567,90,90.96,90 - black 5.65 X 26017
Br-P-Pr Pr3PBr3 Ca3PI3,cI56,214 I4132 1.1746,1.1746,1.1746,90,90,90 - - 5.68 A 36169
Br-P-S PS3Br PS3Br,tP56,114 P-42 1c 0.979,0.979,1.151,90,90,90 - yellow 2.49 X 2612
Br-P-Se P 4Se3Br2 P 4Se3Br2,mS72,15 C12/c1 1.2724,1.4732,1.2553,90,116.6,90 - yellow 3.29 X 55493
Br-P-Sn Sn12P 9.8Br4 Sn12P 9.65I4 ,cP78,223 Pm-3n 1.08123,1.08123,1.08123,90,90,90 - black 5.38 X 42974
Br-P-Y Y2PBr2 Ta2CS2,hR15,166 R-3m 0.39807,0.39807,2.925,90,90,120 - - 4.57 A 49734
Br-P-Zn Zn0.75P 0.25 Br0.75 ZnO,hP4,186 P63 mc 0.40094,0.40094,0.65566,90,90,120 adamantane structure - 4.25 X 32333
Br-Pb-Pd PdPb2Br6 PdPb2Cl6,mP18,14 P121/c1 0.9512,0.6584,0.8383,90,90.07,90 - brown red 6.33 X 32387
Br-Pb-Rb RbPb2Br5 [NH4]Pb2Br5,tI32,140 I4/mcm 0.84455,0.84455,1.45916,90,90,90 - - 5.74 X 43958
Br-Pb-Rb Rb4PbBr6 K4CdCl6,hR66,167 R-3c 1.3329,1.3329,1.6478,90,90,120 - - 4.04 X 21942
Br-Pb-S Pb7S2Br10 Pb7(S0.33Br0.67)6Br6,hP24,176 P63 /m 1.2273,1.2273,0.4319,90,90,120 - black blue 6.82 X 7799
Br-Pb-Se Pb4SeBr6 Pb4(Se0.14 Br0.86)7,oI22,44 Imm2 0.4361,1.578,0.972,90,90,90 - red 6.89 X 7799
Br-Pb-Tc TcPbBr6 *,oP16,59 Pmmn 0.735,1.041,0.745,90,90,90 - - - N 19510
Br-Pb-Th Th0.5 Pb0.5 Br3 Th0.5 Pb0.5I3,oS20,63 Cmcm 0.4228,1.268,0.9191,90,90,90 - - 6.19 A 28165
Br-Pb-Tl TlPb2Br5 U2PbSe5,mP32,14 P121/c1 0.9304,0.8336,1.3004,90,90.,90 - - 6.71 A 10409
Br-Pb-Tl Tl3PbBr5 ht Tl3PbCl5,tP36,76 P41 0.8903,0.8903,1.5486,90,90,90 - - 6.60 X 14261
Br-Pb-Tl Tl3PbBr5 rt Tl3PbBr5,oP36,19 P212121 0.8532,0.9063,1.5399,90,90,90 - - 6.80 X 14724
Br-Pd-Rb Rb2PdBr6 K2PtCl6,cF36,225 Fm-3m 1.025,1.025,1.025,90,90,90 fluorite family - 4.67 X 150
Br-Pd-Se PdSe2Br6 PdS2Cl6,aP9,2 P-1 0.4536,0.7238,0.8856,105.4,97.86,94.5 - red dark 4.48 X 33830
Br-Pd-Se PdSe6Br2 PdSe6Br2,aP9,2 P-1 0.43946,0.7605,0.7992,66.15,86.44,80.9 - black 5.09 X 48477
Br-Pd-Te PdTe2Br6 PdTe2Br6,mP72,14 P121/c1 1.5513,0.8855,1.8092,90,114.72,90 - black 4.95 X 33830
Br-Pd-Te Pd4Te3Br4 Pd4Te3Br4 ,aP22,2 P-1 0.8425,0.845,0.8648,82.55,73.36,88.8 - gray silver 6.41 X 48151
Br-Pd-Tl Tl3PdBr5 Tl3PdCl5,oP72,61 Pbca 0.7823,1.6812,1.7299,90,90,90 - brown dark 6.53 X 44083
Br-Pd-Y Y6PdBr10 Y6RuI10,aP17,2 P-1 0.7227,0.9001,0.90141,108.538,97.123,105.963 - black 4.60 X 59447
Br-Pr-Pt Pr3PtBr3 Ca3PI3,cI56,214 I4132 1.1992,1.1992,1.1992,90,90,90 - - 6.61 A 28698
Br-Pr-Rb Rb2PrBr5 K2PrCl5,oP32,62 Pnma 1.3658,0.9356,0.8595,90,90,90 - - 4.30 A 18593
Br-Pr-Rh Pr3RhBr3 Ca3PI3,cI56,214 I4132 1.1909,1.1909,1.1909,90,90,90 - - 6.02 A 28698
Br-Pr-Ru Pr3RuBr3 Pr3RuI3,mP14,11 P121/m1 0.8884,0.41872,1.1785,90,94.62,90 - - 5.80 A 28698
Br-Pr-Ru Pr6RuBr10 Y6RuI10,aP17,2 P-1 0.7606,0.9206,0.9505,109.69,97.08,107.47 - black 5.01 X 28698
Br-Pr-S PrSBr mon NdSBr,mP12,14 P121/c1 0.698,0.709,0.693,90,99.3,90 - - 4.96 A 7115
Br-Pr-S PrSBr orth CeSI,oP24,61 Pbca 0.69,1.373,0.708,90,90,90 - green 5.01 A 5179
Br-Pr-Sb Pr5Sb3Br CuHf5Sn3,hP18,193 P63 /mcm 0.9378,0.9378,0.6529,90,90,120 AlB2 family - 7.68 A 36169
Br-Rb-Re RbRe3Br10 RbRe3Br10 ,mS56,12 C12/m1 1.46909,1.08575,1.01915,90,91.81,90 - brown red 5.90 X 25513
Br-Rb-Sb Rb2SbBr5 *,tP*,* - 1.084,1.084,1.119,90,90,90 - yellow - N 813
Br-Rb-Sb Rb2SbBr6 Rb2SbBr6,tI72,88 I41/a 1.05487,1.05487,2.15586,90,90,90 - beige 4.28 X 17959
Br-Rb-Sb Rb3Sb2Br11 *,cP*,* - 1.077,1.077,1.077,90,90,90 - black - N 813
Br-Rb-Sb Rb3Sb2Br9 Cs3Fe2Cl9 ,hP14,164 P-3m1 0.7939,0.7939,0.9718,90,90,120 - green 3.82 X 27341
Br-Rb-Sc RbScBr3 BaNiO3,hP10,194 P63 /mmc 0.75653,0.75653,0.6322,90,90,120 perovskite family - 3.92 A 14158
Handbook of Inorganic Substances – Edition 2015 : Data 351

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Rb-Sc Rb3Sc 2Br9 Cs3Cr2Cl9,hP28,194 P63/mmc 0.7548,0.7548,1.9149,90,90,120 perovskite family colorless 3.75 A 14158
Br-Rb-Sm RbSm2Br5 U2PbSe5,mP32,14 P121/c1 0.9448,0.835,1.327,90,90.2,90 - - 4.99 A 13767
Br-Rb-Sm Rb2SmBr5 K2PrCl5,oP32,62 Pnma 1.361,0.927,0.8575,90,90,90 - - 4.43 A 18593
Br-Rb-Sn RbSn2Br5 [NH4]Pb2Br5,tI32,140 I4/mcm 0.84339,0.84339,1.47502,90,90,90 - - 4.57 X 43958
Br-Rb-Sn Rb2SnBr6 K2PtCl6,cF36,225 Fm-3m 1.064,1.064,1.064,90,90,90 fluorite family - 4.24 X 157
Br-Rb-Sr RbSr2Br5 U2PbSe5,mP32,14 P121/c1 0.9434,0.83537,1.33096,90,90.287,90 - - 4.18 A 32489
Br-Rb-Te Rb2TeBr6 lt Rb2TeBr6,tI18,87 I4/m 0.74726,0.74726,1.07008,90,90,90 - - 4.32 X 17220
Br-Rb-Te Rb2TeBr6 rt K2PtCl6,cF36,225 Fm-3m 1.0773,1.0773,1.0773,90,90,90 fluorite family - 4.13 X 17220
Br-Rb-Ti RbTiBr3 BaNiO3,hP10,194 P63/mmc 0.7527,0.7527,0.6316,90,90,120 perovskite family black 4.00 X 45743
Br-Rb-Ti Rb3Ti2Br9 Cs3Cr2Cl9,hP28,194 P63/mmc 0.752,0.752,1.8724,90,90,120 perovskite family - 3.88 X 58381
Br-Rb-Tl Rb0.2 Tl0.8 Br CsCl,cP2,221 Pm-3m 0.40146,0.40146,0.40146,90,90,90 b.c.c. family - 6.69 X 8547
Br-Rb-Tl Rb0.8 Tl0.2 Br NaCl,cF8,225 Fm-3m 0.6843,0.6843,0.6843,90,90,90 rocksalt family - 3.92 X 8547
Br-Rb-Tm RbTmBr3 GdFeO3,oP20,62 Pnma 0.80786,1.12834,0.78214,90,90,90 perovskite family - 4.60 A 26873
Br-Rb-Tm Rb5Tm3Br12 K5Dy3I12,hP20,189 P-62m 1.4491,1.4491,0.4653,90,90,120 - - 3.71 A 39436
Br-Rb-U Rb2UBr5 Y2HfS5,oP32,62 Pnma 1.367,0.939,0.86046,90,90,90 - violet 4.86 A 29507
Br-Rb-U Rb2UBr6 cub K2PtCl6,cF36,225 Fm-3m 1.094,1.094,1.094,90,90,90 fluorite family green 4.51 X 7790
Br-Rb-U Rb2UBr6 tet K2SnCl6,tP18,128 P4/mnc 0.7743,0.7743,1.1061,90,90,90 - - 4.45 X 32187
Br-Rb-V RbVBr3 lt KNiCl3,hP30,185 P63cm 1.2746,1.2746,0.6248,90,90,120 perovskite family - 4.26 X 18214
Br-Rb-V RbVBr3 rt BaNiO3,hP10,194 P63/mmc 0.7408,0.7408,0.628,90,90,120 perovskite family - 4.19 X 18214
Br-Rb-V Rb3V2Br9 Cs3Cr2Cl9,hP28,194 P63/mmc 0.7361,0.7361,1.853,90,90,120 perovskite family - 4.12 X 18955
Br-Rb-W RbW3Br7 RbW3Br7,mS88,15 C12/c1 2.0301,1.5396,0.972,90,115.69,90 - red 5.81 X 35201
Br-Rb-W Rb2WBr6 K2PtCl6,cF36,225 Fm-3m 1.0489,1.0489,1.0489,90,90,90 fluorite family black 4.80 X 33870
Br-Rb-Yb RbYbBr3 GdFeO3,oP20,62 Pnma 0.80512,1.12551,0.77995,90,90,90 perovskite family - 4.68 X 26873
Br-Rb-Zn Rb2ZnBr4 hp Ca2[SiO4],mP28,14 P121/c1 0.7423,0.9534,1.50319,90,120.011,90 - - 4.01 X 40596
Br-Rb-Zn Rb2ZnBr4 ht Rb2ZnBr4,oP56,62 Pnma 0.9753,0.7679,1.3386,90,90,90 - white 3.68 X 12185
Br-Rb-Zn Rb2ZnBr4 lt1 K2CoCl4,oP84,33 Pna21 2.804,1.32387,0.76139,90,90,90 - colorless 3.92 X 57452
Br-Rb-Zn Rb2ZnBr4 lt2 Rb2ZnBr4,mP168,7 P1c1 1.5182,2.88046,1.5204,90,119.924,90 - colorless 3.84 X 57452
Br-Rb-Zn Rb2ZnBr4 lt3 K2CoCl4,mS336,9 C1c1 1.51848,2.6309,2.8853,90,89.94,90 - colorless 3.84 X 57452
Br-Rb-Zn Rb2ZnBr4 lt4 K2BeF4,oP28,33 Pna21 0.9614,1.3198,0.7594,90,90,90 - - 3.83 X 21065
Br-Rb-Zn Rb3ZnBr5 [NH4]3ZnCl5,oP36,62 Pnma 0.9079,1.0496,1.3443,90,90,90 - - 3.74 X 14814
Br-Re-S Re3S2Br5 Re3(Se 0.5 Cl0.5)4Cl3,aP40,2 P-1 0.92,0.9289,1.284,82.71,84.07,82.83 Chevrel phase brown red 6.31 X 36528
Br-Re-S Re3S4Br Re3Se4Br,mP32,14 P121/c1 0.6362,1.1429,1.08805,90,115.517,90 Chevrel phase - 7.13 X 26033
Br-Re-S Re3S7Br7 Re3S7Cl7,hP68,159 P31c 0.92635,0.92635,2.3452,90,90,120 - black 5.12 A 36559
Br-Re-S Re6S5Br8 Re6S5Br8,aP38,2 P-1 0.9047,0.9228,1.3574,96.25,99.24,116.55 Chevrel phase - 6.50 X 36528
Br-Re-S Re6S7Br4 Re6(Se 0.875 Br0.125)8Br3,hR102,167 R-3c 0.93771,0.93771,3.46504,90,90,120 Chevrel phase - 6.27 A 24614
Br-Re-Se Re3Se2Br5 Re3(Se 0.5 Cl0.5)4Cl3,aP40,2 P-1 0.923,0.931,1.2975,83.36,84.1,82.33 Chevrel phase red dark 6.78 X 37765
Br-Re-Se Re3Se4Br Re3Se4Br,mP32,14 P121/c1 0.6572,1.1851,1.11422,90,115.139,90 Chevrel phase gray 8.07 X 21626
Br-Re-Se Re3Se7Br7 Re3S7Cl7,hP68,159 P31c 0.9476,0.9476,2.3796,90,90,120 - brown 6.00 X 36559
Br-Re-Se Re6Se7Br4 Re6(Se 0.875 Br0.125)8Br3,hR102,167 R-3c 0.9827,0.9827,3.1658,90,90,120 Chevrel phase black 7.49 X 32763
Br-Re-Te ReTe 2Br4 ReTe 2Br4,tI56,82 I-4 1.1202,1.1202,1.3935,90,90,90 - black 5.78 X 32441
Br-Re-Te ReTe 3Br5 ReTe 3Br5,mP36,4 P1211 1.1275,0.86185,1.231,90,105.47,90 - black 5.58 X 35684
Br-Re-Te Re3Te 2Br5 Re3(Se 0.5 Cl0.5)4Cl3,aP40,2 P-1 0.9347,0.9403,1.3348,84.46,84.64,82.11 Chevrel phase - 6.99 X 33584
Br-Re-Te Re3Te 7Br7 Re3Te7Br7,hR102,148 R-3 1.0151,1.0151,3.4023,90,90,120 Chevrel phase black 6.60 X 31620
Br-Rh-Tb Tb6RhBr10 Y6RuI10,aP17,2 P-1 0.72909,0.9056,0.90925,108.788,97.104,106.256 - black 5.81 X 59447
Br-Rh-Tb Tb7RhBr12 Sc7NCl12,hR60,148 R-3 1.4633,1.4633,0.99693,90,90,120 - black 5.86 X 59447
Br-Rh-Te RhTe 6Br3 RhTe 6Cl3,hR60,167 R-3c 1.46194,1.46194,0.97773,90,90,120 - - 6.10 X 59493
Br-Ru-Sc Sc4.74 RuBr7 Sc4.75 OsBr7,cP52,215 P-43m 1.09897,1.09897,1.09897,90,90,90 - - 4.37 X 33064
Br-Ru-Tb Tb6RuBr10 Y6RuI10,aP17,2 P-1 0.73177,0.9068,0.9093,108.746,97.189,106.311 - black 5.78 X 59447
Br-Ru-Te RuTe 6Br8 RuTe 6Br8,mP60,14 P121/c1 0.94416,1.64621,1.43813,90,120.606,90 - - 5.20 X 59493
Br-Ru-Y Y4RuBr5 Y4RuI5,tP80,134 P42/nnm 1.1662,1.1662,1.6997,90,90,90 - black 4.92 X 31649
Br-S-Sb SbSBr lt SbSI,oP12,33 Pna21 0.8168,0.97,0.3942,90,90,90 - - 4.97 X 18019
Br-S-Sb SbSBr rt BiSCl,oP12,62 Pnma 0.8212,0.3963,0.972,90,90,90 - yellow 4.91 X 36095
Br-S-Sm SmSBr NdSBr,mP12,14 P121/c1 0.686,0.701,0.686,90,99.32,90 - - 5.35 A 7115
Br-S-Sn Sn3.5 SBr5 Sn3.5 (S0.33 Br0.67)3Br3 ,hP30,173 P63 1.2185,1.2185,0.4418,90,90,120 - yellow 4.95 X 16973
Br-S-Ta Ta3SBr7 Ta3SBr7,mS22,8 C1m1 1.2249,0.7071,0.87522,90,133.905,90 - black 6.90 X 34850
Br-S-Ta Ta4S9Br8 Ta4S9Br8,tI42,107 I4mm 1.2765,1.2765,0.6966,90,90,90 - black 4.83 X 44736
Br-S-Tb TbSBr NdSBr,mP12,14 P121/c1 0.675,0.689,0.677,90,99.33,90 - - 5.79 A 7115
Br-S-Te TeS7Br2 TeS7 Cl2,oP40,62 Pnma 0.9479,0.8858,1.3344,90,90,90 - - 3.03 X 6473
Br-S-Tl TlSBr PbClF,tP6,129 P4/nmm 0.42992,0.42992,0.896,90,90,90 - - 6.34 A 4830
Br-S-Tl Tl6SBr4 Tl6SCl4,tP22,128 P4/mnc 0.876,0.876,0.933,90,90,90 - - 7.32 A 43900
Br-S-V V4S9Br4 rt V4S9 Br4,tP34,129 P4/nmm 1.08639,1.08639,0.69728,90,90,90 - black 3.28 X 45086
Br-S-W WSBr4 WSBr4,mP24,14 P121/c1 0.9642,0.6024,1.2776,90,109.17,90 - green dark 5.07 X 5358
Br-S-Y YSBr FeClO,oP6,59 Pmmn 0.406,0.535,0.809,90,90,90 - white 3.80 A 5179
Br-S-Yb YbSBr FeClO,oP6,59 Pmmn 0.397,0.527,0.807,90,90,90 - yellow 5.61 A 5179
Br-Sb-Se SbSeBr BiSCl,oP12,62 Pnma 0.83,0.395,1.02,90,90,90 - - 5.57 A 354
Br-Sb-W W2SbBr8 W2SbBr8,mP88,14 P121/c1 1.6495,1.0873,1.8001,90,119.48,90 Chevrel phase black 5.34 X 59516
Br-Sb-W W5SbBr15 W5SbBr15,aP84,2 P-1 0.9329,1.5002,1.8601,91.45,99.74,90. - green dark 5.80 X 59320
Br-Se-Ta Ta2Se 17Br12 W2Se17Cl12,aP62,2 P-1 1.1795,1.346,1.3545,112.52,97.81,99.26 - black 4.62 X 33832
Br-Se-Ta Ta2Se 8Br Nb2Se8Br,mP92,14 P121/c1 1.2844,1.3875,1.6018,90,127.57,90 - - 6.30 X 20331
Br-Se-Ta Ta3Se 8Br6 Ta3Se8Br6,aP34,2 P-1 0.7201,1.1239,1.2847,70.49,77.49,81.96 - black 5.76 X 35039
Br-Se-Ta Ta4Se 16Br *,mP84,14 P121/c1 1.2841,1.3875,1.60144,90,127.566,90 - - - N 17191
Br-Se-Tl Tl5Se 2Br Tl5Se2I,tI32,140 I4/mcm 0.8594,0.8594,1.2788,90,90,90 - gray silver 8.86 X 28793
Br-Si-Tb Tb3SiBr3 Ca3PI3,cI56,214 I4132 1.14674,1.14674,1.14674,90,90,90 - - 6.56 X 41054
Br-Si-Tb Tb4SiBr6 Sc4BCl6,oP22,55 Pbam 1.3061,1.3859,0.40407,90,90,90 - black 5.19 X 42464
Br-Sm-Tl TlSm2Br5 U2PbSe5,mP32,14 P121/c1 0.92793,0.8326,1.31846,90,90.084,90 - - 5.90 A 32489
Br-Sn-Th Th0.5 Sn0.5 Br3 Th0.5 Pb0.5I3,oS20,63 Cmcm 0.4209,1.2716,0.9143,90,90,90 - - 5.63 A 28165
Br-Sn-Tl TlSn2Br5 [NH4]Pb2Br5,tI32,140 I4/mcm 0.83564,0.83564,1.43558,90,90,90 - - 5.57 X 43958
Br-Sr-Tc SrTcBr6 *,oP16,59 Pmmn 0.737,1.041,0.746,90,90,90 - - - N 20671
352 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Br-Sr-Th SrThBr6 BaThBr6,oP16,51 Pmma 0.9878,0.4286,1.2255,90,90,90 - - 5.12 X 31057


Br-Sr-Tl Sr2TlBr5 U2PbSe5,mP32,14 P121/c1 0.93672,0.8294,1.32529,90,90.216,90 - - 5.03 A 32489
Br-Sr-W SrW6Br14 HgMo6Cl14 ,cP84,201 Pn-3 1.363,1.363,1.363,90,90,90 Chevrel phase - 6.06 A 29929
Br-Ta-Te TaTeBr9 WTeBr9,mP22,11 P121/m1 0.6613,1.136,1.001,90,102.7,90 - - 4.65 X 36704
Br-Ta-Te TaTe2Br6 TaTe2Cl6,aP18,2 P-1 0.6809,0.7104,1.2399,84.71,81.95,85.31 - black 5.16 X 32628
Br-Ta-Tm TmTa6Br18 LuNb6Cl18 ,hR75,148 R-3 0.9704,0.9704,2.6426,90,90,120 - - 6.23 A 30658
Br-Te-Tl Tl2 TeBr6 K2SnCl6,tP18,128 P4/mnc 0.7468,0.7468,1.0682,90,90,90 - - 5.66 X 43101
Br-Te-U UTe4Br5 UTe4Br5,aP40,2 P-1 0.9008,1.2051,1.366,80.93,76.83,78.84 - gray silver 5.42 X 40953
Br-Te-W WTeBr9 WTeBr9,mP22,11 P121/m1 0.6601,1.134,0.993,90,103.2,90 - orange 4.73 X 36704
Br-Te-Zr ZrTe2Br5 ZrTe2Br5,mS32,12 C12/m1 1.33,1.126,0.9647,90,130.731,90 - - 4.53 X 24552
Br-Te-Zr Zr2TeBr12 Zr2TeBr12 ,mP60,14 P121/c1 0.67618,1.5604,1.9238,90,97.91,90 - - 4.19 X 24552
Br-Tl-W TlW3Br7 KW3Br7,cP90,201 Pn-3 1.3873,1.3873,1.3873,90,90,90 - green 6.54 X 35334
Br-Tl-Yb TlYbBr3 UFeS3,oS20,63 Cmcm 0.42835,1.4066,1.09171,90,90,90 - - 6.23 A 32489
C-Ca-Cl Ca3C3Cl2 Ca3C3Cl2,oS32,63 Cmcm 0.3876,1.3524,1.1653,90,90,90 - red 2.47 X 25492
C-Ca-N Ca[CC3N3 ]2 Cr[CC3N3 ]2,oP30,53 Pmna 0.80881,0.55645,1.09514,90,90,90 - colorless 1.48 X 49156
C-Ca-N Ca[NCN] Ca[NCN],hR12,166 R-3m 0.369,0.369,1.4775,90,90,120 - colorless 2.29 X 51646
C-Ca-N Ca[NC2N2 ]2 rt Ca[NC2N2 ]2,mS44,15 C12/c1 1.24455,0.60797,0.78981,90,98.864,90 - white 1.94 X 39107
C-Ca-N Ca11[NCN]2N6 Ca11[NCN]2N6,tP46,136 P42 /mnm 1.45622,1.45622,0.36186,90,90,90 - red dark 2.62 X 51646
C-Ca-N Ca4[NCN]N2 (Sr0.27 Ca0.73)3Ca[NCN]N2,oP36,62 Pnma 1.1439,0.35772,1.3844,90,90,90 - green 2.68 X 36812
C-Ca-Ni Ca4Ni3C5 Ca4Ni3C5,mS24,12 C12/m1 1.1087,0.3771,0.9839,90,112.58,90 - black 3.47 X 25705
C-Ca-O Ca[CO3] ara Ca[CO3]-a,oP20,62 Pnma 0.57416,0.49596,0.79644,90,90,90 aragonite colorless 2.93 X 57748
C-Ca-O Ca[CO3] cal ht Na[NO3]-a,hR48,167 R-3c 0.49785,0.49785,1.72566,90,90,120 calcite high - 2.69 X 53125
C-Ca-O Ca[CO3] cal rt Ca[CO3],hR30,167 R-3c 0.49945,0.49945,1.69832,90,90,120 calcite low colorless 2.72 X 57843
C-Ca-O Ca[CO3] hp1 Ca[CO3],mP20,14 P121/c1 0.6334,0.4984,0.8033,90,107.9,90 - - 2.76 X 8834
C-Ca-O Ca[CO3] hp2-1 Ca[CO3],aP50,2 P-1 0.62811,0.75073,1.2516,93.76,98.95,106.49 - - 2.99 X 58139
C-Ca-O Ca[CO3] hp2-2 Eu[BO3],aP20,2 P-1 0.6144,0.63715,0.63739,93.84,107.34,107.16 - - 2.96 X 58139
C-Ca-O Ca[CO3] hp5 Ca[CO3],aP10,2 P-1 0.3319,0.4883,0.559,76.7,85.27,89.21 - - 3.78 X 58139
C-Ca-O Ca[CO3] tricl Ca[CO3],aP90,2 P-1 0.70499,0.70499,2.532,82.051,82.051,60.659 vaterite - 2.76 X 57559
C-Ca-O Ca[CO3] vat Ca[CO3],hP26,194 P63 /mmc 0.41304,0.41304,0.84749,90,90,120 vaterite - 2.65 X 57108
C-Ca-O Ca[C2O4] Ca[C2O4],mP28,10 P12/m1 0.61644,0.73623,0.95371,90,90.24,90 - - 1.97 X 51501
C-Ca-Pb Ca11Pb3C8 Ca11Sn3C8 ,mP88,14 P121/c1 1.32117,1.07029,1.42493,90,105.65,90 - - 3.97 X 58259
C-Ca-Pd CaPd3C CaTiO3,cP5,221 Pm-3m 0.4141,0.4141,0.4141,90,90,90 perovskite family black 8.68 X 25705
C-Ca-Sn Ca11Sn3C8 Ca11Sn3C8 ,mP88,14 P121/c1 1.31877,1.06915,1.42148,90,105.649,90 - - 3.07 X 58259
C-Cd-F Cd[C6F5]2 Cd[C6F5]2 ,mP92,14 P121/c1 1.203,0.7792,1.50213,90,120.305,90 - colorless 2.44 X 27046
C-Cd-N Cd[CN]2 Zn[CN]2,cP10,215 P-43m 0.6301,0.6301,0.6301,90,90,90 - colorless 2.18 X 23435
C-Cd-N Cd[NCN] Ca[NCN],hR12,166 R-3m 0.35316,0.35316,1.4555,90,90,120 - - 4.83 X 40361
C-Cd-N Cd[NC2N2]2 ht Ni[NC2N2 ]2,oP22,58 Pnnm 0.62462,0.75292,0.7683,90,90,90 - - 2.25 X 43964
C-Cd-N Cd[NC2N2]2 rt Cd[NC2N2 ]2,mP22,14 P121/c1 0.6216,0.74876,0.97458,90,127.822,90 - colorless 2.27 X 43964
C-Cd-Ni CdNi3C CaTiO3,cP5,221 Pm-3m 0.384,0.384,0.384,90,90,90 perovskite family - 8.81 X 47276
C-Cd-O Cd[CO3] Ca[CO3],hR30,167 R-3c 0.49207,0.49207,1.62968,90,90,120 otavite - 5.03 X 48053
C-Cd-O Cd[C2O4] rt Cd[C2O4],mP14,14 P121/c1 0.5826,0.5252,0.63613,90,123.025,90 - colorless 4.08 X 38375
C-Cd-Ti CdTi2C Cr2AlC,hP8,194 P63 /mmc 0.3099,0.3099,1.441,90,90,120 - - 6.10 A 2309
C-Cd-Ti Cd0.9 Ti3.1 C0.9 CaTiO3,cP5,221 Pm-3m 0.42303,0.42303,0.42303,90,90,90 perovskite family - 5.71 X 4786
C-Ce-Cl Ce13C13Cl8 Ce13C13Cl8,mP136,14 P121/c1 0.7664,5.4249,0.6796,90,103.98,90 - golden 5.48 X 57382
C-Ce-Cl Ce18C18Cl11 Ce18C18Cl11,aP47,2 P-1 0.6771,0.7657,1.898,88.9,80.32,76.09 - golden 5.52 X 57382
C-Ce-Cl Ce2C2Cl La2C2Cl,mS20,15 C12/c1 1.4573,0.4129,0.6696,90,101.37,90 - golden 5.71 X 57382
C-Ce-Cl Ce3CCl5 Pr3CCl5,mS72,15 C12/c1 1.3899,0.871,1.5765,90,98.22,90 - orange 4.29 X 51607
C-Ce-Cl Ce4CCl8 Ce4CCl8,mP104,7 P1c1 1.3538,1.0487,2.2845,90,126.31,90 - black 4.35 X 53409
C-Ce-Cl Ce5C2Cl9 La5C2Cl9,aP32,2 P-1 0.857,0.8627,1.1869,84.8,85.5,61.29 - red 4.53 X 31033
C-Ce-Cl Ce8C8Cl5 La8C8Cl5,mP42,14 P121/c1 0.7669,1.6784,0.6798,90,104.05,90 - golden 5.46 X 51536
C-Ce-Co CeCoC2 CeCoC2,mS16,9 C1c1 0.53885,0.53857,0.7455,90,101.83,90 - - 7.00 X 13715
C-Ce-Dy Ce0.52 Dy0.48 C2 CaC2,tI6,139 I4/mmm 0.3772,0.3772,0.633,90,90,90 - - 6.45 A 13552
C-Ce-Er Ce0.5 Er0.5C2 CaC2,cF36,225 Fm-3m 0.57,0.57,0.57,90,90,90 - - 6.37 X 25047
C-Ce-Fe Ce2Fe14C Nd2Fe14B,tP68,136 P42 /mnm 0.874,0.874,1.185,90,90,90 - - 7.88 A 24789
C-Ce-Fe Ce2Fe17C2 Pr2Mn17C1.77 ,hR66,166 R-3m 0.872,0.872,1.264,90,90,120 CaCu5-Zr4Al3 - 7.50 A 27495
C-Ce-Fe Ce3.67 FeC6 rt La3.67 FeC6 ,hP24,176 P63 /m 0.8686,0.8686,0.5309,90,90,120 - gray 6.15 A 32658
C-Ce-Fe Ce4Fe4C7 *,tP*,* - 0.722,0.722,0.582,90,90,90 - - - N 15735
C-Ce-Ge Ce15Ge9C La15FeGe9 ,hP50,186 P63 mc 1.5336,1.5336,0.6791,90,90,120 - - 6.64 A 56529
C-Ce-Ge Ce5Ge3C CuHf5Sn3,hP18,193 P63 /mcm 0.8855,0.8855,0.6634,90,90,120 AlB2 family - 6.86 A 40825
C-Ce-I Ce12C6I17 Gd12C6I17,mS140,15 C12/c1 1.9731,1.2495,1.9182,90,90.36,90 - black 5.49 X 45810
C-Ce-I Ce3CI5 La3CI5,aP18,2 P-1 0.7875,0.9588,0.9648,107.69,97.24,105.32 - violet 5.43 X 45665
C-Ce-I Ce5C2I9 La5C2I9,oP128,61 Pbca 0.79284,1.6714,3.553,90,90,90 - - 5.27 A 51567
C-Ce-I Ce7C3I10 La7C3I10,aP40,2 P-1 0.9688,1.167,1.3932,80.16,71.81,65.88 - black green 5.57 X 47594
C-Ce-In Ce3InC0.93 CaTiO3,cP5,221 Pm-3m 0.51219,0.51219,0.51219,90,90,90 perovskite family - 6.75 X 42248
C-Ce-La La0.5 Ce0.5 C2 CaC2,tI6,139 I4/mmm 0.3908,0.3908,0.6535,90,90,90 - - 5.44 A 14292
C-Ce-Lu Ce0.75 Lu0.25 C2 CaC2,cF36,225 Fm-3m 0.575,0.575,0.575,90,90,90 - - 6.04 X 25047
C-Ce-Mn CeMn11C2 LaMn11C1.5 ,tI56,141 I41/amd 1.0319,1.0319,0.6696,90,90,90 - - 7.16 A 20415
C-Ce-Mn Ce2Mn17C1.8 Pr2Mn17C1.77 ,hR66,166 R-3m 0.8785,0.8785,1.2683,90,90,120 CaCu5-Zr4Al3 - 7.26 A 18953
C-Ce-Mn Ce3.67 MnC6 La3.67 FeC6 ,hP24,176 P63 /m 0.8706,0.8706,0.5295,90,90,120 - brown dark 6.13 A 32658
C-Ce-Mo Ce2Mo2C3 Er2Mo2C3 ,mS14,12 C12/m1 1.2032,0.33374,0.57467,90,113.97,90 - - 8.00 X 49565
C-Ce-N Ce[NC2N2]3 Nd[NC2N2 ]3,oS64,63 Cmcm 0.79494,1.15215,1.02096,90,90,90 - white 2.40 X 45253
C-Ce-N Ce2[NCN]3 Sm2[NCN]3,mS22,12 C12/m1 1.4968,0.4028,0.5337,90,96.19,90 - - 4.16 A 50382
C-Ce-N Ce3[NCN]3N Ce3[NCN]3N,oP104,19 P212121 0.67297,1.3098,1.6977,90,90,90 - orange red 4.92 X 53441
C-Ce-Nd Ce0.75 Nd0.25 C2 CaC2,tI6,139 I4/mmm 0.3872,0.3872,0.6476,90,90,90 - - 5.65 X 19255
C-Ce-Ni CeNiC2 CeNiC2,oS8,38 Amm2 0.3875,0.4552,0.6162,90,90,90 - - 6.81 X 12313
C-Ce-Ni CeNi5C4 *,hP*,* - 0.4887,0.4887,0.4009,90,90,120 - - - N 13216
C-Ce-Ni Ce2Ni22C2.75 Ce2Ni22C2.75 ,oS216,64 Cmce 1.1373,1.5004,1.4625,90,90,90 - - 8.54 X 26142
C-Ce-Ni Ce2Ni5C3 La2Ni5C3,tP20,127 P4/mbm 0.8306,0.8306,0.3985,90,90,90 - - 7.37 X 55348
Handbook of Inorganic Substances – Edition 2015 : Data 353

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Ce-O CeCO ht *,hP*,* - 0.709,0.709,0.728,90,90,120 - - - N 21357


C-Ce-O CeCO rt ThCN,mS12,12 C12/m1 0.702,0.395,0.727,90,95.6,90 - - 5.57 A 21357
C-Ce-O CeC0.68 O1.27 *,hP*,182 P6322 0.3874,0.3874,0.6038,90,90,120 - red - N 6769
C-Ce-O Ce2CO *,oP*,* - 0.654,0.773,0.946,90,90,90 - gray silver - N 6769
C-Ce-O Ce2C3O *,m**,* - 0.8527,0.4881,1.41023,90,105.061,90 - - - N 3481
C-Ce-Os Ce3.67 OsC6 La3.67 FeC6,hP24,176 P63/m 0.8817,0.8817,0.5274,90,90,120 - gray 7.26 A 39525
C-Ce-Os Ce5Os3C4 La5Os3C4,hP24,193 P63/mcm 0.9055,0.9055,0.6662,90,90,120 - gray dark 9.26 A 33462
C-Ce-P Ce4P 0.57 C4.86 La4P 1.92 C2.16,cI52,199 I213 0.85458,0.85458,0.85458,90,90,90 - - 6.77 X 55443
C-Ce-Pb Ce3PbC CaTiO3,cP5,221 Pm-3m 0.5112,0.5112,0.5112,90,90,90 perovskite family - 7.95 X 2296
C-Ce-Pr Ce0.5 Pr0.5 C2 CaC2,tI6,139 I4/mmm 0.3863,0.3863,0.6456,90,90,90 - - 5.67 A 34561
C-Ce-Re Ce12 Re5C15 La12 Re5C15,hP32,189 P-62m 1.097,1.097,0.5369,90,90,120 - gray dark 8.29 A 29688
C-Ce-Re Ce2ReC2 Pr2ReC2,oP20,62 Pnma 0.6569,0.52937,1.0024,90,90,90 - - 9.35 A 23790
C-Ce-Rh CeRhC2 LaRhC2,tP16,76 P41 0.39245,0.39245,1.526,90,90,90 - - 7.55 X 22199
C-Ce-Rh CeRh3C CaTiO3,cP5,221 Pm-3m 0.4146,0.4146,0.4146,90,90,90 perovskite family - 10.74 X 53254
C-Ce-Ru CeRu3C CaTiO3,cP5,221 Pm-3m 0.41515,0.41515,0.41515,90,90,90 perovskite family - 10.57 X 18137
C-Ce-Ru Ce3.67 RuC6 La3.67 FeC6,hP24,176 P63/m 0.8778,0.8778,0.5283,90,90,120 - gray 6.48 A 32658
C-Ce-Si Ce3Si2C0.68 U3Si2,tP10,127 P4/mbm 0.775,0.775,0.443,90,90,90 - - 6.05 F 40825
C-Ce-Si Ce3Si2C2 Pr3Si2C2,oS20,65 Cmmm 0.399,1.6592,0.4434,90,90,90 - gray 5.66 A 34802
C-Ce-Sn Ce0.75 Sn0.25 C0.115 Cu,cF4,225 Fm-3m 0.509,0.509,0.509,90,90,90 close-packed structure gray 6.86 F 6078
C-Ce-Sn Ce3SnC CaTiO3,cP5,221 Pm-3m 0.5101,0.5101,0.5101,90,90,90 perovskite family - 6.89 X 2296
C-Ce-Th Th0.1 Ce0.9 C2 CaC2,tI6,139 I4/mmm 0.385,0.385,0.646,90,90,90 - - 6.01 A 2330
C-Ce-Th Th0.2 Ce1.8 C3 hp Pu2C3,cI40,220 I-43d 0.848,0.848,0.848,90,90,90 - - 7.29 A 2330
C-Ce-Th Th0.8 Ce0.2 C NaCl,cF8,225 Fm-3m 0.531,0.531,0.531,90,90,90 rocksalt family - 10.01 X 2330
C-Ce-Tl TlCe 3C CaTiO3,cP5,221 Pm-3m 0.5094,0.5094,0.5094,90,90,90 perovskite family - 8.00 X 33965
C-Ce-U Ce0.05 U0.95C NaCl,cF8,225 Fm-3m 0.49641,0.49641,0.49641,90,90,90 rocksalt family - 13.31 X 21426
C-Ce-U Ce0.127 U0.873 C2 ht1 CaC2,tI6,139 I4/mmm 0.3527,0.3527,0.6035,90,90,90 - - 11.04 A 6783
C-Ce-U Ce0.75 U0.25C2 ht CaC2,cF36,225 Fm-3m 0.545,0.545,0.545,90,90,90 - - 7.74 X 25047
C-Ce-U Ce0.856 U0.144 C2 rt CaC2,tI6,139 I4/mmm 0.3858,0.3858,0.6365,90,90,90 - - 6.25 A 6783
C-Ce-U Ce1.94 U0.06C3 Pu2C3,cI40,220 I-43d 0.8441,0.8441,0.8441,90,90,90 - - 7.12 A 2330
C-Ce-W Ce2WC2 Pr2MoC2,tP20,136 P42/mnm 0.57069,0.57069,1.0388,90,90,90 - gray silver 9.58 X 49520
C-Ce-Y Y0.5 Ce0.5 C2 CaC2,tI6,139 I4/mmm 0.376,0.376,0.632,90,90,90 - - 5.15 A 7487
C-Cl-F CCl2F2 SCl2 O2,oF40,43 Fdd2 1.02952,1.52404,0.51287,90,90,90 - - 2.00 X 25628
C-Cl-F CCl3F CCl3 F,oP40,61 Pbca 0.59169,0.95607,1.56524,90,90,90 - - 2.06 X 29940
C-Cl-F C16Cl6F4 C16Cl6F4,mP52,14 P121/c1 1.1022,0.4864,1.5418,90,113.85,90 - yellow 2.11 X 8829
C-Cl-F C2ClF C2ClF,hP24,176 P63/m 0.8541,0.8541,0.6282,90,90,120 - - 1.97 X 13991
C-Cl-F [C6Cl5]F rt *,mP24,14 P121/c1 0.802,0.38,1.65,90,117.,90 - - - N 3734
C-Cl-Ga GaC18Cl3 *,hP*,* - 0.246,0.246,1.283,90,90,120 - black - N 1022
C-Cl-Ga GaC35Cl3 *,hP*,* - 0.246,0.246,1.969,90,90,120 - - - N 1022
C-Cl-Ga GaC9Cl3 *,hP*,* - 0.246,0.246,0.956,90,90,120 - blue dark - N 1022
C-Cl-Gd Gd10 C4Cl17 Gd10 C4Cl17,aP31,2 P-1 0.8498,0.9174,1.1462,104.56,95.98,111.35 - black 4.70 X 15675
C-Cl-Gd Gd2 CCl NaFeO2,hR12,166 R-3m 0.36902,0.36902,2.0308,90,90,120 rocksalt family gray dark 7.53 X 23606
C-Cl-Gd Gd2 CCl2 Ta2CS2,hP5,164 P-3m1 0.37633,0.37633,0.94593,90,90,120 - black 5.69 X 29625
C-Cl-Gd Gd3 CCl3 Ca3PI3,cI56,214 I4132 1.0734,1.0734,1.0734,90,90,90 - - 6.34 X 16544
C-Cl-Gd Gd4 C2Cl3 Gd4C2Cl3,oP36,62 Pnma 1.0596,0.3684,1.9627,90,90,90 - bronze 6.58 X 31047
C-Cl-Gd Gd5 C2Cl9 Gd5C2Cl9,mP64,14 P121/c1 0.9182,1.612,1.2886,90,119.86,90 - black 4.54 X 15675
C-Cl-Gd Gd5 C6Cl3 La5C6Br3,mS56,12 C12/m1 2.1507,0.37193,1.5331,90,123.34,90 - bronze 6.25 X 53425
C-Cl-Gd Gd6 C3Cl5 Gd6C3Cl5,mS28,12 C12/m1 1.6688,0.36969,1.2824,90,128.26,90 - gray silver 6.18 X 21313
C-Cl-Hf Hf6CCl14 Zr6CI14,oS84,64 Cmce 1.3938,1.2498,1.1399,90,90,90 - - 5.28 A 28691
C-Cl-I [C60 ]Cl28[ICl] [C60 ]Cl28[ICl],mP364,14 P121/c1 1.3125,2.4042,1.811,90,100.58,90 fullerene family brown 2.22 X 44169
C-Cl-I [C60 ]Cl30[ICl]2 rt [C60 ]Cl30[ICl]2,tP216,84 P42/m 1.3492,1.3492,1.7027,90,90,90 fullerene family - 2.26 X 44161
C-Cl-In InC16 Cl3 *,hP*,* - 0.246,0.246,1.283,90,90,120 - black - N 1022
C-Cl-La La11 C11Cl7 La11 C11Cl7,mP116,14 P121/c1 0.777,4.7038,0.6901,90,104.28,90 - golden 5.19 X 51536
C-Cl-La La14 C14Cl9 La14 C14Cl9,mP74,7 P1c1 0.7775,2.9963,0.6895,90,104.21,90 - golden 5.19 X 51536
C-Cl-La La2CCl NaFeO2,hR12,166 R-3m 0.3878,0.3878,2.1691,90,90,120 rocksalt family red copper 5.74 X 31167
C-Cl-La La2C2Cl La2C2Cl,mS20,15 C12/c1 1.477,0.4187,0.6802,90,101.5,90 - golden 5.44 X 51536
C-Cl-La La20 C20Cl13 La20 C20Cl13,mP106,14 P121/c1 0.7762,4.2941,0.6903,90,104.26,90 - black 5.18 X 51536
C-Cl-La La3C3Cl2 La3C3Cl2,mP32,14 P121/c1 0.777,1.2962,0.691,90,104.3,90 - golden 5.16 X 49607
C-Cl-La La36 C36Cl23 La36 C36Cl23,mP190,14 P121/c1 0.7764,7.7055,0.6897,90,104.26,90 - gray silver 5.19 X 51536
C-Cl-La La4C2Cl5 La4C2Br5,oI22,71 Immm 0.3921,0.7945,1.7297,90,90,90 - black 4.67 X 51556
C-Cl-La La4C5Cl2 La4C5Cl2,mS44,12 C12/m1 2.257,0.393,1.019,90,95.69,90 - golden 5.07 X 49607
C-Cl-La La5C2Cl9 La5C2Cl9,aP32,2 P-1 0.8645,0.8706,1.1925,84.97,85.78,61.31 - red 4.40 X 31033
C-Cl-La La8C8Cl5 La8C8Cl5,mP42,14 P121/c1 0.7756,1.6951,0.6878,90,104.2,90 - golden 5.25 X 51536
C-Cl-Lu Lu2CCl2 rhom Bi2Te2S,hR15,166 R-3m 0.36017,0.36017,2.716,90,90,120 - brown 7.07 X 20834
C-Cl-Lu Lu2CCl2 trig Ta2CS2,hP5,164 P-3m1 0.35972,0.35972,0.90925,90,90,120 - - 7.05 A 20834
C-Cl-N CNCl mon *,mS36,15 C12/c1 1.301,0.7515,0.7651,90,119.79,90 - - 1.89 N 27164
C-Cl-N C2[CN]Cl C2[CN]Cl,mP10,11 P121/m1 0.496,0.614,0.619,90,95.5,90 - - 1.51 X 3881
C-Cl-N C6N7Cl3 C6N7Cl3,mS384,15 C12/c1 2.3194,1.3488,2.0634,90,118.38,90 - yellow 1.94 X 45695
C-Cl-N C6[CN]2Cl4 m/p1 *,hR42,166 R-3m 0.9233,0.9233,1.0091,90,90,120 - - 1.78 N 51873
C-Cl-N C6[CN]2Cl4 m/p2 C6[CN]2Cl4,mS48,12 C12/m1 0.79237,0.94546,0.65157,90,93.106,90 - colorless 1.81 X 51873
C-Cl-N C6[CN]2Cl4 meta1 C6[CN]2Cl4-b,mP56,14 P121/c1 0.634,0.6226,2.4753,90,95.41,90 - - 1.82 X 14112
C-Cl-N C6[CN]2Cl4 meta2 C6[CN]2Cl4,hR72,166 R-3m 0.92171,0.92171,0.9935,90,90,120 - colorless 1.81 X 51873
C-Cl-N C6[CN]2Cl4 o/m *,hR42,166 R-3m 0.922,0.922,0.9931,90,90,120 - - 1.81 N 51873
C-Cl-N C6[CN]2Cl4 o/p C6[CN]2Cl4,hR72,166 R-3m 0.92473,0.92473,0.9959,90,90,120 - colorless 1.80 X 51873
C-Cl-N C6[CN]2Cl4 ortho C6[CN]2Cl4-a,mP56,14 P121/c1 0.6482,1.882,0.814,90,93.35,90 - - 1.78 X 14113
C-Cl-N C6[CN]2Cl4 para C6[CN]2Cl4,mP28,14 P121/c1 0.6183,0.6262,1.2567,90,92.32,90 - - 1.82 X 14112
C-Cl-N C6[CN]3Cl3 C6[CN]3Cl3,oP60,19 P212121 0.6827,0.7413,2.101,90,90,90 - - 1.60 X 14109
C-Cl-N C8N2Cl6 C8N2Cl6,mP64,14 P121/c1 1.3168,0.39178,2.1622,90,101.22,90 - - 2.04 X 12195
C-Cl-N C9N10Cl6 C9N10Cl6,hR150,148 R-3 1.9335,1.9335,0.75841,90,90,120 - colorless 1.87 X 43980
354 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Cl-N C9N11Cl3 C9N11Cl3,hR276,148 R-3 2.56,2.56,0.70016,90,90,120 - - 1.85 X 51535


C-Cl-N [CC3N3]Cl hex [CC3N3]Cl,hP48,176 P63 /m 1.023,1.023,0.995,90,90,120 - - 1.39 X 6494
C-Cl-N [CC3N3]Cl mon *,mP32,* - 0.557,0.926,1.148,90,90.,90 - - - N 6494
C-Cl-N [CC3N3]Cl orth [CC3N3]Br,oP64,61 Pbca 0.655,0.945,1.83,90,90,90 - - 1.47 A 6494
C-Cl-N [ClCN] orth [ClCN],oP6,59 Pmmn 0.3977,0.5684,0.574,90,90,90 - - 1.57 X 753
C-Cl-O CCl2O CCl2O,tI64,88 I41/a 1.582,1.582,0.572,90,90,90 - - 1.84 X 430
C-Cl-O C19Cl14O[CCl4] C19Cl14O[CCl4],aP78,2 P-1 0.7256,1.3663,1.6341,75.22,80.18,82.57 - red 1.93 X 17680
C-Cl-O C3Cl2O C3Cl2O,mP24,14 P121/c1 0.8763,0.5837,0.8862,90,107.4,90 - - 1.89 X 1471
C-Cl-O C8Cl4O3 C8Cl4O3,mP60,14 P121/c1 1.2342,0.5789,1.80729,90,131.88,90 - - 1.98 X 14960
C-Cl-O C9Cl6O C9Cl6O,mP64,14 P121/c1 1.1294,0.5715,2.02708,90,120.433,90 - colorless 1.98 X 22064
C-Cl-P [CCl3]2PCl3 [CCl3]2PCl3,hR72,166 R-3m 1.0358,1.0358,1.7463,90,90,120 - - 2.30 X 20716
C-Cl-Pr Pr11C11Cl7 La11C11Cl7,mP116,14 P121/c1 0.7612,4.6127,0.6761,90,103.92,90 - golden 5.56 X 57382
C-Cl-Pr Pr14C14Cl9 La14C14Cl9,mP74,7 P1c1 0.7611,2.9392,0.6764,90,103.9,90 - golden 5.56 X 57382
C-Cl-Pr Pr3CCl5 Pr3CCl5,mS72,15 C12/c1 1.3867,0.8638,1.569,90,97.67,90 - yellow 4.37 X 51487
C-Cl-Pr Pr4C2Cl5 La4C2Br5,oI22,71 Immm 0.3848,0.7759,1.701,90,90,90 - black 5.00 X 51556
C-Cl-Pr Pr5C2Cl9 La5C2Cl9,aP32,2 P-1 0.8526,0.8592,1.1821,84.77,85.42,61.26 - brown red 4.61 X 31033
C-Cl-Pr Pr8C8Cl5 La8C8Cl5,mP42,14 P121/c1 0.7617,1.6689,0.6769,90,103.94,90 - golden 5.57 X 57382
C-Cl-S C2S2Cl4 C2S2Cl4,mP16,14 P121/c1 0.6348,0.6005,0.9348,90,98.71,90 - - 2.17 X 28289
C-Cl-S C3S2Cl4 C3S2Cl4,mP36,14 P121/c1 0.68204,1.48777,0.99127,90,126.304,90 - yellow 1.98 X 39978
C-Cl-S C5SCl3 C5SCl3,mP36,7 P1c1 1.068,0.3853,1.81558,90,122.663,90 - - 2.10 X 15071
C-Cl-S [CCl3]2S7 [CCl3]2S7,aP30,2 P-1 0.57,1.09492,1.2555,103.728,93.06,95.953 - colorless 2.03 X 29936
C-Cl-Sc Sc2CCl2 Ta2CS2,hP5,164 P-3m1 0.33997,0.33997,0.8858,90,90,120 - black 3.24 X 18954
C-Cl-Sc Sc5CCl8 Sc5CCl8,mS28,12 C12/m1 1.78,0.35259,1.2052,90,130.11,90 - - 2.99 X 20053
C-Cl-Sc Sc7C2Cl10 Sc7C2Cl10 ,mS38,12 C12/m1 1.862,0.34975,1.181,90,99.81,90 - - 3.04 X 18237
C-Cl-Se Se2C3Cl4 Se2C3Cl4,mP18,11 P121/m1 0.5421,0.8618,0.8462,90,90.,90 - yellow 2.82 X 39978
C-Cl-Si SiCCl3 SiCCl3,mS60,12 C12/m1 1.1896,1.4338,0.9385,90,98.75,90 adamantane structure - 1.84 X 29510
C-Cl-Si Si3CCl7 Si3CCl7,mS88,15 C12/c1 1.5578,0.8574,1.7273,90,103.34,90 - - 2.04 X 29510
C-Cl-Si Si3CCl8 Si3CCl8,aP24,2 P-1 0.8553,0.9003,0.914,95.86,116.45,101.44 - - 2.09 X 28137
C-Cl-Si Si8C3Cl20 Si8C3Cl20,mS248,15 C12/c1 3.1583,1.1037,2.0374,90,116.62,90 - - 2.03 X 28137
C-Cl-Te Te3C3Cl8 Te3C3Cl8,aP28,2 P-1 0.83977,0.8579,1.09212,96.94,102.295,99.65 - red dark 3.12 X 39978
C-Cl-Ti Ti[C60]Cl28 Ti[C60]Cl28 ,hR279,148 R-3 1.25576,1.25576,3.1757,90,90,120 fullerene family yellow 2.02 X 46295
C-Cl-Ti Ti[C76]Cl22 Ti[C76]Cl22 ,oP792,61 Pbca 1.15543,2.12875,4.7168,90,90,90 fullerene family orange 1.99 X 47825
C-Cl-Ti Ti2[C70]Cl8 Ti2[C70]Cl8,mP960,14 P121/c1 4.1816,1.0197,3.0723,90,93.59,90 fullerene family black 1.86 X 39694
C-Cl-Ti Ti3[C60]Cl12 Ti3[C60]Cl12,mP300,14 P121/c1 1.3115,1.8992,2.15232,90,123.782,90 fullerene family red dark 1.92 X 39693
C-Cl-Ti Ti3[C70]Cl13 Ti3[C70]Cl13,aP172,2 P-1 1.01848,1.37803,1.67018,86.242,89.054,79.491 fullerene family black 2.09 X 48160
C-Cl-Ti Ti6CCl14 Zr6CI14,oS84,64 Cmce 1.34592,1.22458,1.09576,90,90,90 - black 2.93 A 28891
C-Cl-W W2CCl8 W2CCl8,oP88,61 Pbca 1.196,1.2156,1.584,90,90,90 - black 3.83 X 40847
C-Cl-W W6CCl15 W6CCl15,mP88,14 P121/c1 0.9883,1.18945,1.7867,90,107.883,90 - - 5.47 X 54360
C-Cl-W W6CCl16 W6CCl16,oP92,62 Pnma 1.6637,1.2958,0.9797,90,90,90 - black 5.29 X 42319
C-Cl-W W6CCl18 W6CCl18,hP50,190 P-62c 0.8923,0.8923,1.7503,90,90,120 - black 4.82 X 42319
C-Cl-Y YCCl GdCBr-a,mS12,12 C12/m1 0.682,0.3713,0.9327,90,94.75,90 - - 3.85 A 32386
C-Cl-Y Y2C0.7 Cl2 Ta2CS2,hP5,164 P-3m1 0.37022,0.37022,0.9195,90,90,120 - gray silver 3.91 A 31015
C-Cl-Zr Zr6CCl14 Zr6CI14,oS84,64 Cmce 1.4091,1.2595,1.1506,90,90,90 - brown red 3.43 X 22583
C-Co-Cr Cr21.26 Co1.74 C6 Cr23C6,cF116,225 Fm-3m 1.0637,1.0637,1.0637,90,90,90 - - 7.06 A 6311
C-Co-Cr Cr6.5 Co0.5 C3 Cr7C3,hP80,186 P63 mc 1.402,1.402,0.4525,90,90,120 - - 6.96 A 6311
C-Co-Dy DyCoC YCoC,tP4,123 P4/mmm 0.3645,0.3645,0.343,90,90,90 - - 8.51 X 22892
C-Co-Dy DyCoC2 CeNiC2,oS8,38 Amm2 0.35442,0.4515,0.6036,90,90,90 - - 8.44 X 19068
C-Co-Er ErCoC YCoC,tP4,123 P4/mmm 0.3633,0.3633,0.3365,90,90,90 - - 8.91 X 22892
C-Co-Er ErCoC2 CeNiC2,oS8,38 Amm2 0.34887,0.45037,0.60166,90,90,90 - - 8.79 A 19068
C-Co-Fe Fe1.5 Co1.5 C Fe3C-b,oP16,62 Pnma 0.5063,0.6759,0.4511,90,90,90 - - 7.93 A 23886
C-Co-Ga Co3GaC0.5 CaTiO3,cP5,221 Pm-3m 0.365,0.365,0.365,90,90,90 perovskite family - 8.62 X 1338
C-Co-Gd GdCoC YCoC,tP6,131 P42 /mmc 0.36613,0.36613,0.7025,90,90,90 - - 8.05 X 19797
C-Co-Gd GdCoC2 CeNiC2,oS8,38 Amm2 0.36142,0.45258,0.6068,90,90,90 - - 8.04 A 19068
C-Co-Ge Co3GeC0.25 CaTiO3,cP5,221 Pm-3m 0.36,0.36,0.36,90,90,90 perovskite family - 8.98 X 1165
C-Co-Ho HoCoC YCoC,tP4,123 P4/mmm 0.3639,0.3639,0.3395,90,90,90 - - 8.71 X 22892
C-Co-Ho HoCoC2 CeNiC2,oS8,38 Amm2 0.35063,0.44928,0.6006,90,90,90 - - 8.70 X 28967
C-Co-In Co3InC0.75 CaTiO3,cP5,221 Pm-3m 0.382,0.382,0.382,90,90,90 perovskite family - 8.96 X 1165
C-Co-La LaCoC2 CeCoC2,mS16,9 C1c1 0.5446,0.5464,0.7515,90,102.12,90 - - 6.74 A 13715
C-Co-La La5Co7C3 *,c**,* - 0.7644,0.7644,0.7644,90,90,90 - - - N 13216
C-Co-Lu LuCoC YCoC,tP4,123 P4/mmm 0.3619,0.3619,0.3286,90,90,90 - - 9.49 X 22892
C-Co-Lu LuCoC2 CeNiC2,oS8,38 Amm2 0.34232,0.44859,0.5989,90,90,90 - - 9.31 A 19068
C-Co-Mg MgCo3C0.5 CaTiO3,cP5,221 Pm-3m 0.382,0.382,0.382,90,90,90 perovskite family - 6.17 X 958
C-Co-Mn Mn2Co2C CaTiO3,cP5,221 Pm-3m 0.3786,0.3786,0.3786,90,90,90 perovskite family - 7.34 X 4770
C-Co-Mn Mn3Co3C W3Fe3C,cF112,227 Fd-3m 1.0973,1.0973,1.0973,90,90,90 η-carbide - 7.11 A 6311
C-Co-Mo Mo3Co3C W3Fe3C,cF112,227 Fd-3m 1.10709,1.10709,1.10709,90,90,90 η-carbide - 9.33 X 21527
C-Co-Mo Mo6Co6C W6Fe6C,cF104,227 Fd-3m 1.08998,1.08998,1.08998,90,90,90 η-carbide - 9.66 X 21527
C-Co-N Co[CC3N3][NC2N2] Co[CC3N3 ][NC2N2],oS52,40 Ama2 0.74129,1.70895,0.55991,90,90,90 - pink 2.01 X 37005
C-Co-N Co[NCN] Co[NCN],hP8,194 P63 /mmc 0.32129,0.32129,0.93902,90,90,120 - brown 3.92 X 48403
C-Co-N Co[NC2N2]2 Ni[NC2N2 ]2,oP22,58 Pnnm 0.59985,0.70711,0.7414,90,90,90 - pink 2.02 X 34233
C-Co-N Co1.25 [CN]3 Co1.25 [CN]3,cF64,225 Fm-3m 1.02,1.02,1.02,90,90,90 - - 1.90 X 927
C-Co-Nb Nb4Co2C W4Co2C,cF112,227 Fd-3m 1.1655,1.1655,1.1655,90,90,90 η-carbide - 8.42 A 14089
C-Co-Nd NdCoC2 CeCoC2,mS16,9 C1c1 0.53488,0.53516,0.74172,90,101.62,90 - gray 7.26 X 22447
C-Co-O Co[CO]3 Co[CO]3,oP140,56 Pccn 0.89912,1.16988,1.7246,90,90,90 - black 2.09 X 36079
C-Co-O Co[CO]4 Co[CO]4,mP72,11 P121/m1 0.6482,1.5398,1.1087,90,90.53,90 - orange 2.05 X 15950
C-Co-O Co[CO3] Ca[CO3],hR30,167 R-3c 0.46618,0.46618,1.4963,90,90,120 spherocobaltite - 4.21 X 18817
C-Co-O Co[C2O4] *,mP14,14 P121/c1 0.5398,0.503,0.61009,90,120.54,90 - - - N 16484
C-Co-O Co3C[CO]9 mon Co3C[CO]9,mS176,15 C12/c1 1.6368,0.945,1.8906,90,106.79,90 - brown dark 2.09 X 6654
C-Co-O Co3C[CO]9 trig Co3C[CO]9,hP132,152 P3121 0.971,0.971,2.5746,90,90,120 - black 2.09 X 27002
Handbook of Inorganic Substances – Edition 2015 : Data 355

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Co-O Co3 C2[CO]9 Co3C2[CO]9,aP46,2 P-1 0.797,0.887,1.261,70.1,73.1,68.3 - - 1.97 X 5240


C-Co-O Co4 C3[CO]12 Co4C3[CO]12,aP124,2 P-1 0.9079,1.5083,1.5489,104.1,92.6,92.9 - - 1.97 X 5918
C-Co-O Co6 C3O[CO]18 Co6C3O[CO]18,oP184,19 P212121 0.9698,0.9775,3.0857,90,90,90 - black 2.07 X 27004
C-Co-Pr PrCoC2 CeCoC2,mS16,9 C1c1 0.5357,0.5358,0.7401,90,101.73,90 - - 7.15 X 28967
C-Co-Pu PuCoC2 CeNiC2,oS8,38 Amm2 0.36243,0.4525,0.60558,90,90,90 - gray 10.93 A 19389
C-Co-Sc ScCo 0.88 C2 ScCoC2,tP8,129 P4/nmm 0.33208,0.33208,0.7331,90,90,90 - gray 4.96 X 26239
C-Co-Sc ScCo 3C CaTiO3,cP5,221 Pm-3m 0.3827,0.3827,0.3827,90,90,90 perovskite family - 6.93 X 10736
C-Co-Sc Sc3CoC4 mon Sc3RhC4,mS32,12 C12/m1 0.55375,1.203,0.55368,90,104.77,90 - black 4.50 X 53619
C-Co-Sc Sc3CoC4 orth Sc3CoC4,oI16,71 Immm 0.33935,0.43687,1.19851,90,90,90 - gray 4.52 X 48527
C-Co-Sm SmCoC2 ht CeNiC2,oS8,38 Amm2 0.36721,0.4537,0.6082,90,90,90 - - 7.65 A 19068
C-Co-Sm SmCoC2 rt CeCoC2,mS16,9 C1c1 0.5312,0.5312,0.7389,90,101.4,90 - - 7.58 A 18699
C-Co-Sm Sm5 Co11C2 *,hP*,* - 0.5148,0.5148,1.0744,90,90,120 - - - N 18699
C-Co-Sn Co3 SnC0.7 CaTiO3,cP5,221 Pm-3m 0.378,0.378,0.378,90,90,90 perovskite family - 9.34 X 1085
C-Co-Ta Ta4Co 2C W4Co2C,cF112,227 Fd-3m 1.158,1.158,1.158,90,90,90 η-carbide - 14.61 A 14089
C-Co-Tb TbCoC YCoC,tP4,123 P4/mmm 0.3652,0.3652,0.3465,90,90,90 - - 8.26 X 22892
C-Co-Tb TbCoC2 CeNiC2,oS8,38 Amm2 0.3573,0.4518,0.6048,90,90,90 - - 8.23 X 23646
C-Co-Th ThCoC2 CeNiC2,oS8,38 Amm2 0.38063,0.45329,0.61461,90,90,90 - - 9.87 A 19389
C-Co-Tm TmCoC YCoC,tP4,123 P4/mmm 0.3626,0.3626,0.3333,90,90,90 - - 9.09 X 22892
C-Co-Tm TmCoC2 CeNiC2,oS8,38 Amm2 0.3461,0.44974,0.6003,90,90,90 - - 8.95 A 19068
C-Co-U UCoC2 ScCoC2,tP8,129 P4/nmm 0.34969,0.34969,0.7313,90,90,90 - gray 11.92 X 19389
C-Co-V V4Co 2C W4Co2C,cF112,227 Fd-3m 1.089,1.089,1.089,90,90,90 η-carbide - 6.86 A 14089
C-Co-W W10 Co3C3.4 W10 Co3C3.4,hP34,194 P63/mmc 0.78304,0.78304,0.78361,90,90,120 - - 16.41 X 10326
C-Co-W W3Co3C W3Fe3C,cF112,227 Fd-3m 1.1106,1.1106,1.1106,90,90,90 η-carbide - 14.36 A 5494
C-Co-W W6Co6C W6Fe6C,cF104,227 Fd-3m 1.0903,1.0903,1.0903,90,90,90 η-carbide - 15.05 A 15733
C-Co-Y YCoC YCoC,tP6,131 P42/mmc 0.36515,0.36515,0.68651,90,90,90 - gray 5.80 X 41685
C-Co-Y YCoC2 CeNiC2,oS8,38 Amm2 0.3546,0.4519,0.6033,90,90,90 - - 5.90 X 23646
C-Co-Y Y2Co 17C0.8 Pr2Mn17C1.77 ,hR66,166 R-3m 0.8369,0.8369,1.2188,90,90,120 CaCu5-Zr4Al3 - 8.01 A 26075
C-Co-Yb YbCoC2 CeNiC2,oS8,38 Amm2 0.34368,0.4492,0.5991,90,90,90 - - 9.19 A 19068
C-Co-Zn ZnCo 3C CaTiO3,cP5,221 Pm-3m 0.373,0.373,0.373,90,90,90 perovskite family - 8.13 X 1085
C-Cr-Dy Dy2 Cr2C3 Ho2Cr2C3,mS14,12 C12/m1 1.0494,0.3381,0.5562,90,106.12,90 - - 8.15 A 28795
C-Cr-Er Er2Cr2C3 Ho2Cr2C3,mS14,12 C12/m1 1.047,0.3332,0.55064,90,106.54,90 - - 8.56 A 40407
C-Cr-Fe CrFe 7C0.45 m CrFe 7C0.45,cF64,225 Fm-3m 0.72,0.72,0.72,90,90,90 - - 7.98 X 19445
C-Cr-Fe Cr0.05 Fe2.95 C m Fe3C-b,oP16,62 Pnma 0.5087,0.6741,0.4524,90,90,90 - - 7.68 A 12779
C-Cr-Fe Cr0.36 Fe0.5 C0.14 m *,cI*,* - 0.8976,0.8976,0.8976,90,90,90 - - - N 13596
C-Cr-Fe Cr1.54 Fe5.46 C3 rt Mn7 C3,oP40,62 Pnma 0.4498,0.6898,1.1981,90,90,90 - - 7.52 A 3476
C-Cr-Fe Cr22.26 Fe0.74 C6 Cr23 C6,cF116,225 Fm-3m 1.06537,1.06537,1.06537,90,90,90 isovite - 6.98 X 19961
C-Cr-Fe Cr3.5 Fe3.5 C3 2O *,oP80,61 Pbca 0.452,1.394,1.294,90,90,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 3M *,mP120,14 P121/c1 1.84484,0.452,1.394,90,100.873,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 4M *,mP160,14 P121/c1 2.51391,0.452,1.394,90,106.093,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 4O *,oP160,61 Pbca 0.452,1.394,2.494,90,90,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 5M1 *,mP200,14 P121/c1 3.038,0.452,1.394,90,96.56,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 5M2 *,mP200,14 P121/c1 3.03868,0.452,1.394,90,96.566,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 5M3 *,mP200,14 P121/c1 3.03778,0.452,1.394,90,96.575,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 6M1 *,mP240,14 P121/c1 3.62294,0.452,1.394,90,90.005,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 6M2 *,mP240,14 P121/c1 3.688,0.452,1.394,90,100.87,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 6O *,oP240,61 Pbca 0.452,1.394,3.622,90,90,90 - - - N 17998
C-Cr-Fe Cr3.5 Fe3.5 C3 8O *,oP320,61 Pbca 0.452,1.394,4.83,90,90,90 - - - N 17998
C-Cr-Ga Cr2GaC Cr2AlC,hP8,194 P63/mmc 0.29008,0.29008,1.2632,90,90,120 - black 6.70 X 52995
C-Cr-Gd Gd2 Cr2C3 Ho2Cr2C3,mS14,12 C12/m1 1.0445,0.3437,0.5625,90,105.79,90 - - 7.77 A 19771
C-Cr-Ge Cr2GeC Cr2AlC,hP8,194 P63/mmc 0.29481,0.29481,1.21183,90,90,120 - - 6.87 X 56468
C-Cr-Ge Cr3GeC Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.2899,1.0339,0.7724,90,90,90 - - 6.90 X 6168
C-Cr-Hf Hf0.94 Cr0.06 C NaCl,cF8,225 Fm-3m 0.4637,0.4637,0.4637,90,90,90 rocksalt family - 12.19 X 3222
C-Cr-Ho Ho2 Cr2C3 Ho2Cr2C3,mS14,12 C12/m1 1.047,0.3365,0.55403,90,106.31,90 - - 8.33 X 19771
C-Cr-Ir Cr0.5 Ir0.5 C0.25 ht NaCl,cF8,225 Fm-3m 0.379,0.379,0.379,90,90,90 rocksalt family - 15.27 X 12895
C-Cr-Lu Lu2Cr2C3 Ho2Cr2C3,mS14,12 C12/m1 1.0492,0.33016,0.5452,90,106.99,90 - - 9.01 A 19771
C-Cr-Mn Cr4Mn3C3 Cr7C3,hP80,186 P63mc 1.396,1.396,0.4538,90,90,120 - - 7.09 A 6311
C-Cr-Mn Cr9.2Mn13.8 C6 Cr23 C6,cF116,225 Fm-3m 1.0623,1.0623,1.0623,90,90,90 - - 7.25 A 11125
C-Cr-Mo Cr0.23 Mo0.77 C0.75 Sc0.67 Te,hR24,166 R-3m 0.2982,0.2982,2.881,90,90,120 - - 8.52 X 7499
C-Cr-Mo Cr0.32 Mo0.68 C0.5 ht2 NiAs,hP4,194 P63/mmc 0.2963,0.2963,0.47,90,90,120 AlB2 family - 8.17 X 33112
C-Cr-Mo Cr0.56 Mo0.44 C0.85 ht NaCl,cF8,225 Fm-3m 0.427,0.427,0.427,90,90,90 rocksalt family - 6.96 X 2810
C-Cr-Mo Cr20.39Mo2.61 C6 Mg3 Ni20B6,cF116,225 Fm-3m 1.08,1.08,1.08,90,90,90 - - 7.29 A 2810
C-Cr-N Cr[CC3N3]2 Cr[CC3N3]2,oP30,53 Pmna 0.7313,0.54534,1.06394,90,90,90 - blue sky 1.82 X 37171
C-Cr-N Cr2C0.31 N0.69 Fe2N0.94 ,oP12,60 Pbcn 0.4459,0.5594,0.4845,90,90,90 - - 6.45 A 3193
C-Cr-N Cr2[NCN]3 Yb2[NCN]3,hR66,167 R-3c 0.54751,0.54751,2.79696,90,90,120 - green 3.07 X 53626
C-Cr-N Cr3C1.52 N0.48 Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.2833,0.9249,0.6937,90,90,90 - - 6.61 X 15719
C-Cr-Nb NbCr2C0.024 MgZn2,hP12,194 P63/mmc 0.495,0.495,0.8088,90,90,120 Friauf-Laves phase - 7.63 F 38852
C-Cr-Nb Nb0.04 Cr2.96 C2 Cr3C2-b,oP20,62 Pnma 0.553,0.283,1.147,90,90,90 - - 6.72 A 38852
C-Cr-Nb Nb0.06 Cr6.94 C3 Cr7C3,hP80,186 P63mc 1.4035,1.4035,0.4539,90,90,120 - - 6.90 A 38852
C-Cr-Nb Nb0.38 Cr22.62 C6 Cr23 C6,cF116,225 Fm-3m 1.0678,1.0678,1.0678,90,90,90 - - 7.00 A 38852
C-Cr-Nb Nb0.74 Cr0.26 C0.72 NaCl,cF8,225 Fm-3m 0.4422,0.4422,0.4422,90,90,90 rocksalt family - 6.98 X 38852
C-Cr-Nb Nb0.91 Cr0.09 C0.01 W,cI2,229 Im-3m 0.3246,0.3246,0.3246,90,90,90 b.c.c. family - 8.68 F 38852
C-Cr-Nb Nb0.97 Cr0.03 C0.5 NiAs,hP4,194 P63/mmc 0.3118,0.3118,0.496,90,90,120 AlB2 family - 7.77 X 38852
C-Cr-Nb Nb1.06 Cr1.94C0.024 MgCu2,cF24,227 Fd-3m 0.6982,0.6982,0.6982,90,90,90 Friauf-Laves phase - 7.79 F 38852
C-Cr-Nb Nb3 Cr3C W3Fe3C,cF112,227 Fd-3m 1.149,1.149,1.149,90,90,90 η-carbide - 7.82 A 497
C-Cr-Ni Cr0.14 Ni0.86 C0.031 Cu,cF4,225 Fm-3m 0.35464,0.35464,0.35464,90,90,90 close-packed structure - 8.66 F 36099
C-Cr-Ni Cr2.965 Ni0.035 C2 Cr3C2-b,oP20,62 Pnma 0.5537,0.2831,1.148,90,90,90 - - 6.65 A 36099
C-Cr-Ni Cr21.26 Ni1.74 C6 Cr23 C6,cF116,225 Fm-3m 1.0636,1.0636,1.0636,90,90,90 - - 7.06 A 6311
C-Cr-Ni Cr6.5 Ni0.5 C3 Cr7C3,hP80,186 P63mc 1.405,1.405,0.4504,90,90,120 - - 6.96 A 6311
356 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Cr-O Cr[CO]6 Cr[CO]6,oP52,62 Pnma 1.1474,1.0894,0.61885,90,90,90 - yellow pale 1.89 X 42656


C-Cr-P Cr3PC Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.3054,0.9704,0.7299,90,90,90 - - 6.11 A 4188
C-Cr-P Cr6P 2.55 C0.45 K2UF6,hP9,189 P-62m 0.6136,0.6136,0.3227,90,90,120 Fe2P family - 6.26 X 6167
C-Cr-P Cr8P 6C Cr8.1P6C0.75 ,hP17,162 P-31m 0.6676,0.6676,0.4608,90,90,120 - - 5.73 X 30298
C-Cr-Pt Cr0.5Pt0.5 C0.1 NaCl,cF8,225 Fm-3m 0.383,0.383,0.383,90,90,90 rocksalt family - 14.75 X 12895
C-Cr-Pt Cr2.22Pt1.78 C CaTiO3,cP5,221 Pm-3m 0.382,0.382,0.382,90,90,90 perovskite family - 14.14 X 2739
C-Cr-Pu PuCr2C2 *,t**,* - 0.3656,0.3656,1.5809,90,90,90 - - - N 12917
C-Cr-Re Cr0.533 Re0.467 C0.005 (Cr0.49 Fe0.51),tP30,136 P42 /mnm 0.9191,0.9191,0.478,90,90,90 Frank-Kasper phase - 14.16 F 38852
C-Cr-Re Cr0.60 Re0.40 C0.28 Mg,hP2,194 P63 /mmc 0.2789,0.2789,0.4444,90,90,120 close-packed structure - 12.10 F 38852
C-Cr-Re Cr0.621 Re0.379 C0.002 W,cI2,229 Im-3m 0.2972,0.2972,0.2972,90,90,90 b.c.c. family - 13.02 F 38852
C-Cr-Re Cr1.56 Re0.44 C0.86 W2C,hP11,162 P-31m 0.49281,0.49281,0.44774,90,90,120 close-packed structure - 9.17 X 41644
C-Cr-Re Cr18.07 Re4.93 C6 Cr23C6,cF116,225 Fm-3m 1.0797,1.0797,1.0797,90,90,90 - - 10.18 A 38852
C-Cr-Re Cr2.85 Re0.15 C2 Cr3C2-b,oP20,62 Pnma 0.556,0.2835,1.15,90,90,90 - - 7.33 A 38852
C-Cr-Re Cr6.92 Re0.08 C3 Cr7C3,hP80,186 P63 mc 1.4082,1.4082,0.4545,90,90,120 - - 6.99 A 38852
C-Cr-Rh Cr0.45 Rh0.55 C0.18 ht NaCl,cF8,225 Fm-3m 0.378,0.378,0.378,90,90,90 rocksalt family - 10.10 X 16396
C-Cr-Ru Cr0.3 Ru0.7 C0.22 NaCl,cF8,225 Fm-3m 0.3841,0.3841,0.3841,90,90,90 rocksalt family - 10.43 X 16396
C-Cr-Sc ScCrC2 ht ScCrC2,hP8,194 P63 /mmc 0.3237,0.3237,0.9149,90,90,120 - gray light 4.84 X 30690
C-Cr-Sc ScCrC2 rt ScCrC2,oP16,59 Pmmn 0.32434,0.915,0.56148,90,90,90 - gray light 4.82 X 30690
C-Cr-Sc Sc2CrC3 Sc2CrC3,oP24,55 Pbam 0.5809,1.411,0.3271,90,90,90 - - 4.41 X 24070
C-Cr-Si Cr4.8 Si2.9 C0.3 CuHf5Sn3,hP18,193 P63 /mcm 0.69835,0.69835,0.47426,90,90,120 AlB2 family - 5.55 A 43947
C-Cr-Sm Sm2Cr2C3 Ho2Cr2C3,mS14,12 C12/m1 1.0544,0.3468,0.5689,90,105.57,90 - - 7.31 X 53428
C-Cr-Ta TaCr2C0.03 MgZn2,hP12,194 P63 /mmc 0.4926,0.4926,0.8081,90,90,120 Friauf-Laves phase - 11.16 F 38852
C-Cr-Ta Ta0.03 Cr2.97 C2 Cr3C2-b,oP20,62 Pnma 0.5532,0.284,1.149,90,90,90 - - 6.77 A 38852
C-Cr-Ta Ta0.05 Cr6.95 C3 Cr7C3,hP80,186 P63 mc 1.403,1.403,0.4528,90,90,120 - - 7.00 A 38852
C-Cr-Ta Ta0.29 Cr22.71 C6 Cr23C6,cF116,225 Fm-3m 1.0691,1.0691,1.0691,90,90,90 - - 7.10 A 38852
C-Cr-Ta Ta0.82 Cr0.18 C0.82 NaCl,cF8,225 Fm-3m 0.4415,0.4415,0.4415,90,90,90 rocksalt family - 12.94 X 38852
C-Cr-Ta Ta0.90 Cr0.10 C0.02 W,cI2,229 Im-3m 0.3269,0.3269,0.3269,90,90,90 b.c.c. family - 16.00 F 38852
C-Cr-Ta Ta0.98 Cr0.02 C0.41 NiAs,hP4,194 P63 /mmc 0.3101,0.3101,0.4937,90,90,120 AlB2 family - 14.81 X 38852
C-Cr-Tb Tb2Cr2C3 Ho2Cr2C3,mS14,12 C12/m1 1.0493,0.3404,0.5606,90,105.93,90 - - 7.90 A 40407
C-Cr-Ti Ti0.5 Cr0.5 C0.8 NaCl,cF8,225 Fm-3m 0.4217,0.4217,0.4217,90,90,90 rocksalt family - 5.28 X 23313
C-Cr-Ti Ti1.45 Cr21.55 C6 Cr23C6,cF116,225 Fm-3m 1.0651,1.0651,1.0651,90,90,90 - - 6.94 A 3222
C-Cr-Tm Tm2Cr2C3 Ho2Cr2C3,mS14,12 C12/m1 1.05,0.33295,0.5482,90,106.61,90 - - 8.64 A 19771
C-Cr-U UCrC2 UMoC2,oP16,62 Pnma 0.5438,0.3219,1.0637,90,90,90 - - 11.20 A 19771
C-Cr-U UCr4C4 UCr4C4,tI18,87 I4/m 0.79363,0.79363,0.30754,90,90,90 - - 8.47 X 20503
C-Cr-U U2Cr2C5 *,oS36,64 Cmce 1.5746,0.5142,0.5142,90,90,90 - - 10.21 N 21977
C-Cr-V VCrC Fe2N0.94 ,oP12,60 Pbcn 0.4482,0.57,0.497,90,90,90 - - 6.01 A 2736
C-Cr-V V0.52 Cr0.48 C0.5 ht NiAs,hP4,194 P63 /mmc 0.2843,0.2843,0.44,90,90,120 AlB2 family - 6.20 X 4268
C-Cr-V V0.6 Cr0.4 C NaCl,cF8,225 Fm-3m 0.4131,0.4131,0.4131,90,90,90 rocksalt family - 5.97 X 2736
C-Cr-V V0.9 Cr2.1 C1.44 (V0.3 Cr0.7)3C1.44 ,oS20,63 Cmcm 0.2876,0.931,0.6987,90,90,90 - - 6.12 X 13353
C-Cr-V V1.72 Cr0.28 C0.86 rt Fe2N0.94 ,oP12,60 Pbcn 0.4534,0.5722,0.5008,90,90,90 - - 5.75 A 3221
C-Cr-V V4Cr19C6 Cr23C6,cF116,225 Fm-3m 1.0724,1.0724,1.0724,90,90,90 - - 6.81 A 2736
C-Cr-W Cr0.3W0.7 C0.5 ht2 NiAs,hP4,194 P63 /mmc 0.296,0.296,0.469,90,90,120 AlB2 family - 14.03 X 3721
C-Cr-W Cr0.4W0.6 C0.9 ht NaCl,cF8,225 Fm-3m 0.4193,0.4193,0.4193,90,90,90 rocksalt family - 12.79 X 3721
C-Cr-W Cr1.8W0.2 C Fe2N0.94 ,oP12,60 Pbcn 0.4484,0.5691,0.496,90,90,90 - - 7.47 A 2331
C-Cr-W Cr2.57 W0.43 C2 Cr3C2-b,oP20,62 Pnma 0.559,0.2849,1.1545,90,90,90 - - 8.55 A 2331
C-Cr-W Cr20.4 W2.6 C6 Cr23C6,cF116,225 Fm-3m 1.076,1.076,1.076,90,90,90 - - 8.59 A 3721
C-Cr-W Cr3W10C3.5 W10Co3C3.4 ,hP34,194 P63 /mmc 0.7755,0.7755,0.7764,90,90,120 - - 16.73 A 8598
C-Cr-W Cr6.6W0.4 C3 Cr7C3,hP80,186 P63 mc 1.41,1.41,0.4543,90,90,120 - - 7.69 A 2331
C-Cr-Y Y1.8 Cr0.2 C2.9 Pu2C3,cI40,220 I-43d 0.82384,0.82384,0.82384,90,90,90 - - 4.88 A 4710
C-Cr-Y Y2Cr2C3 Ho2Cr2C3,mS14,12 C12/m1 1.0472,0.3392,0.5549,90,106.27,90 - - 5.58 A 19771
C-Cs-Cu CsCuC2 CsAgC2,tP8,131 P42 /mmc 0.49406,0.49406,0.9142,90,90,90 - gray 3.28 X 40776
C-Cs-K CsK2[C70] cubic Cu2MnAl,cF16,225 Fm-3m 1.52342,1.52342,1.52342,90,90,90 fullerene family - 1.98 X 40115
C-Cs-Li CsLi2[C60 ] Cu2MnAl,cF16,225 Fm-3m 1.40746,1.40746,1.40746,90,90,90 fullerene family - 2.07 X 29450
C-Cs-Li CsLi3[C60 ] hp2 CsLi3[C60 ],mP24,14 P121/c1 0.9362,1.4061,1.36063,90,133.419,90 fullerene family - 2.23 X 35647
C-Cs-Li CsLi3[C60 ] ht Cu0.5 Mn0.25 Cl,cF48,225 Fm-3m 1.4111,1.4111,1.4111,90,90,90 fullerene family - 2.07 X 35647
C-Cs-Li CsLi3[C60 ] rt-hp1 CsLi3[C60 ],cP48,205 Pa-3 1.4068,1.4068,1.4068,90,90,90 fullerene family - 2.09 X 35647
C-Cs-N CsCN5 CsCN5,mP28,14 P121/c1 0.44393,0.87151,1.186,90,93.83,90 - yellow 3.12 X 55740
C-Cs-N Cs[CN] lt *,hR*,* - 0.5777,0.5777,0.77558,90,90,120 - - - N 16712
C-Cs-N Cs[CN] rt K[CN],cP9,221 Pm-3m 0.42728,0.42728,0.42728,90,90,90 - - 3.38 A 41104
C-Cs-N Cs[NC2N2 ] Cs[NC2N2 ],mS48,15 C12/c1 0.9385,1.2702,0.8261,90,110.94,90 - - 2.87 X 24402
C-Cs-Na CsNa2[C60 ] rt CsNa2[C60 ],cP492,205 Pa-3 1.40458,1.40458,1.40458,90,90,90 fullerene family - 2.16 X 29449
C-Cs-Na CsNa2[C70 ] cub Cu2MnAl,cF16,225 Fm-3m 1.489,1.489,1.489,90,90,90 fullerene family - 2.05 X 40115
C-Cs-Na CsNa2[C70 ] mon CsNa2[C70 ],mS8,12 C12/m1 1.81897,1.0406,1.04905,90,125.22,90 fullerene family - 2.09 X 40115
C-Cs-Na CsNa2[C70 ] rhom Na3Hg,hR12,166 R-3m 1.032,1.032,2.611,90,90,120 fullerene family - 2.11 X 40115
C-Cs-O Cs2[CO3] ht *,oP*,* - 0.6153,0.8269,1.0349,90,90,90 - - - N 37479
C-Cs-O Cs2[CO3] mon K2[CO3],mP24,14 P121/c1 0.6126,1.0277,0.8148,90,95.85,90 - - 4.24 X 13771
C-Cs-O Cs2[C2O4] ht1 Rb2[C2O4],oP56,62 Pnma 0.86378,0.67824,1.12733,90,90,90 - - 3.56 X 44416
C-Cs-O Cs2[C2O4] ht2 K2[C2O4],hP148,194 P63 /mmc 0.66333,0.66333,0.88411,90,90,120 - - 3.49 X 44416
C-Cs-O Cs2[C2O4] mon2 Cs2[C2O4],mP32,14 P121/c1 0.66215,1.10038,0.86125,90,97.139,90 - - 3.77 X 41509
C-Cs-O Cs2[C4O4] mon1 Rb2[C4O4],mS20,12 C12/m1 1.11768,0.70453,0.47424,90,92.89,90 - - 3.36 X 45783
C-Cs-O Cs2[OC2O] K2[OC2O],tI12,139 I4/mmm 0.4371,0.4371,1.3523,90,90,90 - colorless 4.14 X 2406
C-Cs-Pd Cs2PdC2 Na2PdC2,hP5,164 P-3m1 0.56236,0.56236,0.52976,90,90,120 - - 4.53 X 39429
C-Cs-Pt Cs2PtC2 Na2PdC2,hP5,164 P-3m1 0.56301,0.56301,0.52294,90,90,120 - - 5.61 X 39429
C-Cs-Rb CsRb2[C60 ] K3[C60],cF492,225 Fm-3m 1.44595,1.44595,1.44595,90,90,90 fullerene family - 2.25 A 29463
C-Cs-S Cs2[C6S10 ] Cs2[C6S10 ],oP72,60 Pbcn 1.8832,0.9792,0.9217,90,90,90 - yellow 2.57 X 54217
C-Cu-K KCuC2 CsAgC2,tP8,131 P42 /mmc 0.49098,0.49098,0.76078,90,90,90 - gray 2.29 X 40776
C-Cu-N Cu[CC3N3 ][NC2N2] Co[CC3N3 ][NC2N2],oS52,40 Ama2 0.71884,1.76983,0.57395,90,90,90 - - 2.00 X 37005
C-Cu-N Cu[CN] ht Ag[CN],hR9,166 R-3m 0.59711,0.59711,0.48433,90,90,120 - off-white 2.98 X 42497
Handbook of Inorganic Substances – Edition 2015 : Data 357

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Cu-N Cu[CN] rt Cu[CN],oS108,20 C222 1 0.79024,1.26403,1.79364,90,90,90 - colorless 2.99 X 42563


C-Cu-N Cu[NCN] Cu[NCN],oS16,63 Cmcm 0.29921,0.61782,0.94003,90,90,90 - black 3.96 X 45858
C-Cu-Na NaCuC2 KAgC2,tP4,123 P4/mmm 0.37661,0.37661,0.49595,90,90,90 - gray 2.61 X 40776
C-Cu-Na NaCu5C6 rt NaCu5C6,oP48,62 Pnma 0.7328,1.09963,0.72615,90,90,90 - orange 4.69 X 43941
C-Cu-O Cu[CO3] Cu[CO3],mS10,8 C1m1 0.6092,0.4493,0.3515,90,101.34,90 - - 4.35 X 8640
C-Cu-O Cu[C4O4] Cu[C4O4],mS36,15 C12/c1 1.06869,0.89394,0.56747,90,117.596,90 - brown 2.43 X 45699
C-Cu-Rb RbCuC2 tet1 CsAgC2,tP8,131 P42/mmc 0.49263,0.49263,0.8285,90,90,90 - gray 2.86 X 40776
C-Cu-Rb RbCuC2 tet2 KAgC2,tP4,123 P4/mmm 0.44612,0.44612,0.4918,90,90,90 - gray 2.94 X 40776
C-D-N [ND4][NC2N2] rt [NH4][NC2N2],mP24,14 P121/c1 0.37328,1.23177,0.91303,90,91.596,90 - white 1.39 X 42005
C-D-Nb NbC0.71 D0.3 NaCl,cF8,225 Fm-3m 0.44413,0.44413,0.44413,90,90,90 rocksalt family - 7.74 X 52496
C-D-Nb Nb2 C1.52 D0.34 Nb2C0.9(C0.66 H0.34),oP4,47 Pmmm 0.31375,0.31429,0.44456,90,90,90 - - 7.76 X 52496
C-D-O D2[C2O4][D2O]2 mon1 H2[C2O4][H2O]2-a,mP16,14 P121/c1 0.615,0.3612,1.19291,90,103.265,90 - colorless 1.70 X 4413
C-D-O D2[C2O4][D2O]2 mon2 H2[C2O4][H2O]2-b,mP16,14 P121/c1 0.5148,0.5052,1.0021,90,99.27,90 - colorless 1.71 X 3375
C-D-Ti TiC0.48 D0.60 Cu2MnAl,cF16,225 Fm-3m 0.43096,0.43096,0.43096,90,90,90 b.c.c. family - 4.55 X 41680
C-D-Ti Ti2CD1.414 Ce2SO2,hP5,164 P-3m1 0.30821,0.30821,0.50405,90,90,120 - - 4.43 X 41680
C-D-Y Y2CD2 Ce2SO2,hP5,164 P-3m1 0.36556,0.36556,0.59973,90,90,120 - - 4.64 X 41646
C-D-Y Y2CD2.55 Y2CH2.55 ,hP18,162 P-31m 0.63124,0.63124,0.5932,90,90,120 - - 4.74 X 41646
C-D-Zr ZrC0.62 D0.28 NaCl,cF8,225 Fm-3m 0.46792,0.46792,0.46792,90,90,90 rocksalt family - 6.43 X 3661
C-Dy-Er Dy0.5 Er0.5C2 CaC2,tI6,139 I4/mmm 0.365,0.365,0.614,90,90,90 - - 7.67 A 14292
C-Dy-Fe DyFeC2 CeNiC2,oS8,38 Amm2 0.3597,0.4553,0.5993,90,90,90 - - 8.20 A 19068
C-Dy-Fe Dy15 Fe8C25 Er15 Fe8C25,hP49,150 P321 1.19323,1.19323,0.51429,90,90,120 - gray 8.34 X 53632
C-Dy-Fe Dy2 FeC4 Er2FeC4,oI28,72 Ibam 0.7514,0.9594,0.50509,90,90,90 - gray 7.82 A 20407
C-Dy-Fe Dy2 Fe14C Nd2Fe14B,tP68,136 P42/mnm 0.87387,0.87387,1.17914,90,90,90 - - 8.25 X 24965
C-Dy-Fe Dy2 Fe17C rhom Pr2Mn17C1.77 ,hR66,166 R-3m 0.85732,0.85732,1.24599,90,90,120 CaCu5-Zr4Al3 - 8.08 X 23584
C-Dy-Fe Dy2 Fe17C2 hex Tb2Mn17C2.5 ,hP44,194 P63/mmc 0.863,0.863,0.842,90,90,120 CaCu5-Zr4Al3 - 7.94 A 27495
C-Dy-Fe Dy7 Fe49C3 Dy7Fe49C3,hP62,147 P-3 0.859,0.859,1.2519,90,90,120 CaCu5-Zr4Al3 - 8.12 X 22474
C-Dy-Ga Dy3 GaC CaTiO3,cP5,221 Pm-3m 0.4831,0.4831,0.4831,90,90,90 perovskite family - 8.38 X 33965
C-Dy-Gd Gd0.51 Dy0.49 C2 CaC2,tI6,139 I4/mmm 0.3693,0.3693,0.6221,90,90,90 - - 7.20 A 12408
C-Dy-Ho Dy0.5 Ho0.5 C2 CaC2,tI6,139 I4/mmm 0.3668,0.3668,0.6169,90,90,90 - - 7.51 A 14292
C-Dy-I Dy12 C6I17 Gd12 C6I17,mS140,15 C12/c1 1.9149,1.2069,1.8595,90,90.54,90 - black 6.46 X 49741
C-Dy-I Dy2 CI3 Dy2CI3,oP52,58 Pnnm 1.3622,1.4335,0.8396,90,90,90 - black 5.82 X 49741
C-Dy-I Dy5 C2I9 Gd5C2Cl9,mP64,14 P121/c1 1.047,1.7152,1.3983,90,121.14,90 - black 6.12 X 49741
C-Dy-I Dy7 C2I12 Dy7C2I12,hR93,148 R-3 1.5233,1.5233,1.0649,90,90,120 - black 6.25 X 59447
C-Dy-In Dy3 InC CaTiO3,cP5,221 Pm-3m 0.4888,0.4888,0.4888,90,90,90 perovskite family - 8.74 X 33965
C-Dy-La La0.5 Dy0.5 C2 CaC2,cF36,225 Fm-3m 0.575,0.575,0.575,90,90,90 - - 6.10 A 9939
C-Dy-La La0.74 Dy0.26 C2 CaC2,tI6,139 I4/mmm 0.389,0.389,0.6422,90,90,90 - - 5.78 A 9939
C-Dy-Mn Dy10.14 Mn12.86 C18 Dy10 (Dy0.14 Mn0.86)Mn12C18,cI82,217 I-43m 1.0138,1.0138,1.0138,90,90,90 - gray silver 8.19 X 27414
C-Dy-Mn Dy12 Mn5C15 La12 Re5C15,hP32,189 P-62m 1.0468,1.0468,0.5038,90,90,120 - black 8.35 X 31743
C-Dy-Mn Dy2 Mn17C3 Tb2Mn17C2.5 ,hP44,194 P63/mmc 0.8715,0.8715,0.8515,90,90,120 CaCu5-Zr4Al3 - 7.68 A 20415
C-Dy-Mo DyMoC2 UMoC2,oP16,62 Pnma 0.5636,0.3371,1.0822,90,90,90 - - 9.13 A 19771
C-Dy-Mo Dy2 Mo2C3 Er2Mo 2C3,mS14,12 C12/m1 1.17239,0.33335,0.56997,90,112.14,90 - gray dark 8.90 X 49565
C-Dy-N Dy2 [NCN]3 Sm2 [NCN]3,mS22,12 C12/m1 1.4287,0.37901,0.5224,90,95.66,90 - - 5.25 A 46500
C-Dy-Nd Nd0.54 Dy0.46 C2 CaC2,tI6,139 I4/mmm 0.3744,0.3744,0.628,90,90,90 - - 6.67 A 14292
C-Dy-Ni DyNiC2 CeNiC2,oS8,38 Amm2 0.35707,0.45075,0.6041,90,90,90 - - 8.38 X 19068
C-Dy-Ni Dy11 Ni60C6 Yb11 Ni60C6,cI154,229 Im-3m 1.2495,1.2495,1.2495,90,90,90 - - 9.16 A 26067
C-Dy-Ni Dy2 Ni22C3 Ce2Ni22C2.75,oS216,64 Cmce 1.1334,1.4957,1.4539,90,90,90 - - 8.91 A 26142
C-Dy-Ni Dy4 Ni13C4 Er4Ni13C4,oS42,65 Cmmm 1.1714,1.2007,0.389,90,90,90 - - 8.87 A 25377
C-Dy-O Dy2 [CO3]O2 Nd2[CO3]O2,hP24,194 P63/mmc 0.3869,0.3869,1.5163,90,90,120 - colorless 7.05 X 36639
C-Dy-Os Dy12 Os5C15 La12 Re5C15,hP32,189 P-62m 1.066,1.066,0.5041,90,90,120 - - 10.31 A 34625
C-Dy-Os Dy2 OsC2 Pr2ReC2,oP20,62 Pnma 0.6424,0.5097,0.9753,90,90,90 - - 11.22 A 33350
C-Dy-Pb Dy3 PbC CaTiO3,cP5,221 Pm-3m 0.4868,0.4868,0.4868,90,90,90 perovskite family - 10.17 X 33965
C-Dy-Pr Pr0.5 Dy0.5C2 CaC2,tI6,139 I4/mmm 0.3757,0.3757,0.6309,90,90,90 - - 6.55 A 14292
C-Dy-Re Dy12 Re5C15 La12 Re5C15,hP32,189 P-62m 1.0683,1.0683,0.5083,90,90,120 - gray dark 10.12 A 29688
C-Dy-Re Dy2 ReC2 Pr2ReC2,oP20,62 Pnma 0.65433,0.50987,0.98308,90,90,90 - - 10.84 X 31911
C-Dy-Rh DyRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.4127,0.4127,0.4127,90,90,90 perovskite family - 11.33 X 6791
C-Dy-Rh Dy8 Rh5C12 Er8Rh5C12,mS50,12 C12/m1 2.7791,0.35409,0.7366,90,93.8,90 - - 8.99 A 22276
C-Dy-Ru DyRu3C CaTiO3,cP5,221 Pm-3m 0.4124,0.4124,0.4124,90,90,90 perovskite family - 11.31 X 30191
C-Dy-Ru Dy3 Ru2C5 Gd3Ru2C5,hP50,176 P63/m 1.1396,1.1396,0.5007,90,90,120 - gray dark 8.84 A 39177
C-Dy-Ru Dy7 Ru2C11 Er7Ru2C11,oS80,63 Cmcm 0.35221,1.6595,1.9732,90,90,90 - gray 8.48 A 28260
C-Dy-Si Dy15 Si9C La15 FeGe9,hP50,186 P63mc 1.4537,1.4537,0.6348,90,90,120 - - 7.73 A 56529
C-Dy-Si Dy3 Si2C2 Tb3Si2C2,oP32,57 Pbcm 0.4203,0.7675,1.5611,90,90,90 - gray 7.49 X 39069
C-Dy-Sm Sm0.5 Dy0.5 C2 CaC2,tI6,139 I4/mmm 0.3714,0.3714,0.6244,90,90,90 - - 6.96 A 14292
C-Dy-Sn Dy3 SnC CaTiO3,cP5,221 Pm-3m 0.4853,0.4853,0.4853,90,90,90 perovskite family - 8.98 X 33965
C-Dy-Tb Tb0.5 Dy0.5 C2 CaC2,tI6,139 I4/mmm 0.3683,0.3683,0.6194,90,90,90 - - 7.30 A 14292
C-Dy-Th Th1.8 Dy0.2 C3 ht-hp Pu2C3,cI40,220 I-43d 0.85482,0.85482,0.85482,90,90,90 - - 10.34 A 7468
C-Dy-Tl TlDy3C CaTiO3,cP5,221 Pm-3m 0.4877,0.4877,0.4877,90,90,90 perovskite family - 10.08 X 33965
C-Dy-W DyWC2 UMoC2,oP16,62 Pnma 0.5909,0.35598,1.11315,90,90,90 - - 10.51 A 34411
C-Dy-Y Y0.56 Dy0.44 C2 CaC2,tI6,139 I4/mmm 0.3671,0.3671,0.6178,90,90,90 - - 5.80 A 14292
C-Er-Fe ErFeC2 CeNiC2,oS8,38 Amm2 0.3531,0.4543,0.598,90,90,90 - - 8.56 A 19068
C-Er-Fe Er15 Fe8C25 Er15 Fe8C25,hP49,150 P321 1.18602,1.18602,0.50885,90,90,120 - gray 8.72 X 53632
C-Er-Fe Er2FeC4 Er2FeC4,oI28,72 Ibam 0.7506,0.9426,0.50059,90,90,90 - gray 8.22 X 20407
C-Er-Fe Er2Fe 14C Nd2Fe14B,tP68,136 P42/mnm 0.87213,0.87213,1.17475,90,90,90 - - 8.39 X 24965
C-Er-Fe Er2Fe 17C2 hex Tb2Mn17C2.5 ,hP44,194 P63/mmc 0.863,0.863,0.844,90,90,120 CaCu5-Zr4Al3 - 7.98 A 27495
C-Er-Fe Er2Fe 17C3 rhom Pr2Mn17C1.77 ,hR66,166 R-3m 0.8662,0.8662,1.2636,90,90,120 CaCu5-Zr4Al3 - 8.01 A 28854
C-Er-Ga Er3GaC CaTiO3,cP5,221 Pm-3m 0.478,0.478,0.478,90,90,90 perovskite family - 8.87 X 33965
C-Er-In Er3InC CaTiO3,cP5,221 Pm-3m 0.4831,0.4831,0.4831,90,90,90 perovskite family - 9.26 X 33965
C-Er-La La0.5 Er0.5 C2 CaC2,cF36,225 Fm-3m 0.5685,0.5685,0.5685,90,90,90 - - 6.40 A 7487
C-Er-Mn ErMn12C0.86 Y(Ti0.25 Fe0.75)4Fe8N0.5 ,tI28,139 I4/mmm 0.86471,0.86471,0.48312,90,90,90 CaCu5-Zr4Al3 - 7.69 X 39050
358 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Er-Mn Er10Mn13C18 Dy10(Dy0.14 Mn0.86)Mn12C18 ,cI82,217 I-43m 1.0077,1.0077,1.0077,90,90,90 - - 8.45 A 27414


C-Er-Mn Er12Mn5C15 La12Re5C15 ,hP32,189 P-62m 1.0394,1.0394,0.498,90,90,120 - black 8.77 A 31743
C-Er-Mn Er2MnC4 Er2FeC4,oI28,72 Ibam 0.7598,0.9359,0.5038,90,90,90 - gray 8.11 X 28182
C-Er-Mn Er2Mn17C3 Tb2Mn17C2.5 ,hP44,194 P63 /mmc 0.8678,0.8678,0.8506,90,90,120 CaCu5-Zr4Al3 - 7.81 A 20415
C-Er-Mo ErMoC2 UMoC2,oP16,62 Pnma 0.5604,0.33308,1.077,90,90,90 - - 9.49 A 19771
C-Er-Mo Er2Mo2C3 Er2Mo2C3 ,mS14,12 C12/m1 1.15995,0.33115,0.56568,90,111.302,90 - - 9.23 X 36072
C-Er-N Er2[NCN]3 Sm2[NCN]3,mS22,12 C12/m1 1.4184,0.37471,0.52051,90,95.559,90 - - 5.48 A 46500
C-Er-Ni ErNiC2 CeNiC2,oS8,38 Amm2 0.3496,0.4481,0.6005,90,90,90 - - 8.83 X 24951
C-Er-Ni Er11Ni60C6 Yb11Ni60C6,cI154,229 Im-3m 1.2459,1.2459,1.2459,90,90,90 - - 9.33 A 26067
C-Er-Ni Er4Ni13C4 Er4Ni13C4 ,oS42,65 Cmmm 1.1694,1.1975,0.3856,90,90,90 - - 9.10 X 24066
C-Er-Ni Er4Ni2C5 rt Yb4Ni2C5,oP11,25 Pmm2 0.3576,1.1494,0.368,90,90,90 - gray silver 9.29 A 28173
C-Er-Os Er12Os5C15 La12Re5C15 ,hP32,189 P-62m 1.0623,1.0623,0.5026,90,90,120 - - 10.61 A 34625
C-Er-Os Er2OsC2 Pr2ReC2,oP20,62 Pnma 0.64045,0.50341,0.96668,90,90,90 - - 11.70 A 33350
C-Er-Pb Er3PbC CaTiO3,cP5,221 Pm-3m 0.4817,0.4817,0.4817,90,90,90 perovskite family - 10.71 X 3196
C-Er-Re Er12Re5C15 La12Re5C15 ,hP32,189 P-62m 1.0628,1.0628,0.501,90,90,120 - gray dark 10.57 A 29688
C-Er-Re Er2ReC2 Pr2ReC2,oP20,62 Pnma 0.6499,0.50353,0.97431,90,90,90 - - 11.35 X 23790
C-Er-Re Er5Re2C7 Sc5Re2C7,oS28,65 Cmmm 0.7929,1.4394,0.33802,90,90,90 - gray dark 11.13 A 33968
C-Er-Rh ErRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.4105,0.4105,0.4105,90,90,90 perovskite family - 11.63 X 6791
C-Er-Rh Er8Rh5C12 Er8Rh5C12 ,mS50,12 C12/m1 2.7726,0.34909,0.7298,90,94.17,90 - - 9.41 X 22276
C-Er-Ru ErRu3C CaTiO3,cP5,221 Pm-3m 0.4117,0.4117,0.4117,90,90,90 perovskite family - 11.48 X 30191
C-Er-Ru Er10Ru10C19 Er10Ru10C19,mS78,8 C1m1 1.4578,0.7219,1.0004,90,111.36,90 - - 9.86 X 34160
C-Er-Ru Er3Ru2C5 Gd3Ru2C5 ,hP50,176 P63 /m 1.1338,1.1338,0.4953,90,90,120 - gray dark 9.20 A 39177
C-Er-Ru Er5Ru5C9.5 orth1 Er5Ru5C9.5 ,oS62,38 Amm2 0.36097,1.8632,0.7289,90,90,90 - - 9.86 X 34160
C-Er-Ru Er5Ru5C9.5 orth2 Er5Ru5C9.5 ,oS40,38 Amm2 0.36097,1.8632,0.7289,90,90,90 - - 9.86 X 34160
C-Er-Ru Er7Ru2C11 Er7Ru2C11 ,oP96,62 Pnma 1.9506,0.34596,1.6503,90,90,90 - gray 8.98 X 28260
C-Er-Si Er15Si9C La15FeGe9 ,hP50,186 P63 mc 1.43975,1.43975,0.62787,90,90,120 - - 8.17 X 56617
C-Er-Si Er3Si2C2 Pr3Si2C2,oS20,65 Cmmm 0.3811,1.542,0.4172,90,90,90 - gray 7.88 A 34802
C-Er-Si Er4.76 Si2.66 C0.54 Er4.8 Si2.7 C0.5 ,hP54,187 P-6m2 1.441,1.441,0.6322,90,90,120 - - 7.69 X 15286
C-Er-Si Er5Si3C Er5Si3C,hP162,164 P-3m1 1.44,1.44,1.8,90,90,120 - - 8.62 X 15286
C-Er-Si Er5Si3C0.2 CuHf5Sn3,hP18,193 P63 /mcm 0.8316,0.8316,0.6279,90,90,120 AlB2 family - 8.15 A 15260
C-Er-Sn Er3SnC CaTiO3,cP5,221 Pm-3m 0.4806,0.4806,0.4806,90,90,90 perovskite family - 9.46 X 3196
C-Er-Th ThErC3 ht-hp Pu2C3,cI40,220 I-43d 0.8412,0.8412,0.8412,90,90,90 - - 9.72 A 7468
C-Er-Tl TlEr3C CaTiO3,cP5,221 Pm-3m 0.4824,0.4824,0.4824,90,90,90 perovskite family - 10.62 X 33965
C-Er-W ErWC2 UMoC2,oP16,62 Pnma 0.59143,0.36064,1.11201,90,90,90 - - 10.51 A 34411
C-Eu-N Eu[NCN] Sr[NCN],oP16,62 Pnma 1.23241,0.39526,0.53943,90,90,90 - orange red 4.85 X 42335
C-Eu-N Eu[NC2N2 ]3 Nd[NC2N2 ]3,oS64,63 Cmcm 0.7767,1.1351,1.0137,90,90,90 - white 2.60 X 45253
C-Eu-Ni Eu3.16 NiC6 Eu3.16 NiC6 ,hP22,176 P63 /m 0.8613,0.8613,0.5499,90,90,120 - - 5.74 X 32658
C-Eu-O Eu[CO3] Ca[CO3]-a,oP20,62 Pnma 0.603,0.5102,0.8422,90,90,90 - yellow 5.43 A 2063
C-Eu-Rh EuRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.414,0.414,0.414,90,90,90 perovskite family - 10.98 X 6791
C-Eu-Sr Sr0.5 Eu0.5 C2 ht CaC2,tI6,139 I4/mmm 0.41168,0.41168,0.6711,90,90,90 - - 4.20 X 55481
C-Eu-Sr Sr0.5 Eu0.5 C2 rt ThC2,mS12,15 C12/c1 0.70313,0.44274,0.76129,90,107.122,90 - - 4.22 X 55481
C-F-Gd Gd2CF2 Ce2SO2,hP5,164 P-3m1 0.37311,0.37311,0.6425,90,90,120 - brass 7.81 X 25514
C-F-Ge [C6F5]4Ge [C6F5]4Ge,tI180,88 I41/a 1.7277,1.7277,0.8122,90,90,90 - colorless 2.03 X 8211
C-F-Hg HgC4F6 HgC4F6,aP11,2 P-1 0.4956,0.5733,0.6394,104.57,109.32,107.16 - - 3.99 X 35771
C-F-Ho Ho2CF2 lt Ho2CF2,aP5,2 P-1 0.3651,0.36517,0.63085,89.879,89.808,60.107 - brown 8.65 X 26091
C-F-Ho Ho2CF2 rt Ce2SO2,hP5,164 P-3m1 0.36537,0.36537,0.63098,90,90,120 - brown 8.65 X 26091
C-F-I CIF5 CIF5,tI80,122 I-42d 0.8509,0.8509,1.2324,90,90,90 - colorless 3.48 X 34360
C-F-I C3IF2 ht C3IF2,mP24,14 P121/c1 0.8026,0.6069,0.9239,90,100.27,90 - - 3.01 X 14010
C-F-I [CF3]I rt CIF3,oS40,64 Cmce 0.75354,0.58491,1.9323,90,90,90 - - 3.06 X 28292
C-F-I [CF3]IF4 [CF3]IF4,mP36,14 P121/c1 0.7622,0.8429,0.8564,90,99.65,90 - yellowish 3.33 X 31030
C-F-I [C6F5]IF2 [C6F5]IF2,mP112,14 P121/c1 2.2901,0.9131,0.7721,90,99.01,90 - - 2.77 X 38138
C-F-N C2[CN]F3 mon1 C2[CN]F3-a,mP56,14 P121/c1 0.5599,0.8828,0.92343,90,115.4,90 - - 1.72 X 37198
C-F-N C2[CN]F3 mon2 C2[CN]F3-b,mP56,14 P121/c1 0.5421,0.8748,0.90867,90,112.74,90 - - 1.79 X 37198
C-F-N C3[CN]F2 C3[CN]F2,oP224,61 Pbca 1.0462,1.3343,2.1991,90,90,90 - colorless 1.73 X 25772
C-F-N [CF3]5[C59 N] [CF3]5[C59 N],oP640,61 Pbca 1.73007,2.03568,2.00148,90,90,90 fullerene family red 2.01 X 55632
C-F-N [C6F5][CN] lt [C6F5][CN],oS104,64 Cmce 0.7611,0.9427,1.8603,90,90,90 - colorless 1.92 X 27042
C-F-O C12O2F8 C12O2F8,mP44,14 P121/c1 0.5894,0.9966,1.00153,90,118.686,90 - colorless 2.11 X 13161
C-F-O C2O3F2 C2O3F2,oP56,19 P212121 0.6527,0.7027,1.6191,90,90,90 - - 1.97 X 43031
C-F-O C3OF2 C3OF2,mP24,14 P121/c1 0.669,0.5405,0.9107,90,106.15,90 - yellow 1.89 X 8001
C-F-O C6OF7 C6OF7,oF224,70 Fddd 0.95781,1.63763,1.74396,90,90,90 - colorless 2.15 X 29771
C-F-O [CF3]2O3 [CF3]2O3,aP22,2 P-1 0.481,0.7477,0.7993,78.91,86.12,83.49 - - 2.21 X 29750
C-F-O [C2F5]4[C60 ]O [C2F5]4[C60 ]O,aP178,2 P-1 1.01145,1.23096,1.88423,80.148,78.049,74.893 fullerene family orange red 1.83 X 46543
C-F-Os [C6F6]Os2 F11 [C6F6]Os2 F11,hP150,152 P3121 0.89858,0.89858,2.87388,90,90,120 - - 3.84 X 57863
C-F-P PCF3 mon PCF3,mP100,14 P121/c1 0.987,0.978,1.73575,90,110.646,90 - - 2.12 X 1369
C-F-P PCF3 tet PCF3,tP40,137 P42 /nmc 1.01,1.01,0.6397,90,90,90 - colorless 2.04 X 1604
C-F-P [C2F5]3P [C2F5]3P,hR132,148 R-3 1.3459,1.3459,1.0811,90,90,120 - colorless 2.28 X 54106
C-F-P [C6F5]3P [C6F5]3P,mP136,14 P121/c1 0.7194,1.793,1.3834,90,94.29,90 - colorless 1.99 X 22072
C-F-P [C6F5]3PF2 PC18F17,oP144,60 Pbcn 0.8903,1.1152,1.8269,90,90,90 - - 2.09 X 8760
C-F-S [CF3]CSF3 mon1 [CF3]CSF3 ,mP18,4 P1211 0.5667,0.7599,0.6298,90,105.59,90 - - 2.16 X 18003
C-F-S [CF3]CSF3 mon2 [CF3]CSF3 ,mP36,14 P121/c1 0.6571,0.5612,1.4382,90,117.057,90 - colorless 2.39 X 18003
C-F-S [C6F5]2S [C6F5]2S,tP92,92 P41212 0.569,0.569,3.7858,90,90,90 - - 1.98 X 22959
C-F-Sb [C6F6]Sb2 F11 [C6F6]Os2 F11,hP150,152 P3121 0.9058,0.9058,2.9079,90,90,120 - - 3.08 X 57863
C-F-Se SeC6F4 SeC6F4,mP88,14 P121/c1 0.6637,0.9162,2.1498,90,107.161,90 - colorless 2.41 X 13158
C-F-Si [C6F5]4Si [C6F5]4Ge,tI180,88 I41/a 1.7165,1.7165,0.8125,90,90,90 - - 1.93 X 11288
C-F-Sn [C6F5]4Sn [C6F5]4Ge,tI180,88 I41/a 1.7738,1.7738,0.8094,90,90,90 - colorless 2.05 X 8211
C-F-Te Te2C2F4 rt Te2C2F4,mP32,4 P1211 0.7053,1.1361,0.7482,90,91.43,90 - red violet 3.94 X 27526
C-F-Te [CF3]Te [CF3]Te,mP40,14 P121/c1 0.6822,1.1489,1.013,90,101.2,90 - - 3.35 X 32475
C-F-Te [CF3]2 TeF2 [CF3]2 TeF2,mS132,15 C12/c1 2.2065,0.9764,0.8981,90,91.66,90 - colorless 3.13 X 23120
Handbook of Inorganic Substances – Edition 2015 : Data 359

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-F-Te [C6F5]4Te [C6F5]4Te,mP360,14 P121/c1 0.98598,2.40441,2.1392,90,102.902,90 - colorless 2.14 X 49638


C-Fe-Ga Fe3GaC0.5 CaTiO3,cP5,221 Pm-3m 0.371,0.371,0.371,90,90,90 perovskite family - 7.91 X 1338
C-Fe-Gd GdFeC *,hP*,* - 0.912,0.912,0.597,90,90,120 - - - N 14777
C-Fe-Gd GdFeC2 CeNiC2,oS8,38 Amm2 0.369,0.4559,0.6007,90,90,90 - - 7.79 A 19068
C-Fe-Gd GdFe 2C2 *,oP*,* - 0.2995,0.3678,1.45,90,90,90 - - - N 14777
C-Fe-Gd Gd13 Fe10C13 Gd13 Fe10C13,hP108,152 P3121 0.9247,0.9247,2.3713,90,90,120 - gray 7.83 X 58419
C-Fe-Gd Gd2 Fe14C Nd2Fe14B,tP68,136 P42/mnm 0.8775,0.8775,1.2084,90,90,90 - - 7.91 A 24945
C-Fe-Gd Gd2 Fe17C2 Pr2Mn17C1.77 ,hR66,166 R-3m 0.868,0.868,1.266,90,90,120 CaCu5-Zr4Al3 - 7.77 A 27495
C-Fe-Gd Gd2 Fe2C3 *,hP*,* - 0.8388,0.8388,1.026,90,90,120 - - - N 14777
C-Fe-Gd Gd4 Fe4C7 *,tP*,* - 0.7045,0.7045,1.023,90,90,90 - - - N 14777
C-Fe-Ge Fe3GeC0.45 CaTiO3,cP5,221 Pm-3m 0.366,0.366,0.366,90,90,90 perovskite family - 8.32 X 1165
C-Fe-Ho HoFeC2 CeNiC2,oS8,38 Amm2 0.3561,0.4548,0.5982,90,90,90 - - 8.39 A 19068
C-Fe-Ho Ho15 Fe8C25 Er15 Fe8C25,hP49,150 P321 1.19038,1.19038,0.5108,90,90,120 - gray 8.53 X 53632
C-Fe-Ho Ho2 FeC4 Er2FeC4,oI28,72 Ibam 0.7514,0.9494,0.50223,90,90,90 - gray 8.04 A 20407
C-Fe-Ho Ho2 Fe14C Nd2Fe14B,tP68,136 P42/mnm 0.87499,0.87499,1.18125,90,90,90 - - 8.25 X 26108
C-Fe-Ho Ho2 Fe17C rhom Pr2Mn17C1.77 ,hR66,166 R-3m 0.85493,0.85493,1.24585,90,90,120 CaCu5-Zr4Al3 - 8.16 X 23584
C-Fe-Ho Ho2 Fe17C3 hex Tb2Mn17C2.5 ,hP44,194 P63/mmc 0.8521,0.8521,0.8309,90,90,120 CaCu5-Zr4Al3 - 8.36 X 27170
C-Fe-In Fe3InC0.5 CaTiO3,cP5,221 Pm-3m 0.368,0.368,0.368,90,90,90 perovskite family - 9.61 X 1165
C-Fe-La La11 Fe3C18 La11 Fe3C18,hP68,176 P63/m 0.8793,0.8793,1.605,90,90,120 - gray 5.91 X 52851
C-Fe-La La2Fe 14C Nd2Fe14B,tP68,136 P42/mnm 0.8819,0.8819,1.2142,90,90,90 - - 7.54 X 18526
C-Fe-Lu LuFeC2 CeNiC2,oS8,38 Amm2 0.345,0.4528,0.5965,90,90,90 - - 9.08 A 19068
C-Fe-Lu Lu2FeC4 Er2FeC4,oI28,72 Ibam 0.7494,0.9249,0.49508,90,90,90 - gray 8.78 A 20407
C-Fe-Lu Lu2Fe 14C Nd2Fe14B,tP68,136 P42/mnm 0.871,0.871,1.172,90,90,90 - - 8.55 X 23585
C-Fe-Lu Lu2Fe 17C0.6 Tb2Mn17C2.5 ,hP44,194 P63/mmc 0.845,0.845,0.8308,90,90,120 CaCu5-Zr4Al3 - 8.45 A 26249
C-Fe-Mn Mn0.26 Fe0.74 C0.006 cub NaCl,cF8,225 Fm-3m 0.35997,0.35997,0.35997,90,90,90 rocksalt family - 7.93 X 49175
C-Fe-Mn Mn0.26 Fe0.74 C0.006 hex NiAs,hP4,194 P63/mmc 0.25362,0.25362,0.40965,90,90,120 AlB2 family - 8.10 X 49175
C-Fe-Mn Mn1.8 Fe1.2 C Fe3C-b,oP16,62 Pnma 0.50764,0.67667,0.45229,90,90,90 - - 7.61 X 55589
C-Fe-Mn Mn3.5 Fe3.5 C3 Mn7 C3,oP40,62 Pnma 0.4535,0.6855,1.197,90,90,90 - - 7.56 A 23886
C-Fe-Mn Mn3.6 Fe0.4 C *,tP*,* - 0.6772,0.6772,0.9427,90,90,90 - - - N 3689
C-Fe-Mn Mn3.9 Fe1.1 C2 ht Mn5 C2,mS28,15 C12/c1 1.1646,0.457,0.5078,90,97.7,90 - - 7.43 X 3260
C-Fe-Mn Mn5.4 Fe0.6 C2 *,hP*,* - 0.577,0.577,0.698,90,90,120 - - - N 3689
C-Fe-Mo Mo0.02 Fe2.98 C m Fe3C-b,oP16,62 Pnma 0.509,0.6751,0.4528,90,90,90 - - 7.70 A 12779
C-Fe-Mo Mo0.03 Fe0.97 C0.075 NaCl,cF8,225 Fm-3m 0.3717,0.3717,0.3717,90,90,90 rocksalt family - 7.50 X 57102
C-Fe-Mo Mo0.14 Fe0.86 C0.14 m Mn,cI58,217 I-43m 0.8972,0.8972,0.8972,90,90,90 - - 8.42 F 14655
C-Fe-Mo Mo0.56 Fe0.44 Cx (Cr0.49 Fe0.51),tP30,136 P42/mnm 0.9076,0.9076,0.4821,90,90,90 Frank-Kasper phase - 9.82 A 5294
C-Fe-Mo Mo0.83 Fe0.17 C0.3 m NiAs,hP4,194 P63/mmc 0.2989,0.2989,0.4738,90,90,120 AlB2 family - 8.40 X 57102
C-Fe-Mo Mo0.94 Fe0.06 C0.01 W,cI2,229 Im-3m 0.3136,0.3136,0.3136,90,90,90 b.c.c. family - 10.09 F 5294
C-Fe-Mo Mo2 Fe21C6 Cr21 W2C6,cF116,225 Fm-3m 1.0546,1.0546,1.0546,90,90,90 - - 8.14 A 16223
C-Fe-Mo Mo3 Fe3C W3Fe3C,cF112,227 Fd-3m 1.11138,1.11138,1.11138,90,90,90 η-carbide - 9.05 X 42857
C-Fe-Mo Mo6 Fe11C5 Mo6 Fe11C5,mS44,12 C12/m1 1.0865,0.7767,0.6559,90,120.13,90 - - 8.67 X 18315
C-Fe-N Fe[CC3N3]2 Cr[CC3N3]2,oP30,53 Pmna 0.75371,0.53005,1.04636,90,90,90 - green pale 1.87 X 43013
C-Fe-N Fe[NCN] Co[NCN],hP8,194 P63/mmc 0.32689,0.32689,0.9401,90,90,120 - - 3.66 X 51935
C-Fe-N Fe[NC2N2]2 Ni[NC2N2]2,oP22,58 Pnnm 0.60362,0.71195,0.74455,90,90,90 - - 1.95 X 42180
C-Fe-N Fe1.75 [CN]4.5 Fe1.75 [CN]4.5 ,cF200,225 Fm-3m 1.013,1.013,1.013,90,90,90 Prussian blue - 1.37 X 13243
C-Fe-N Fe2C0.184 N0.736 rt W2C,hP11,162 P-31m 0.47644,0.47644,0.43906,90,90,120 - - 7.17 X 38786
C-Fe-N Fe2C0.4 N0.6 *,o**,* - 0.2752,0.4389,0.4834,90,90,90 - - - N 298
C-Fe-N Fe2[CN]6 CdCo 0.67 [CN]4,cF56,225 Fm-3m 1.02,1.02,1.02,90,90,90 Prussian blue green dark 1.68 A 40068
C-Fe-N Fe3C0.5 N0.6 Re1.16 O3,hP10,182 P6322 0.47251,0.47251,0.43881,90,90,120 - - 7.12 X 59521
C-Fe-Nd Nd2 Fe14C Nd2Fe14B,tP68,136 P42/mnm 0.8828,0.8828,1.20343,90,90,90 - - 7.67 X 21375
C-Fe-Nd Nd2 Fe17C2.94 Pr2Mn17C1.77 ,hR66,166 R-3m 0.87883,0.87883,1.25819,90,90,120 CaCu5-Zr4Al3 - 7.54 X 30326
C-Fe-Nd Nd3.67 FeC6 La3.67 FeC6,hP24,176 P63/m 0.8585,0.8585,0.5189,90,90,120 - gray 6.59 A 32658
C-Fe-Ni Fe0.55 Ni0.45 C0.0033 Cu,cF4,225 Fm-3m 0.3622,0.3622,0.3622,90,90,90 close-packed structure - 7.99 F 46878
C-Fe-Ni Fe0.87 Ni0.13 C0.05 rt W,cI2,229 Im-3m 0.36058,0.36058,0.36058,90,90,90 b.c.c. family - 4.03 F 26535
C-Fe-Ni Fe2.98 Ni0.02 C m Fe3C-b,oP16,62 Pnma 0.5088,0.6742,0.4525,90,90,90 - - 7.69 A 12779
C-Fe-O Fe[CO]4 lt Fe[CO]4,mP528,14 P121/c1 1.952,3.3408,1.1261,90,102.95,90 - black 2.10 X 36423
C-Fe-O Fe[CO]4 rt Fe[CO]4,mP108,14 P121/c1 0.8359,1.1309,1.14172,90,129.609,90 - black 2.01 X 8255
C-Fe-O Fe[CO]5 Fe[CO]5,mS44,15 C12/c1 1.1807,0.6821,0.9367,90,107.72,90 - - 1.81 X 24281
C-Fe-O Fe[CO3] Ca[CO3],hR30,167 R-3c 0.4579,0.4579,1.428,90,90,120 siderite - 4.45 X 55270
C-Fe-O Fe2[CO]9 Fe2[CO]9,hP40,176 P63/m 0.6436,0.6436,1.6123,90,90,120 - yellow 2.09 X 8273
C-Fe-O Fe4C[CO]13 *,mP124,14 P121/c1 0.9337,2.144,1.22805,90,129.991,90 - black 2.11 N 14220
C-Fe-O Fe5C[CO]15 Fe5C[CO]15,mS288,15 C12/c1 1.673,0.899,3.0122,90,105.202,90 - black 2.16 X 1674
C-Fe-Pr Pr2Fe 14C Nd2Fe14B,tP68,136 P42/mnm 0.88,0.88,1.204,90,90,90 - - 7.66 A 24789
C-Fe-Pr Pr2Fe 17C2 Pr2Mn17C1.77 ,hR66,166 R-3m 0.878,0.878,1.265,90,90,120 CaCu5-Zr4Al3 - 7.40 A 27495
C-Fe-Pr Pr3.67 FeC6 La3.67 FeC6,hP24,176 P63/m 0.8634,0.8634,0.5228,90,90,120 - gray 6.35 A 32658
C-Fe-Pu PuFeC2 ScCoC2,tP8,129 P4/nmm 0.35018,0.35018,0.7467,90,90,90 - gray 11.75 A 19389
C-Fe-Pu Pu3Fe4C5 *,cI*,* - 1.0105,1.0105,1.0105,90,90,90 - - - N 2053
C-Fe-Sc ScFeC2 ScCoC2,tP8,129 P4/nmm 0.3293,0.3293,0.7487,90,90,90 - - 5.11 A 18527
C-Fe-Sc Sc3FeC4 Sc3CoC4,oI16,71 Immm 0.33689,0.43818,1.20959,90,90,90 - gray 4.44 X 48527
C-Fe-Si Fe0.7373 Si0.0239 C0.2388 m3 *,hP*,* - 0.272,0.272,0.4315,90,90,120 - - - N 7298
C-Fe-Si Fe0.75 Si0.22C0.3 m4 *,oP*,* - 0.88,0.9,1.44,90,90,90 - - - N 1126
C-Fe-Si Fe0.9 Si0.1 C0.14 m1 Mn,cP20,213 P4132 0.6281,0.6281,0.6281,90,90,90 - - 7.34 F 24053
C-Fe-Si Fe0.9 Si0.1 C0.14 m2 Mn,cI58,217 I-43m 0.88782,0.88782,0.88782,90,90,90 - - 7.54 F 24054
C-Fe-Si Fe0.929 Si0.07 C0.001 m5 *,h**,* - 0.989,0.989,0.848,90,90,120 - - - N 2322
C-Fe-Si Fe22.4 Si5.6C2.8 Mn22.6 Si5.4 C4,aP32,1 P1 0.6347,0.63827,0.972,86.229,80.16,60.511 - - 7.09 A 6574
C-Fe-Si Fe5SiC Mn5 SiC,oS56,36 Cmc21 1.0043,0.7944,0.7469,90,90,90 - - 7.12 X 44597
C-Fe-Sm SmFeC2 CeNiC2,oS8,38 Amm2 0.3761,0.4572,0.601,90,90,90 - - 7.40 A 19068
C-Fe-Sm Sm11 Fe12C18 Th11 Ru12C18,cI82,217 I-43m 1.0119,1.0119,1.0119,90,90,90 - - 8.14 X 26696
C-Fe-Sm Sm2 Fe14C Nd2Fe14B,tP68,136 P42/mnm 0.8803,0.8803,1.1947,90,90,90 - - 7.85 A 24833
360 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Fe-Sm Sm2Fe17C2 Pr2Mn17C1.77 ,hR66,166 R-3m 0.873,0.873,1.265,90,90,120 CaCu5-Zr4Al3 - 7.60 A 27495


C-Fe-Sm Sm3.67 FeC6 La3.67 FeC6 ,hP24,176 P63 /m 0.8497,0.8497,0.5121,90,90,120 - gray 7.05 A 32658
C-Fe-Sn Fe0.97 Sn0.03 C0.005 rt W,cI2,229 Im-3m 0.2889,0.2889,0.2889,90,90,90 b.c.c. family - 7.96 F 16891
C-Fe-Sn Fe3SnC CaTiO3,cP5,221 Pm-3m 0.3862,0.3862,0.3862,90,90,90 perovskite family - 8.60 X 53828
C-Fe-Tb TbFeC2 CeNiC2,oS8,38 Amm2 0.3637,0.45583,0.5997,90,90,90 - - 7.98 A 19068
C-Fe-Tb Tb2FeC4 Er2FeC4,oI28,72 Ibam 0.7526,0.9644,0.50679,90,90,90 - gray 7.62 A 20407
C-Fe-Tb Tb2Fe14C Nd2Fe14B,tP68,136 P42 /mnm 0.878,0.878,1.187,90,90,90 - - 8.07 X 24839
C-Fe-Tb Tb2Fe17C Pr2Mn17C1.77 ,hR66,166 R-3m 0.86068,0.86068,1.24619,90,90,120 CaCu5-Zr4Al3 - 7.97 X 23584
C-Fe-Th ThFe11C1.35 LaMn11C1.5 ,tI56,141 I41/amd 1.0174,1.0174,0.6581,90,90,90 - - 8.41 X 26218
C-Fe-Th Th2Fe17C0.3 Pr2Mn17C1.77 ,hR66,166 R-3m 0.8606,0.8606,1.2492,90,90,120 CaCu5-Zr4Al3 - 8.81 X 26139
C-Fe-Tm Tm2FeC4 Er2FeC4,oI28,72 Ibam 0.7494,0.9367,0.49792,90,90,90 - gray 8.40 X 20407
C-Fe-Tm Tm2Fe14C Nd2Fe14B,tP68,136 P42 /mnm 0.87302,0.87302,1.17703,90,90,90 - - 8.38 X 26109
C-Fe-Tm Tm2Fe17C1.14 hex Tb2Mn17C2.5 ,hP44,194 P63 /mmc 0.85223,0.85223,0.83476,90,90,120 CaCu5-Zr4Al3 - 8.23 X 26109
C-Fe-Tm Tm2Fe17C1.4 rhom Pr2Mn17C1.77 ,hR66,166 R-3m 0.8503,0.8503,1.242,90,90,120 CaCu5-Zr4Al3 - 8.35 A 23645
C-Fe-U UFeC2 ScCoC2,tP8,129 P4/nmm 0.34944,0.34944,0.7389,90,90,90 - - 11.70 A 19389
C-Fe-U U0.6 Fe0.4 C rt CoO,tI4,139 I4/mmm 0.35405,0.35405,0.5084,90,90,90 rocksalt family - 9.23 X 24096
C-Fe-U U2Fe2C3 rt *,cI*,* - 1.0068,1.0068,1.0068,90,90,90 - - - N 24096
C-Fe-V V0.11 Fe0.89 C0.11 m NaCl,cF8,225 Fm-3m 0.4048,0.4048,0.4048,90,90,90 rocksalt family - 5.67 X 19215
C-Fe-V V3Fe3C W3Fe3C,cF112,227 Fd-3m 1.08771,1.08771,1.08771,90,90,90 η-carbide - 6.86 A 2720
C-Fe-W W0.01 Fe2.99 C m Fe3C-b,oP16,62 Pnma 0.508,0.674,0.452,90,90,90 - - 7.76 A 893
C-Fe-W W0.16 Fe0.84 C0.16 m Mn,cI58,217 I-43m 0.8996,0.8996,0.8996,90,90,90 - - 10.35 F 14655
C-Fe-W W2Fe21C6 Cr21W2C6 ,cF116,225 Fm-3m 1.0533,1.0533,1.0533,90,90,90 - - 9.17 A 16223
C-Fe-W W3Fe3C W3Fe3C,cF112,227 Fd-3m 1.1087,1.1087,1.1087,90,90,90 η-carbide - 14.25 X 3423
C-Fe-W W6Fe6C W6Fe6C,cF104,227 Fd-3m 1.0934,1.0934,1.0934,90,90,90 η-carbide - 14.74 X 3423
C-Fe-W W9.4 Fe3.6 C3.5 W10Co3C3.4 ,hP34,194 P63 /mmc 0.77987,0.77987,0.78298,90,90,120 - - 15.88 X 16298
C-Fe-Y YFeC2 *,tP*,* - 1.065,1.065,0.86,90,90,90 - - - N 23072
C-Fe-Y Y15Fe8C25 Er15Fe8C25 ,hP49,150 P321 1.19492,1.19492,0.51383,90,90,120 - gray 5.44 A 53632
C-Fe-Y Y2FeC4 Er2FeC4,oI28,72 Ibam 0.7529,0.9565,0.50406,90,90,90 - gray 5.15 A 20407
C-Fe-Y Y2Fe14C m Nd2Fe14B,tP68,136 P42 /mnm 0.876,0.876,1.186,90,90,90 - - 7.09 A 24789
C-Fe-Y Y2Fe17C rt Pr2Mn17C1.77 ,hR66,166 R-3m 0.85927,0.85927,1.24616,90,90,120 CaCu5-Zr4Al3 - 7.12 X 23584
C-Fe-Y Y2Fe17C2 ht Tb2Mn17C2.5 ,hP44,194 P63 /mmc 0.867,0.867,0.84,90,90,120 CaCu5-Zr4Al3 - 6.99 A 27495
C-Fe-Yb Yb2FeC4 Er2FeC4,oI28,72 Ibam 0.748,0.9315,0.4958,90,90,90 - gray 8.65 A 20407
C-Fe-Zn ZnFe3C CaTiO3,cP5,221 Pm-3m 0.381,0.381,0.381,90,90,90 perovskite family - 7.35 X 1085
C-Fe-Zr Zr3Fe3C m W3Fe3C,cF112,227 Fd-3m 1.18,1.18,1.18,90,90,90 η-carbide - 7.33 A 3657
C-Ga-Gd Gd3GaC CaTiO3,cP5,221 Pm-3m 0.4909,0.4909,0.4909,90,90,90 perovskite family - 7.77 X 33965
C-Ga-Ho Ho3GaC CaTiO3,cP5,221 Pm-3m 0.4805,0.4805,0.4805,90,90,90 perovskite family - 8.63 X 33965
C-Ga-Lu Lu3GaC CaTiO3,cP5,221 Pm-3m 0.472,0.472,0.472,90,90,90 perovskite family - 9.58 X 33965
C-Ga-Mn Mn3GaC CaTiO3,cP5,221 Pm-3m 0.3896,0.3896,0.3896,90,90,90 perovskite family - 6.92 X 5575
C-Ga-Mo Mo2GaC Cr2AlC,hP8,194 P63 /mmc 0.3017,0.3017,1.318,90,90,120 - - 8.75 A 1969
C-Ga-N Ga[CN]3 Ga[CN]3,cP7,221 Pm-3m 0.5295,0.5295,0.5295,90,90,90 - - 1.65 X 33521
C-Ga-Nb Nb2GaC Cr2AlC,hP8,194 P63 /mmc 0.3131,0.3131,1.3565,90,90,120 - - 7.72 A 2309
C-Ga-Nd Nd3GaC CaTiO3,cP5,221 Pm-3m 0.5138,0.5138,0.5138,90,90,90 perovskite family - 6.30 X 3660
C-Ga-Ni Ni0.6 Ga0.2 C0.2 Cu,cF4,225 Fm-3m 0.363,0.363,0.363,90,90,90 close-packed structure - 7.16 X 53130
C-Ga-Ni Ni3GaC0.31 CaTiO3,cP5,221 Pm-3m 0.3619,0.3619,0.3619,90,90,90 perovskite family - 8.74 X 53130
C-Ga-Pr Pr3GaC CaTiO3,cP5,221 Pm-3m 0.516,0.516,0.516,90,90,90 perovskite family - 6.10 X 3190
C-Ga-Pt PtGa0.33 C0.17 CuAu,tP2,123 P4/mmm 0.27719,0.27719,0.388,90,90,90 close-packed structure - 12.26 X 1560
C-Ga-Sc Sc3GaC CaTiO3,cP5,221 Pm-3m 0.44683,0.44683,0.44683,90,90,90 perovskite family - 4.03 X 33965
C-Ga-Sm Sm3GaC CaTiO3,cP5,221 Pm-3m 0.4941,0.4941,0.4941,90,90,90 perovskite family - 7.34 X 33965
C-Ga-Ta Ta2GaC Cr2AlC,hP8,194 P63 /mmc 0.3104,0.3104,1.357,90,90,120 - - 13.01 A 2312
C-Ga-Tb Tb3GaC CaTiO3,cP5,221 Pm-3m 0.4868,0.4868,0.4868,90,90,90 perovskite family - 8.04 X 33965
C-Ga-Ti Ti2GaC Cr2AlC,hP8,194 P63 /mmc 0.30764,0.30764,1.3378,90,90,120 - black 5.38 X 52995
C-Ga-Ti Ti4GaC3 Ti4GaC3,hP18,194 P63 /mmc 0.3069,0.3069,2.344,90,90,120 - - 5.17 X 52995
C-Ga-Tm Tm3GaC CaTiO3,cP5,221 Pm-3m 0.4752,0.4752,0.4752,90,90,90 perovskite family - 9.11 X 33965
C-Ga-V V2GaC Cr2AlC,hP8,194 P63 /mmc 0.2938,0.2938,1.284,90,90,120 - - 6.35 A 1969
C-Ga-Y Y3GaC CaTiO3,cP5,221 Pm-3m 0.4859,0.4859,0.4859,90,90,90 perovskite family - 5.04 X 33965
C-Ga-Yb Yb3GaC CaTiO3,cP5,221 Pm-3m 0.4722,0.4722,0.4722,90,90,90 perovskite family - 9.48 X 33965
C-Gd-Ge Gd5Ge3C0.33 CuHf5Sn3,hP18,193 P63 /mcm 0.85547,0.85547,0.64681,90,90,120 AlB2 family - 8.17 A 56529
C-Gd-I Gd12C6I17 Gd12C6I17,mS140,15 C12/c1 1.9297,1.2201,1.8635,90,90.37,90 - black 6.23 X 16645
C-Gd-I Gd19C6I34 Y19C6I34,aP59,2 P-1 0.94172,1.039,2.23711,79.001,88.32,69.25 - black 6.10 X 55468
C-Gd-I Gd2CI Cr2AlC,hP8,194 P63 /mmc 0.3801,0.3801,1.4792,90,90,120 - - 8.14 X 23606
C-Gd-I Gd3CI3 Pr3RuI3,mP14,11 P121/m1 0.8658,0.3926,1.1735,90,92.26,90 - bronze 7.20 X 28200
C-Gd-I Gd5C2I8 Gd5C2I8,aP60,2 P-1 1.0463,1.122,1.6945,80.85,88.06,87.32 - black 6.18 X 38186
C-Gd-In Gd3InC CaTiO3,cP5,221 Pm-3m 0.4953,0.4953,0.4953,90,90,90 perovskite family - 8.18 X 33965
C-Gd-La La0.47 Gd0.53 C2 CaC2,tI6,139 I4/mmm 0.383,0.383,0.642,90,90,90 - - 6.09 A 8296
C-Gd-Mn Gd10.34 Mn12.66 C18 Th11Ru12C18,cI82,217 I-43m 1.0269,1.0269,1.0269,90,90,90 - gray silver 7.78 X 31798
C-Gd-Mn Gd12Mn5C15 La12Re5C15 ,hP32,189 P-62m 1.0583,1.0583,0.5117,90,90,120 - black 7.84 A 31743
C-Gd-Mn Gd2Mn17C hex Tb2Mn17C2.5 ,hP44,194 P63 /mmc 0.8733,0.8733,0.8486,90,90,120 CaCu5-Zr4Al3 - 7.47 A 24830
C-Gd-Mn Gd2Mn17C2.7 rhom Pr2Mn17C1.77 ,hR66,166 R-3m 0.8778,0.8778,1.2793,90,90,120 CaCu5-Zr4Al3 - 7.47 A 24830
C-Gd-Mn Gd3Mn2C6 Gd3Mn2C6 ,hP22,176 P63 /m 0.815,0.815,0.50493,90,90,120 - - 7.47 X 28210
C-Gd-Mo GdMoC2 UMoC2,oP16,62 Pnma 0.5735,0.33953,1.0901,90,90,90 - - 8.67 A 19771
C-Gd-Mo Gd2Mo2C3 Er2Mo2C3 ,mS14,12 C12/m1 1.187,0.33575,0.5756,90,113.11,90 - gray 8.54 X 45799
C-Gd-N GdC0.294 N0.354 NaCl,cF8,225 Fm-3m 0.5016,0.5016,0.5016,90,90,90 rocksalt family - 8.72 X 13408
C-Gd-N Gd[NC2N2]3 Nd[NC2N2 ]3,oS64,63 Cmcm 0.77522,1.13505,1.0111,90,90,90 - brown 2.65 X 47672
C-Gd-N Gd2[NCN]3 Sm2[NCN]3,mS22,12 C12/m1 1.4453,0.38472,0.52586,90,95.762,90 - - 4.96 A 46500
C-Gd-Ni GdNiC2 CeNiC2,oS8,38 Amm2 0.3649,0.4158,0.6073,90,90,90 - - 8.65 A 22383
C-Gd-Ni Gd2Ni22C3 Ce2Ni22C2.75 ,oS216,64 Cmce 1.1361,1.498,1.457,90,90,90 - - 8.80 A 26142
C-Gd-Ni Gd4Ni13C4 Er4Ni13C4 ,oS42,65 Cmmm 1.175,1.2019,0.3906,90,90,90 - - 8.67 A 25377
C-Gd-O Gd2[CO3]O2 Nd2[CO3]O2,hP24,194 P63 /mmc 0.39222,0.39222,1.54624,90,90,120 - - 6.55 X 54657
Handbook of Inorganic Substances – Edition 2015 : Data 361

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Gd-Os Gd12 Os5C15 La12 Re5C15,hP32,189 P-62m 1.0756,1.0756,0.5127,90,90,120 - - 9.76 A 34625


C-Gd-Os Gd2 OsC2 Pr2ReC2,oP20,62 Pnma 0.64634,0.51782,0.9886,90,90,90 - - 10.61 A 33350
C-Gd-Pb Gd3 PbC CaTiO3,cP5,221 Pm-3m 0.4948,0.4948,0.4948,90,90,90 perovskite family - 9.47 X 3196
C-Gd-Re Gd12 Re5C15 La12 Re5C15,hP32,189 P-62m 1.08,1.08,0.5157,90,90,120 - gray dark 9.56 A 29688
C-Gd-Re Gd2 ReC2 Pr2ReC2,oP20,62 Pnma 0.65927,0.51756,0.9945,90,90,90 - - 10.27 A 23790
C-Gd-Rh GdRh3C CaTiO3,cP5,221 Pm-3m 0.4148,0.4148,0.4148,90,90,90 perovskite family - 11.12 X 53254
C-Gd-Rh Gd8 Rh5C12 Er8Rh5C12,mS50,12 C12/m1 2.7915,0.36031,0.7453,90,93.28,90 - - 8.51 A 22276
C-Gd-Ru GdRuC2 GdRuC2,oS16,63 Cmcm 0.4365,0.9277,0.5202,90,90,90 - gray 8.90 X 30645
C-Gd-Ru Gd3 Ru1.86 C4.97 Gd3Ru2C5,hP50,176 P63/m 1.145,1.145,0.502,90,90,120 - gray dark 8.38 X 39177
C-Gd-Ru Gd3.67 RuC6 La3.67 FeC6,hP24,176 P63/m 0.8542,0.8542,0.5093,90,90,120 - gray 7.74 A 39525
C-Gd-Si Gd15 Si9C La15 FeGe9,hP50,186 P63mc 1.4725,1.4725,0.6435,90,90,120 - - 7.21 A 56529
C-Gd-Si Gd3 Si2C2 Pr3Si2C2,oS20,65 Cmmm 0.3886,1.5863,0.4276,90,90,90 - gray 6.95 A 34802
C-Gd-Si Gd5 Si3C0.5 Er4.8 Si2.7 C0.5 ,hP54,187 P-6m2 1.4717,1.4717,0.6493,90,90,120 - - 7.17 A 16162
C-Gd-Sn Gd3 SnC CaTiO3,cP5,221 Pm-3m 0.493,0.493,0.493,90,90,90 perovskite family - 8.35 X 3196
C-Gd-Th Th1.8 Gd0.2 C3 ht-hp Pu2C3,cI40,220 I-43d 0.85439,0.85439,0.85439,90,90,90 - - 10.33 A 7468
C-Gd-Tl TlGd3C CaTiO3,cP5,221 Pm-3m 0.4931,0.4931,0.4931,90,90,90 perovskite family - 9.53 X 33965
C-Gd-W GdWC2 UMoC2,oP16,62 Pnma 0.58968,0.35806,1.1142,90,90,90 - - 10.31 A 34411
C-Ge-La La15 Ge9C La15 FeGe9,hP50,186 P63mc 1.54674,1.54674,0.68795,90,90,120 - - 6.41 X 31630
C-Ge-La La4GeC4 La4GeC4,cI52,220 I-43d 0.8995,0.8995,0.8995,90,90,90 - gray 6.17 X 36281
C-Ge-La La5Ge 2C2 La5Ge2C2,oP18,55 Pbam 0.8873,1.2946,0.4273,90,90,90 - gray 5.84 X 43963
C-Ge-La La5Ge 3C0.75 CuHf5Sn3,hP18,193 P63/mcm 0.8955,0.8955,0.6904,90,90,120 AlB2 family - 6.38 A 27301
C-Ge-Mn Mn3 GeC cub CaTiO3,cP5,221 Pm-3m 0.387,0.387,0.387,90,90,90 perovskite family - 7.15 X 1165
C-Ge-Mn Mn3 GeC tet Cr3AsN,tI20,140 I4/mcm 0.538,0.538,0.8068,90,90,90 - - 7.09 X 4180
C-Ge-Mn Mn5 Ge3C0.8 CuHf5Sn3,hP18,193 P63/mcm 0.7135,0.7135,0.4996,90,90,120 AlB2 family - 7.57 A 52651
C-Ge-Mo Mo5 Ge3C0.1 Mn5 Si3,hP16,193 P63/mcm 0.7369,0.7369,0.5047,90,90,120 - - 9.78 P 2299
C-Ge-Nb Nb5 Ge3C0.5 CuHf5Sn3,hP18,193 P63/mcm 0.76348,0.76348,0.53017,90,90,120 AlB2 family - 8.54 X 58580
C-Ge-Nd Nd15 Ge9C La15 FeGe9,hP50,186 P63mc 1.5129,1.5129,0.6713,90,90,120 - - 7.06 X 56529
C-Ge-Ni Ni3GeC0.15 CaTiO3,cP5,221 Pm-3m 0.358,0.358,0.358,90,90,90 perovskite family - 9.07 X 1165
C-Ge-Pr Pr15 Ge9C La15 FeGe9,hP50,186 P63mc 1.5242,1.5242,0.6764,90,90,120 - - 6.78 A 56529
C-Ge-Si Ge0.17 Si0.83 C ZnS,cF8,216 F-43m 0.43999,0.43999,0.43999,90,90,90 adamantane structure - 3.72 X 45501
C-Ge-Sm Sm5 Ge3C0.33 CuHf5Sn3,hP18,193 P63/mcm 0.8655,0.8655,0.6574,90,90,120 AlB2 family - 7.58 A 56529
C-Ge-Ti Ti2GeC Cr2AlC,hP8,194 P63/mmc 0.3079,0.3079,1.293,90,90,120 - - 5.64 X 1960
C-Ge-Ti Ti3GeC2 Ti3SiC2,hP12,194 P63/mmc 0.30926,0.30926,1.78484,90,90,120 - - 5.40 X 55294
C-Ge-V V2GeC Cr2AlC,hP8,194 P63/mmc 0.3001,0.3001,1.225,90,90,120 - - 6.48 X 1972
C-Ge-V V3GeC Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.3047,1.014,0.7884,90,90,90 - - 6.47 A 6168
C-Ge-Y Y1.8 Ge0.2 C2.7 Pu2C3,cI40,220 I-43d 0.8286,0.8286,0.8286,90,90,90 - - 4.83 A 4710
C-H-Hf HfC0.58 H0.42 NaCl,cF8,225 Fm-3m 0.463,0.463,0.463,90,90,90 rocksalt family - 12.44 X 6165
C-H-Hf Hf2CH *,hP*,164 P-3m1 0.3301,0.3301,0.5399,90,90,120 - - - N 3661
C-H-Li LiC0.016 H0.984 NaCl,cF8,225 Fm-3m 0.4096,0.4096,0.4096,90,90,90 rocksalt family black 0.79 X 5343
C-H-N C2N8[NH2]2 orth C2N8[NH2]2,oP96,61 Pbca 0.62946,1.97287,1.02063,90,90,90 - - 1.76 X 58082
C-H-N C2N8[NH2]2 tricl C2N8[NH2]2,aP48,2 P-1 0.62087,0.99845,1.06782,90.106,90.874,106.336 - - 1.76 X 58082
C-H-N C4[NH][CN]4 C4[NH][CN]4,oP52,33 Pna21 1.14239,0.75869,0.96957,90,90,90 - - 1.32 X 58105
C-H-N C6N7[NH2]3 C6N7[NH2]3,mP64,14 P121/c1 0.74166,0.86228,1.3359,90,99.91,90 - - 1.72 X 47650
C-H-N HCN6 HCN6,aP28,2 P-1 0.72321,0.72828,0.78104,108.408,98.467,91.593 - colorless 1.68 X 57797
C-H-N HC2 N5 HC2 N5,mP14,11 P121/m1 0.5085,0.6103,0.6294,90,98.54,90 - greenish 1.63 X 57904
C-H-N H[C4N5] H[C4N5],mP36,14 P121/c1 0.60162,1.12171,0.75625,90,94.214,90 - white 1.55 X 52264
C-H-N H[NH4][C2N8] H[NH4][C2N8],mP44,14 P121/c1 0.45136,0.84692,1.5522,90,94.32,90 - - 1.74 X 59720
C-H-N H[NH4][NCN] H[NH4][NCN],oP16,19 P212121 0.64399,0.65761,0.7402,90,90,90 - colorless 1.25 X 47646
C-H-N H4C2N10 H4C2N10,mS48,15 C12/c1 1.2401,0.5513,0.9835,90,115.57,90 - - 1.84 X 49623
C-H-N H8CN6 H8CN6,mP28,14 P121/c1 0.746,1.0274,0.6343,90,110.8,90 - colorless 1.52 X 18805
C-H-N [CN3H5] [CN3H5],oP64,61 Pbca 0.85648,0.92017,1.5713,90,90,90 - colorless 1.27 X 51941
C-H-N [CN3H6][C4N5] [CN3H6][C4N5],mS156,9 C1c1 1.26,1.71138,1.20952,90,106.098,90 - colorless 1.42 X 52264
C-H-N [CN3H6]2[C2N8] [CN3H6]2[C2N8],mP36,14 P121/c1 0.3588,1.5014,1.0048,90,97.362,90 - colorless 1.59 X 57857
C-H-N [CN4H7][C4N5] [CN4H7][C4N5],mP28,7 P1c1 0.88671,0.72893,0.70921,90,105.141,90 - colorless 1.45 X 52264
C-H-N [CN5H8][C4N5] [CN5H8][C4N5],mP30,4 P1211 0.37727,1.56832,0.83416,90,101.797,90 - colorless 1.43 X 52264
C-H-N [CN6H9][C4N5] [CN6H9][C4N5],mS128,15 C12/c1 1.40789,1.1579,1.3584,90,115.239,90 - colorless 1.48 X 52264
C-H-N [CN6H9]2[C2N8] [CN6H9]2[C2N8],mP48,14 P121/c1 1.0417,0.3929,1.95427,90,110.447,90 - purple light 1.53 X 57857
C-H-N [C2N4H4] *,mS24,* - 0.62,0.44,1.38,90,90.58,90 - - 1.48 N 16
C-H-N [C6N11H9] [C6N11H9],mS204,15 C12/c1 1.811,1.0867,1.3984,90,96.31,90 - colorless 1.71 X 48140
C-H-N [NH2][CN] [NH2][CN],oP24,61 Pbca 0.6628,0.9147,0.6856,90,90,90 - colorless 1.34 X 20975
C-H-N [NH2]2[CN]2 *,m**,* - 1.308,0.4479,1.497,90,115.41,90 - white - N 47646
C-H-N [NH4][CC3N3] [NH4][CC3N3],mP32,14 P121/c1 0.9055,0.387,1.7325,90,104.6,90 - colorless 1.22 X 2442
C-H-N [NH4][C4N5] [NH4][C4N5],oP40,62 Pnma 0.65646,0.75707,1.3303,90,90,90 - colorless 1.37 X 52264
C-H-N [NH4][NC2N2] rt [NH4][NC2N2],mP24,14 P121/c1 0.37913,1.2412,0.9113,90,91.49,90 - colorless 1.30 X 42005
C-H-N [NH4]2[C2N8] mon [NH4]2[C2N8],mS24,12 C12/m1 0.88511,1.11956,0.36809,90,99.608,90 - colorless 1.59 X 57857
C-H-N [NH4]2[C2N8] orth [NH4]2[C2N8],oP24,50 Pban 0.91301,1.07631,0.3666,90,90,90 - - 1.59 X 59720
C-H-N [NH4]2[C4N12] [NH4]2[C4N12],mS36,12 C12/m1 0.95043,1.1605,0.58734,90,126.42,90 - red 1.61 X 59473
C-H-N [N2H5]CN5[N2H4] rt [N2H5]CN5[N2H4],aP20,2 P-1 0.46208,0.8585,0.9271,108.486,95.29,102.991 - yellow 1.46 X 38679
C-H-N [N2H5][CN5H2] [N2H5][CN5H2],oP32,18 P21212 0.967,1.354,0.386,90,90,90 - - 1.54 X 936
C-H-N [N2H5]2[C2N8] [N2H5]2[C2N8],aP14,2 P-1 0.36096,0.79134,0.82992,72.058,79.051,79.132 - colorless 1.53 X 57857
C-H-Nb NbC0.71 H0.28 NbC0.71 H0.28,tI8,139 I4/mmm 0.31393,0.31393,0.44377,90,90,90 - - 7.72 X 52496
C-H-Nb NbC0.77 H0.23 NaCl,cF8,225 Fm-3m 0.444,0.444,0.444,90,90,90 rocksalt family - 7.77 X 6165
C-H-Nb Nb2 C1.52 H0.36 Nb2C0.9(C0.66 H0.34),oP4,47 Pmmm 0.31411,0.31455,0.44479,90,90,90 - - 7.72 X 52496
C-H-O H2[C2O4][H2O]2 H2[C2O4][H2O]2-a,mP16,14 P121/c1 0.6119,0.3607,1.18891,90,103.28,90 - colorless 1.64 X 4413
C-H-O [OCO]3.65 [H2O]23 [OCO]3.65 [H2O]23,cP334,223 Pm-3n 1.1879,1.1879,1.1879,90,90,90 - - 1.14 X 54455
C-H-O [OCO]4[H2O]23 [Cl2]4[H2O]23,cP54,223 Pm-3n 1.204,1.204,1.204,90,90,90 - - 1.12 A 649
C-H-S H2CS3 mon1 H2CS3,mP64,14 P121/c1 0.5839,2.2474,1.2992,90,90.67,90 - yellow 1.72 X 13843
C-H-S H2CS3 mon2 H2CS3,mP48,14 P121/c1 1.1454,0.5936,1.9197,90,102.66,90 - - 1.72 X 20872
362 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-H-Ti TiC0.4 H1.2 rt *,h**,* - 0.309,0.309,0.5089,90,90,120 - - - N 33151


C-H-Ti TiC0.5 H0.5 rt NaCl,cF8,225 Fm-3m 0.4296,0.4296,0.4296,90,90,90 rocksalt family - 4.56 X 33151
C-H-Ti Ti2CH0.5 Ti2C,cF48,227 Fd-3m 0.8646,0.8646,0.8646,90,90,90 - - 4.45 F 17014
C-H-Ti Ti2CH0.6 *,hP3,164 P-3m1 0.3075,0.3075,0.507,90,90,120 - - - P 3661
C-H-V VC0.75 H0.25 NaCl,cF8,225 Fm-3m 0.4138,0.4138,0.4138,90,90,90 rocksalt family - 5.64 X 6165
C-H-V V2CH0.3 Fe2N0.94 ,oP12,60 Pbcn 0.4575,0.5771,0.5037,90,90,90 - - 5.70 F 3661
C-H-Yb YbCH0.5 *,cF*,* - 0.4974,0.4974,0.4974,90,90,90 - gray silver - N 9017
C-H-Yb YbC0.5 H *,hP*,* - 0.3575,0.3575,0.5786,90,90,120 - gray dark - N 9017
C-H-Zr ZrC0.64 H0.31 NaCl,cF8,225 Fm-3m 0.4661,0.4661,0.4661,90,90,90 rocksalt family - 6.51 X 6165
C-H-Zr Zr2CH Ce2SO2,hP5,164 P-3m1 0.334,0.334,0.5482,90,90,120 - - 6.13 X 3661
C-H-Zr Zr2C0.6 H2 Zr2C0.6 H2,hP8,164 P-3m1 0.3341,0.3341,0.5476,90,90,120 - - 6.01 X 5546
C-H-Zr Zr2C1.2 H0.8 Zr2C1.2 H0.8 ,cF76,216 F-43m 0.934,0.934,0.934,90,90,90 - - 6.45 X 2737
C-H-Zr Zr3C0.9 H3 Zr3C0.9 H3,hP22,162 P-31m 0.5787,0.5787,0.5476,90,90,120 - - 6.01 X 4882
C-Hf-In Hf2InC Cr2AlC,hP8,194 P63 /mmc 0.3307,0.3307,1.473,90,90,120 - - 11.52 X 1960
C-Hf-Mo Hf0.001Mo0.999 C0.001 W,cI2,229 Im-3m 0.31434,0.31434,0.31434,90,90,90 b.c.c. family - 10.27 F 3515
C-Hf-Mo Hf0.5 Mo0.5 C NaCl,cF8,225 Fm-3m 0.4493,0.4493,0.4493,90,90,90 rocksalt family - 10.93 X 10852
C-Hf-N HfC0.5 N0.5 NaCl,cF8,225 Fm-3m 0.4565,0.4565,0.4565,90,90,90 rocksalt family - 13.37 X 9212
C-Hf-Nb Hf0.1 Nb0.9 C0.5 ht2 NiAs,hP4,194 P63 /mmc 0.3139,0.3139,0.498,90,90,120 AlB2 family - 8.40 X 2307
C-Hf-Nb Hf0.5 Nb0.5 C NaCl,cF8,225 Fm-3m 0.4545,0.4545,0.4545,90,90,90 rocksalt family - 10.45 X 3596
C-Hf-O HfC0.6 O0.4 NaCl,cF8,225 Fm-3m 0.461,0.461,0.461,90,90,90 rocksalt family - 13.02 X 9212
C-Hf-Pb Hf2PbC Cr2AlC,hP8,194 P63 /mmc 0.3358,0.3358,1.447,90,90,120 - - 13.54 A 2239
C-Hf-Rh HfRh3C0.21 CaTiO3,cP5,221 Pm-3m 0.395,0.395,0.395,90,90,90 perovskite family - 13.20 X 16396
C-Hf-Ru HfRu3C0.7 CaTiO3,cP5,221 Pm-3m 0.4016,0.4016,0.4016,90,90,90 perovskite family - 12.57 X 16396
C-Hf-Sn Hf2SnC Cr2AlC,hP8,194 P63 /mmc 0.3312,0.3312,1.439,90,90,120 - - 11.85 A 1969
C-Hf-Ta Hf0.12 Ta0.88 C0.5 ht NiAs,hP4,194 P63 /mmc 0.3123,0.3123,0.4972,90,90,120 AlB2 family - 14.76 X 1966
C-Hf-Ta Hf0.2 Ta0.8 C NaCl,cF8,225 Fm-3m 0.44854,0.44854,0.44854,90,90,90 rocksalt family - 14.17 X 57266
C-Hf-Ti Hf0.3 Ti0.7 C NaCl,cF8,225 Fm-3m 0.4431,0.4431,0.4431,90,90,90 rocksalt family - 7.57 X 10850
C-Hf-Tl TlHf2C Cr2AlC,hP8,194 P63 /mmc 0.3322,0.3322,1.463,90,90,120 - - 13.62 A 2239
C-Hf-U U0.25 Hf0.75 C NaCl,cF8,225 Fm-3m 0.4712,0.4712,0.4712,90,90,90 rocksalt family - 13.04 X 1961
C-Hf-V Hf0.13 V0.87 C NaCl,cF8,225 Fm-3m 0.4227,0.4227,0.4227,90,90,90 rocksalt family - 6.99 X 10851
C-Hf-V Hf0.91 V0.09 C NaCl,cF8,225 Fm-3m 0.4599,0.4599,0.4599,90,90,90 rocksalt family - 12.22 X 10851
C-Hf-W Hf0.83 W0.17 C0.89 NaCl,cF8,225 Fm-3m 0.4574,0.4574,0.4574,90,90,90 rocksalt family - 13.19 X 9815
C-Hf-Zn Zn3Hf3C W3Fe3C,cF112,227 Fd-3m 1.1957,1.1957,1.1957,90,90,90 η-carbide - 11.56 A 2295
C-Hf-Zr Hf0.5 Zr0.5 C NaCl,cF8,225 Fm-3m 0.466,0.466,0.466,90,90,90 rocksalt family - 9.64 X 1987
C-Hg-K KHgC4 KHgC4,oF96,70 Fddd 0.492,0.852,4.064,90,90,90 GIC - 4.49 X 16532
C-Hg-N Hg[CN]2 Hg[CN]2,tI40,122 I-42d 0.96922,0.96922,0.89015,90,90,90 - colorless 4.01 X 41104
C-Hg-N Hg[NCN] ht Hg[NCN],mP16,14 P121/c1 0.55516,0.69797,0.68521,90,113.212,90 - - 6.55 X 40055
C-Hg-N Hg[NCN] rt Hg[NCN],oP32,61 Pbca 0.65138,0.68929,1.04851,90,90,90 - colorless 6.79 X 38154
C-Hg-O Hg[C2O4] Hg[C2O4],mP14,4 P1211 0.5029,0.5228,0.6437,90,108.82,90 - white 5.98 X 29662
C-Hg-Ti Hg0.8 Ti3.2 C CaTiO3,cP5,221 Pm-3m 0.42124,0.42124,0.42124,90,90,90 perovskite family - 7.24 X 4786
C-Ho-In Ho3InC CaTiO3,cP5,221 Pm-3m 0.4834,0.4834,0.4834,90,90,90 perovskite family - 9.14 X 33965
C-Ho-La La0.3 Ho0.7 C2 CaC2,tI6,139 I4/mmm 0.37752,0.37752,0.64694,90,90,90 - - 6.52 A 27711
C-Ho-La La0.5 Ho0.5 C2 CaC2,cF36,225 Fm-3m 0.56782,0.56782,0.56782,90,90,90 - - 6.38 A 27711
C-Ho-Mn Ho10Mn13 C18 Dy10(Dy0.14 Mn0.86)Mn12C18 ,cI82,217 I-43m 1.0105,1.0105,1.0105,90,90,90 - - 8.30 A 27414
C-Ho-Mn Ho12Mn5C15 La12Re5C15 ,hP32,189 P-62m 1.043,1.043,0.501,90,90,120 - black 8.56 A 31743
C-Ho-Mn Ho2Mn17C3 Tb2Mn17C2.5 ,hP44,194 P63 /mmc 0.87004,0.87004,0.8515,90,90,120 CaCu5-Zr4Al3 - 7.73 A 20415
C-Ho-Mo HoMoC2 UMoC2,oP16,62 Pnma 0.5626,0.3349,1.0807,90,90,90 - - 9.29 A 19771
C-Ho-Mo Ho2Mo2C3 mon1 Er2Mo2C3 ,mS14,12 C12/m1 1.1646,0.33201,0.5666,90,111.69,90 - - 9.10 A 19771
C-Ho-Mo Ho2Mo2C3 mon2 Er2Mo2C3 ,mS14,12 C12/m1 1.1616,0.33203,0.56613,90,111.603,90 - - 9.13 X 36072
C-Ho-N Ho2CN0.08 NaFeO2,hR12,166 R-3m 0.35564,0.35564,1.77029,90,90,120 rocksalt family - 8.81 X 3010
C-Ho-N Ho2[NCN]3 Sm2[NCN]3,mS22,12 C12/m1 1.4214,0.3766,0.521,90,95.6,90 - - 5.38 A 46500
C-Ho-Ni HoNiC2 CeNiC2,oS8,38 Amm2 0.353,0.4486,0.6014,90,90,90 - - 8.64 X 28982
C-Ho-Ni Ho11Ni60C6 Yb11Ni60C6,cI154,229 Im-3m 1.248,1.248,1.248,90,90,90 - - 9.24 A 26067
C-Ho-Ni Ho2Ni22C3 Ce2Ni22C2.75 ,oS216,64 Cmce 1.1342,1.4948,1.4529,90,90,90 - - 8.94 A 26142
C-Ho-Ni Ho4Ni13C4 Er4Ni13C4 ,oS42,65 Cmmm 1.1706,1.1995,0.3872,90,90,90 - - 8.99 A 25377
C-Ho-Os Ho2OsC2 Pr2ReC2,oP20,62 Pnma 0.64128,0.50688,0.97137,90,90,90 - - 11.45 A 33350
C-Ho-Pb Ho3PbC CaTiO3,cP5,221 Pm-3m 0.4847,0.4847,0.4847,90,90,90 perovskite family - 10.41 X 33965
C-Ho-Re Ho12Re5C15 La12Re5C15 ,hP32,189 P-62m 1.0667,1.0667,0.5042,90,90,120 - gray dark 10.33 X 29688
C-Ho-Re Ho2ReC2 Pr2ReC2,oP20,62 Pnma 0.65257,0.50682,0.97873,90,90,90 - - 11.08 X 31911
C-Ho-Rh HoRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.4111,0.4111,0.4111,90,90,90 perovskite family - 11.52 X 6791
C-Ho-Rh Ho8Rh5C12 Er8Rh5C12 ,mS50,12 C12/m1 2.7743,0.35158,0.7334,90,94.,90 - - 9.21 A 22276
C-Ho-Ru HoRu3C CaTiO3,cP5,221 Pm-3m 0.4124,0.4124,0.4124,90,90,90 perovskite family - 11.37 X 30191
C-Ho-Ru Ho3Ru2C5 Gd3Ru2C5 ,hP50,176 P63 /m 1.1365,1.1365,0.4984,90,90,120 - gray dark 9.02 A 39177
C-Ho-Ru Ho7Ru2C11 Er7Ru2C11 ,oS80,63 Cmcm 0.34934,1.6559,1.9618,90,90,90 - gray 8.71 A 28260
C-Ho-Si Ho15Si9C La15FeGe9 ,hP50,186 P63 mc 1.4459,1.4459,0.6325,90,90,120 - - 7.94 A 56529
C-Ho-Si Ho3Si2C2 Pr3Si2C2,oS20,65 Cmmm 0.3828,1.5507,0.4189,90,90,90 - gray 7.68 A 34802
C-Ho-Si Ho5Si3C Er5Si3C,hP162,164 P-3m1 1.4476,1.4476,1.9229,90,90,120 - - 7.89 A 16162
C-Ho-Si Ho5Si3C0.33 Zr5Al3O0.5 ,hP52,186 P63 mc 1.44677,1.44677,0.63342,90,90,120 - - 7.92 X 56617
C-Ho-Sn Ho0.75 Sn0.25 C0.12 Cu,cF4,225 Fm-3m 0.4835,0.4835,0.4835,90,90,90 close-packed structure - 9.10 F 6078
C-Ho-Sn Ho3SnC CaTiO3,cP5,221 Pm-3m 0.4829,0.4829,0.4829,90,90,90 perovskite family - 9.22 X 3196
C-Ho-Th Th1.6 Ho0.4 C3 ht-hp Pu2C3,cI40,220 I-43d 0.8526,0.8526,0.8526,90,90,90 - - 10.14 A 7468
C-Ho-Tl TlHo 3C CaTiO3,cP5,221 Pm-3m 0.4848,0.4848,0.4848,90,90,90 perovskite family - 10.36 X 33965
C-Ho-W HoWC2 UMoC2,oP16,62 Pnma 0.59103,0.35807,1.112,90,90,90 - - 10.52 A 34411
C-Ho-Y Y0.75 Ho0.25 C2 rt CaC2,tI6,139 I4/mmm 0.366,0.366,0.6166,90,90,90 - - 5.31 X 17249
C-I-La LaCI mon1 GdCBr-a,mS12,12 C12/m1 0.7619,0.41252,1.07513,90,93.143,90 - bronze 5.47 X 36086
C-I-La LaCI mon2 GdCBr-b,mS12,12 C12/m1 0.76132,0.41324,1.0859,90,100.835,90 - bronze 5.50 X 36086
C-I-La La10C4I15 La10C4I15,aP29,2 P-1 0.9747,1.0655,1.1736,93.68,114.44,109.28 - red dark 5.45 X 45665
C-I-La La12C6I17 Gd12C6I17,mS140,15 C12/c1 1.9927,1.2636,1.9399,90,90.24,90 - black 5.30 X 45808
Handbook of Inorganic Substances – Edition 2015 : Data 363

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-I-La La3CI5 La3CI5,aP18,2 P-1 0.7955,0.9687,0.9728,107.81,97.34,105.56 - violet 5.28 X 45665


C-I-La La3C2I3 La3C2Br3,oS128,20 C222 1 1.2026,1.7739,1.7735,90,90,90 - black 5.77 X 51600
C-I-La La4C1.5I5 La4C1.5 I5,mS28,12 C12/m1 1.9836,0.4142,0.8952,90,103.95,90 - gray silver 5.62 X 51555
C-I-La La4C2I5 La4C2I5,mS26,12 C12/m1 1.9907,0.4184,0.8963,90,104.36,90 - gray silver 5.58 X 51555
C-I-La La5C2I9 ht La5C2I9,oP128,61 Pbca 0.80247,1.6887,3.5886,90,90,90 - green 5.08 X 51567
C-I-La La5C2I9 rt La5C2I9,aP32,2 P-1 0.8006,1.0088,1.4383,79.34,80.75,85.07 - red dark 5.49 X 45665
C-I-La La7C3I10 La7C3I10,aP40,2 P-1 0.9761,1.179,1.4055,79.6,71.49,65.79 - black green 5.42 X 47594
C-I-N [ICN] CSO,hR9,160 R3m 0.687,0.687,0.596,90,90,120 - - 3.13 X 170
C-I-Nd Nd12 C6I17 Gd12 C6I17,mS140,15 C12/c1 1.9574,1.2393,1.9003,90,90.41,90 - black 5.71 X 48935
C-I-O C4I2 O2 C4I2 O2,tP64,92 P41212 0.5997,0.5997,3.9191,90,90,90 - yellow 3.15 X 23087
C-I-Pr Pr12 C6I17 Gd12 C6I17,mS140,15 C12/c1 1.961,1.2406,1.9062,90,90.45,90 - gray silver 5.62 X 48935
C-I-Pr Pr7C3I10 La7C3I10,aP40,2 P-1 0.9663,1.1619,1.3866,80.31,71.79,65.9 - black 5.64 X 51412
C-I-S C2S3I C2S3 I,mS96,15 C12/c1 1.5443,0.9922,1.6375,90,116.79,90 - red 2.93 X 46306
C-I-Sc Sc12 C5I15 Sc12 C5I15,cP512,205 Pa-3 2.55182,2.55182,2.55182,90,90,90 - black 4.00 X 45894
C-I-Sc Sc2CI3 m Sc2CI3,aP48,2 P-1 1.0793,1.0803,1.3959,87.8,73.04,60.8 - black 4.76 X 20036
C-I-Sc Sc6C2I11 Sc6C2I11,aP38,2 P-1 0.903,1.0046,1.4152,89.27,75.64,69.55 - black 4.83 X 20036
C-I-Sc Sc7CI12 Sc7CI12,hR60,146 R3 1.4717,1.4717,0.9847,90,90,120 - purple dark 4.99 X 18959
C-I-Tb Tb2CI Cr2AlC,hP8,194 P63/mmc 0.37707,0.37707,1.466,90,90,120 - - 8.40 A 26858
C-I-Y YCI GdCBr-a,mS12,12 C12/m1 0.7174,0.3866,1.0412,90,92.98,90 - bronze 5.25 X 29618
C-I-Y Y10C2I13 Y10C2I13,mS50,12 C12/m1 2.1317,0.3957,1.9899,90,97.4,90 - black 5.11 X 23375
C-I-Y Y19C6I34 Y19C6I34,aP59,2 P-1 0.93683,1.0341,2.2173,79.104,88.175,69.277 - black 5.12 X 55468
C-I-Y Y2CI2 Ta2CS2,hP5,164 P-3m1 0.3922,0.3922,1.0404,90,90,120 - green olive 5.32 A 31015
C-I-Y Y4CI5 Y4CI5,mS20,12 C12/m1 1.8479,0.3947,0.8472,90,103.22,90 - red dark 5.53 X 21165
C-I-Y Y5C2I9 Gd5C2Cl9,mP64,14 P121/c1 1.0475,1.7167,1.40026,90,121.166,90 - black 4.97 X 31202
C-I-Y Y6C2I7 Y6C2I7,mS30,12 C12/m1 2.1557,0.39093,1.2374,90,123.55,90 - black 5.53 X 21165
C-I-Zr Zr6CI12 Zr6CI12,hR57,148 R-3 1.4508,1.4508,1.0007,90,90,120 - - 5.69 X 18001
C-I-Zr Zr6CI14 Zr6CI14,oS84,64 Cmce 1.569,1.4218,1.2808,90,90,90 - - 5.43 X 18001
C-In-La La3InC CaTiO3,cP5,221 Pm-3m 0.5121,0.5121,0.5121,90,90,90 perovskite family - 6.72 X 33965
C-In-Lu Lu3InC CaTiO3,cP5,221 Pm-3m 0.4762,0.4762,0.4762,90,90,90 perovskite family - 10.02 X 33965
C-In-Mn Mn3 InC CaTiO3,cP5,221 Pm-3m 0.3992,0.3992,0.3992,90,90,90 perovskite family - 7.61 X 25299
C-In-N In[CN]3 Ga[CN]3,cP7,221 Pm-3m 0.5627,0.5627,0.5627,90,90,90 - - 1.80 X 34354
C-In-N In2.24 [NCN]3 In2.24 [NCN]3,hR72,167 R-3c 0.60609,0.60609,2.8844,90,90,120 - amber 4.10 X 31229
C-In-Nb Nb2 InC Cr2AlC,hP8,194 P63/mmc 0.3172,0.3172,1.437,90,90,120 - - 8.29 A 2312
C-In-Nd Nd3 InC0.85 CaTiO3,cP5,221 Pm-3m 0.50667,0.50667,0.50667,90,90,90 perovskite family - 7.12 X 42248
C-In-Ni Ni3In0.95 C CaTiO3,cP5,221 Pm-3m 0.37836,0.37836,0.37836,90,90,90 perovskite family - 9.11 X 49455
C-In-Pd Pd0.67 In0.22 C0.11 W,cI2,229 Im-3m 0.3795,0.3795,0.3795,90,90,90 b.c.c. family - 5.95 X 1560
C-In-Pr Pr3InC CaTiO3,cP5,221 Pm-3m 0.5056,0.5056,0.5056,90,90,90 perovskite family - 7.06 X 33965
C-In-Pt Pt3InC0.5 CaTiO3,cP5,221 Pm-3m 0.3988,0.3988,0.3988,90,90,90 perovskite family - 18.49 X 1560
C-In-Sc Sc3InC CaTiO3,cP5,221 Pm-3m 0.45368,0.45368,0.45368,90,90,90 perovskite family - 4.65 X 33965
C-In-Sm Sm3 InC CaTiO3,cP5,221 Pm-3m 0.4989,0.4989,0.4989,90,90,90 perovskite family - 7.73 X 33965
C-In-Tb Tb3InC CaTiO3,cP5,221 Pm-3m 0.4916,0.4916,0.4916,90,90,90 perovskite family - 8.44 X 33965
C-In-Ti Ti0.86 In0.14 C0.03 rt Mg,hP2,194 P63/mmc 0.2959,0.2959,0.4687,90,90,120 close-packed structure - 5.39 F 44794
C-In-Ti Ti0.95 In0.05 C0.33 NaCl,cF8,225 Fm-3m 0.4265,0.4265,0.4265,90,90,90 rocksalt family - 4.73 X 44794
C-In-Ti Ti2InC Cr2AlC,hP8,194 P63/mmc 0.3132,0.3132,1.406,90,90,120 - - 6.19 X 1960
C-In-Ti Ti3InC0.93 CaTiO3,cP5,221 Pm-3m 0.423,0.423,0.423,90,90,90 perovskite family - 5.92 X 44794
C-In-Tm Tm3 InC CaTiO3,cP5,221 Pm-3m 0.4801,0.4801,0.4801,90,90,90 perovskite family - 9.51 X 33965
C-In-Y Y3InC CaTiO3,cP5,221 Pm-3m 0.49023,0.49023,0.49023,90,90,90 perovskite family - 5.55 X 30305
C-In-Yb Yb3InC CaTiO3,cP5,221 Pm-3m 0.4782,0.4782,0.4782,90,90,90 perovskite family - 9.81 X 33965
C-In-Zr Zr2InC Cr2AlC,hP8,194 P63/mmc 0.3347,0.3347,1.491,90,90,120 - - 7.10 X 1960
C-Ir-Mo Mo0.6 Ir0.4C0.2 ht NaCl,cF8,225 Fm-3m 0.4018,0.4018,0.4018,90,90,90 rocksalt family - 14.01 X 6000
C-Ir-O Ir[CO]3 Ir[CO]3,hP116,143 P3 1.32902,1.32902,0.89809,90,90,120 - yellow 4.01 X 11514
C-Ir-O Ir3[CO]8 mon1 Ir3[CO]8,mP152,13 P12/c1 1.3622,1.2807,1.8589,90,132.65,90 - - 4.46 X 17061
C-Ir-O Ir3[CO]8 mon2 Ir3[CO]8,mS152,15 C12/c1 1.6656,0.9761,1.6776,90,118.09,90 - - 4.42 X 17061
C-Ir-Sc ScIr3C CaTiO3,cP5,221 Pm-3m 0.3994,0.3994,0.3994,90,90,90 perovskite family - 16.51 X 10736
C-Ir-Sc Sc3IrC4 mon Sc3RhC4,mS32,12 C12/m1 0.55996,1.2241,0.55994,90,105.35,90 - - 6.73 X 45559
C-Ir-Sc Sc3IrC4 orth Sc3CoC4,oI16,71 Immm 0.33974,0.44538,1.2235,90,90,90 - gray 6.73 A 26435
C-Ir-U U2IrC2 Na2HgO2,tI10,139 I4/mmm 0.34804,0.34804,1.24821,90,90,90 - - 15.21 X 5645
C-Ir-W W0.6 Ir0.4 C0.2 ht NaCl,cF8,225 Fm-3m 0.4,0.4,0.4,90,90,90 rocksalt family - 19.68 X 6000
C-K-N K[CC3N3] K[CC3N3],aP16,2 P-1 0.389,0.8665,0.8873,75.,86.7,89.9 - - 1.49 X 5667
C-K-N K[CN] hp K[CN],mS6,8 C1m1 0.55307,0.52093,0.37431,90,94.42,90 - - 2.01 X 8485
C-K-N K[CN] ht-hp K[CN],cP9,221 Pm-3m 0.3808,0.3808,0.3808,90,90,90 - - 1.96 X 8485
C-K-N K[CN] lt-hp1 K[CN],mS12,9 C1c1 0.7433,0.4606,0.81217,90,108.518,90 - - 1.64 X 14515
C-K-N K[CN] lt-hp2 K[CN],mS12,15 C12/c1 0.7441,0.4595,0.81417,90,108.563,90 - - 1.64 X 27955
C-K-N K[CN] lt-hp3 K[CN],mS12,12 C12/m1 0.79402,0.42694,0.81234,90,107.711,90 - - 1.65 X 27955
C-K-N K[CN] lt-hp4 K[CN],aP12,2 P-1 0.4493,0.75628,0.8167,71.391,87.729,86.243 - - 1.65 X 27955
C-K-N K[CN] lt1 Na[CN],oP6,59 Pmmn 0.4187,0.60735,0.52457,90,90,90 - - 1.62 X 27955
C-K-N K[CN] lt2 K(Br0.05 [CN]0.95 ),oI4,71 Immm 0.4224,0.51842,0.61342,90,90,90 - - 1.61 X 27955
C-K-N K[CN] m *,aP6,2 P-1 0.44147,0.443,0.8129,104.736,91.33,117.93 - - - N 22640
C-K-N K[CN] rt NaCl,cF8,225 Fm-3m 0.64802,0.64802,0.64802,90,90,90 rocksalt family colorless 1.59 X 27955
C-K-N K2[NCN] K2[NCN],mS10,12 C12/m1 0.5762,0.5669,0.5756,90,108.78,90 - colorless 2.21 X 59467
C-K-N K3C6[NCN]3N7 K3C6[NCN]3N7,mP200,14 P121/c1 1.3213,1.7556,1.3114,90,114.17,90 - colorless 1.95 X 52146
C-K-O K2[CO3] ht K2[CO3],hP66,194 P63/mmc 0.56948,0.56948,0.73301,90,90,120 - - 2.23 X 44416
C-K-O K2[CO3] rt mon1 K2[CO3],mP24,14 P121/c1 0.56396,0.98391,0.68741,90,98.703,90 - - 2.43 X 34741
C-K-O K2[CO3] rt mon2 K2[CO3],mS24,15 C12/c1 0.5675,0.992,0.7018,90,96.8,90 - - 2.34 X 9648
C-K-O K2[C2O4] ht K2[C2O4],hP148,194 P63/mmc 0.62643,0.62643,0.79281,90,90,120 - - 2.05 X 44416
C-K-O K2[C2O4] rt K2[C2O4],oP16,55 Pbam 0.61159,1.09118,0.344,90,90,90 - - 2.40 X 41509
C-K-O K2[C2O6] K2[C2O6],mP40,14 P121/c1 0.83805,1.07641,0.71167,90,111.24,90 - blue light 2.20 X 39711
C-K-O K2[OC2O] K2[OC2O],tI12,139 I4/mmm 0.3927,0.3927,1.275,90,90,90 - yellow 2.27 X 1897
364 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-K-Rb RbK2[C60 ] K3[C60],cF492,225 Fm-3m 1.4244,1.4244,1.4244,90,90,90 fullerene family - 2.03 X 35084


C-K-S K2CS3 *,oS72,40 Ama2 1.2179,1.5739,1.0057,90,90,90 - - - N 4525
C-La-Mn LaMn11C1.5 LaMn11C1.5 ,tI56,141 I41/amd 1.04134,1.04134,0.67293,90,90,90 - gray silver 6.93 X 18634
C-La-Mn La11Mn3C18 La11Mn3C18,hR192,148 R-3 1.52649,1.52649,1.6013,90,90,120 - - 5.89 X 54998
C-La-Mn La2Mn17C1.8 Pr2Mn17C1.77 ,hR66,166 R-3m 0.8983,0.8983,1.294,90,90,120 CaCu5-Zr4Al3 - 6.79 A 18953
C-La-Mn La3.67 MnC6 La3.67 FeC6 ,hP24,176 P63 /m 0.8806,0.8806,0.5329,90,90,120 - brown dark 5.91 A 32658
C-La-N La[NC2N2 ]3 Nd[NC2N2 ]3,oS64,63 Cmcm 0.79988,1.1582,1.0267,90,90,90 - white 2.35 X 45253
C-La-Nd La0.5 Nd0.5 C2 CaC2,tI6,139 I4/mmm 0.3878,0.3878,0.6492,90,90,90 - - 5.63 A 7487
C-La-Ni LaNiC2 CeNiC2,oS8,38 Amm2 0.3959,0.4564,0.6204,90,90,90 - - 6.57 A 16514
C-La-Ni La2Ni22C3 Ce2Ni22C2.75 ,oS216,64 Cmce 1.143,1.513,1.473,90,90,90 - - 8.37 X 24707
C-La-Ni La2Ni5C3 La2Ni5C3,tP20,127 P4/mbm 0.83285,0.83285,0.40269,90,90,90 - gray 7.22 X 22447
C-La-O LaCO ThCN,mS12,12 C12/m1 0.7069,0.3985,0.731,90,95.7,90 - - 5.41 X 9899
C-La-O La2[CO3]O2 hex Nd2[CO3]O2,hP24,194 P63 /mmc 0.40755,0.40755,1.5957,90,90,120 - - 5.35 X 22604
C-La-O La2[CO3]O2 mon La2[CO3]O2,mS96,15 C12/c1 1.2239,0.70668,1.6465,90,104.31,90 - - 5.34 X 39116
C-La-O La2[CO3]O2 orth La2[CO3]O2,oS192,40 Ama2 3.1914,1.2247,0.7063,90,90,90 - - 5.34 X 39116
C-La-O La2[CO3]O2 rt *,mP*,* - 0.4072,1.3509,0.4083,90,90.96,90 - - - N 33719
C-La-Os La3.67 OsC6 La3.67 FeC6 ,hP24,176 P63 /m 0.88944,0.88944,0.53492,90,90,120 - gray 7.00 X 39525
C-La-Os La5Os3C3.25 La5Os3C4,hP24,193 P63 /mcm 0.91957,0.91957,0.67386,90,90,120 - gray dark 8.78 X 33462
C-La-Os La7Os4C9 La7Os4C9,mS40,12 C12/m1 1.1985,0.542,1.1962,90,111.04,90 - - 8.43 X 50993
C-La-P La4P 1.92 C2.16 La4P 1.92 C2.16 ,cI52,199 I213 0.893,0.893,0.893,90,90,90 - - 5.98 X 55443
C-La-Pb La3PbC CaTiO3,cP5,221 Pm-3m 0.5171,0.5171,0.5171,90,90,90 perovskite family - 7.64 X 33965
C-La-Pb La5Pb3C0.75 CuHf5Sn3,hP18,193 P63 /mcm 0.9529,0.9529,0.6992,90,90,120 AlB2 family - 8.00 A 29066
C-La-Pr La0.5 Pr0.5 C2 CaC2,tI6,139 I4/mmm 0.3905,0.3905,0.65,90,90,90 - - 5.49 A 7487
C-La-Re La12Re5C15 La12Re5C15 ,hP32,189 P-62m 1.1168,1.1168,0.5453,90,90,120 - gray dark 7.83 X 29688
C-La-Rh LaRhC2 LaRhC2,tP16,76 P41 0.3981,0.3981,1.5351,90,90,90 - - 7.26 X 21804
C-La-Rh LaRh3C ht CaTiO3,cP5,221 Pm-3m 0.422,0.422,0.422,90,90,90 perovskite family - 10.16 X 53254
C-La-Ru La3.65 RuC6 La3.67 FeC6 ,hP24,176 P63 /m 0.8879,0.8879,0.5356,90,90,120 - gray 6.18 X 55504
C-La-Si La3Si2C2 Pr3Si2C2,oS20,65 Cmmm 0.4039,1.6884,0.4506,90,90,90 - gray 5.37 A 34802
C-La-Sn La0.75 Sn0.25 C0.138 Cu,cF4,225 Fm-3m 0.518,0.518,0.518,90,90,90 close-packed structure - 6.48 F 6078
C-La-Sn La3SnC CaTiO3,cP5,221 Pm-3m 0.5133,0.5133,0.5133,90,90,90 perovskite family - 6.72 X 3190
C-La-Tb La0.53 Tb0.47 C2 rt CaC2,tI6,139 I4/mmm 0.3841,0.3841,0.6356,90,90,90 - - 6.10 A 11656
C-La-Th La1.4 Th0.6 C3 ht-hp Pu2C3,cI40,220 I-43d 0.8785,0.8785,0.8785,90,90,90 - - 7.24 A 5328
C-La-Tl TlLa3C CaTiO3,cP5,221 Pm-3m 0.5146,0.5146,0.5146,90,90,90 perovskite family - 7.71 X 33965
C-La-Tm La0.5 Tm0.5 C2 CaC2,cF36,225 Fm-3m 0.562,0.562,0.562,90,90,90 - - 6.66 A 7487
C-La-U La0.25 U0.75 C2 ht CaC2,cF36,225 Fm-3m 0.553,0.553,0.553,90,90,90 - - 9.32 A 25047
C-La-U La0.84 U0.16 C2 rt CaC2,tI6,139 I4/mmm 0.3925,0.3925,0.63891,90,90,90 - - 6.03 A 6783
C-La-Y La0.28 Y0.72 C2 CaC2,tI6,139 I4/mmm 0.369,0.369,0.6268,90,90,90 - - 4.94 A 14292
C-La-Y La0.52 Y0.48 C2 CaC2,cF36,225 Fm-3m 0.5709,0.5709,0.5709,90,90,90 - - 4.96 A 14292
C-Li-N Li[CN] Li[CN],oP12,62 Pnma 0.873,0.373,0.652,90,90,90 - - 1.03 X 221
C-Li-N Li2[NCN] Li2[NCN],tI10,139 I4/mmm 0.3687,0.3687,0.8668,90,90,90 - colorless 1.52 X 11582
C-Li-O Li2[CO3] hp Li2[CO3],hP12,193 P63 /mcm 0.44568,0.44568,0.51254,90,90,120 - - 2.78 X 41917
C-Li-O Li2[CO3] rt Li2[CO3],mS24,15 C12/c1 0.8361,0.4976,0.6193,90,114.69,90 zabuyelite colorless 2.10 X 23299
C-Li-O Li2[C2O4] Li2[C2O4],mP16,14 P121/c1 0.34,0.5156,0.93565,90,105.601,90 - - 2.14 X 2111
C-Li-O Li2[C4O4] Li2[C4O4],mS20,12 C12/m1 0.71073,0.95627,0.32973,90,101.11,90 - - 1.90 X 45783
C-Lu-Mn Lu10Mn13 C18 Dy10(Dy0.14 Mn0.86)Mn12C18 ,cI82,217 I-43m 1.0012,1.0012,1.0012,90,90,90 - - 8.87 A 27414
C-Lu-Mn Lu12Mn5C15 La12Re5C15 ,hP32,189 P-62m 1.0303,1.0303,0.4902,90,90,120 - black 9.41 A 31743
C-Lu-Mn Lu2Mn17C3 Tb2Mn17C2.5 ,hP44,194 P63 /mmc 0.8657,0.8657,0.8518,90,90,120 CaCu5-Zr4Al3 - 7.93 A 20415
C-Lu-Mo Lu2Mo2C3 Er2Mo2C3 ,mS14,12 C12/m1 1.41401,0.32793,0.5581,90,110.3,90 - - 7.91 A 19771
C-Lu-N Lu2[NCN]3 Lu2[NCN]3,hR33,155 R32 0.62732,0.62732,1.4681,90,90,120 - - 4.68 X 46500
C-Lu-Ni LuNiC2 CeNiC2,oS8,38 Amm2 0.34471,0.4481,0.5983,90,90,90 - - 9.26 A 19068
C-Lu-Ni Lu11Ni60C6 Yb11Ni60C6,cI154,229 Im-3m 1.2414,1.2414,1.2414,90,90,90 - - 9.58 A 26067
C-Lu-Ni Lu4Ni13C4 Er4Ni13C4 ,oS42,65 Cmmm 1.1638,1.1918,0.3821,90,90,90 - - 9.47 A 24669
C-Lu-Ni Lu4Ni2C5 Yb4Ni2C5,oP11,25 Pmm2 0.3511,1.1384,0.3651,90,90,90 - gray silver 9.98 A 28173
C-Lu-Pb Lu3PbC CaTiO3,cP5,221 Pm-3m 0.4757,0.4757,0.4757,90,90,90 perovskite family - 11.48 X 33965
C-Lu-Pr Pr0.5 Lu0.5 C2 CaC2,cF36,225 Fm-3m 0.562,0.562,0.562,90,90,90 - - 6.81 A 7487
C-Lu-Re Lu2ReC2 Pr2ReC2,oP20,62 Pnma 0.64449,0.49611,0.9628,90,90,90 - - 12.09 A 23790
C-Lu-Re Lu5Re2C7 Sc5Re2C7,oS28,65 Cmmm 0.79144,1.41808,0.33279,90,90,90 - gray dark 11.84 X 33968
C-Lu-Rh LuRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.4085,0.4085,0.4085,90,90,90 perovskite family - 11.99 X 6791
C-Lu-Ru LuRu3C CaTiO3,cP5,221 Pm-3m 0.4106,0.4106,0.4106,90,90,90 perovskite family - 11.76 X 30191
C-Lu-Sn Lu3SnC CaTiO3,cP5,221 Pm-3m 0.4733,0.4733,0.4733,90,90,90 perovskite family - 10.27 X 33965
C-Lu-Th Th1.4 Lu0.6 C3 ht-hp Pu2C3,cI40,220 I-43d 0.8461,0.8461,0.8461,90,90,90 - - 10.22 A 7468
C-Lu-Tl TlLu3C CaTiO3,cP5,221 Pm-3m 0.4752,0.4752,0.4752,90,90,90 perovskite family - 11.47 X 33965
C-Mg-N Mg[CN]2 Zn[CN]2,cP10,224 Pn-3m 0.6122,0.6122,0.6122,90,90,90 - colorless 1.11 X 39149
C-Mg-N Mg[NCN] rt Ca[NCN],hR12,166 R-3m 0.32734,0.32734,1.41282,90,90,120 - colorless 2.45 X 28779
C-Mg-N Mg[NC2N2]2 rt Ni[NC2N2 ]2,oP22,58 Pnnm 0.61714,0.71697,0.74035,90,90,90 - white 1.59 X 39107
C-Mg-Ni MgNi3C CaTiO3,cP5,221 Pm-3m 0.38106,0.38106,0.38106,90,90,90 perovskite family - 6.37 X 59347
C-Mg-O Mg[CO3] rt Ca[CO3],hR30,167 R-3c 0.46149,0.46149,1.4867,90,90,120 magnesite - 3.06 X 32839
C-Mg-O Mg[C2O4] *,mS28,15 C12/c1 0.9413,0.6229,0.5724,90,96.47,90 - - - N 5809
C-Mg-Pt Mg0.96Pt2.88 C0.16 CaTiO3,cP5,221 Pm-3m 0.3904,0.3904,0.3904,90,90,90 perovskite family - 16.39 X 1560
C-Mn-Mo Mo0.2Mn1.8 C *,hP*,* - 0.2716,0.2716,0.4519,90,90,120 - - - N 6290
C-Mn-Mo Mo1.7Mn0.3 C ht1 Fe2N0.94 ,oP12,60 Pbcn 0.4684,0.5927,0.5129,90,90,90 - - 8.94 A 6290
C-Mn-Mo Mo1.74Mn21.26 C6 rt Cr21W2C6 ,cF116,225 Fm-3m 1.063,1.063,1.063,90,90,90 - - 7.78 A 6290
C-Mn-Mo Mo3Mn3C W3Fe3C,cF112,227 Fd-3m 1.113,1.113,1.113,90,90,90 η-carbide - 8.95 A 6290
C-Mn-N MnC0.30 N0.105 ZrO0.37 ,hP12,182 P6322 0.4778,0.4778,0.4486,90,90,120 - - 6.74 A 29086
C-Mn-N Mn[CC3N3]2 *,oP30,53 Pmna 0.76791,0.53837,1.0623,90,90,90 - colorless 1.78 N 34207
C-Mn-N Mn[CN]2 Zn[CN]2,cP10,224 Pn-3m 0.61488,0.61488,0.61488,90,90,90 - - 1.53 X 58285
C-Mn-N Mn[NCN] Ca[NCN],hR12,166 R-3m 0.33583,0.33583,1.4347,90,90,120 - green 3.38 X 44676
C-Mn-N Mn[NC2N2]2 Ni[NC2N2 ]2,oP22,58 Pnnm 0.61486,0.73155,0.75371,90,90,90 - - 1.83 X 37992
Handbook of Inorganic Substances – Edition 2015 : Data 365

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Mn-Nd NdMn11C2 LaMn11C1.5 ,tI56,141 I41/amd 1.03369,1.03369,0.6706,90,90,90 - - 7.16 A 20415


C-Mn-Nd Nd12 Mn5C15 La12 Re5C15,hP32,189 P-62m 1.0758,1.0758,0.5245,90,90,120 - black 6.90 A 31743
C-Mn-Nd Nd3.67 MnC6 La3.67 FeC6,hP24,176 P63/m 0.8601,0.8601,0.519,90,90,120 - brown dark 6.56 A 32658
C-Mn-O Mn[CO]5 Mn[CO]5,mS88,15 C12/c1 1.72971,0.68799,1.41257,90,126.971,90 - golden 1.93 X 41273
C-Mn-O Mn[CO3] Ca[CO3],hR30,167 R-3c 0.4772,0.4772,1.5637,90,90,120 rhodochrosite - 3.71 X 29895
C-Mn-Pr PrMn11C1.5 LaMn11C1.5 ,tI56,141 I41/amd 1.0372,1.0372,0.6715,90,90,90 - - 7.02 A 18634
C-Mn-Pr Pr12 Mn5C15 La12 Re5C15,hP32,189 P-62m 1.0847,1.0847,0.524,90,90,120 - black 6.67 A 31743
C-Mn-Pr Pr2Mn17C1.77 Pr2Mn17C1.77 ,hR66,166 R-3m 0.88714,0.88714,1.2783,90,90,120 CaCu5-Zr4Al3 - 7.07 X 18953
C-Mn-Pr Pr3.67 MnC6 La3.67 FeC6,hP24,176 P63/m 0.8658,0.8658,0.5213,90,90,120 - brown dark 6.32 A 32658
C-Mn-Si Mn0.05 Si0.95 C ZnS,cF8,216 F-43m 0.43619,0.43619,0.43619,90,90,90 adamantane structure - 3.32 X 49268
C-Mn-Si Mn22.6 Si5.4 C4 Mn22.6 Si5.4 C4,aP32,1 P1 0.64492,0.64863,0.9944,85.817,80.412,60.521 - - 6.70 X 8843
C-Mn-Si Mn5 SiC Mn5 SiC,oS56,36 Cmc21 1.0198,0.8035,0.763,90,90,90 - - 6.69 X 9717
C-Mn-Si Mn5 Si3C0.8 CuHf5Sn3,hP18,193 P63/mcm 0.6939,0.6939,0.4831,90,90,120 AlB2 family - 6.08 X 52651
C-Mn-Sm Sm12 Mn5C15 La12 Re5C15,hP32,189 P-62m 1.0639,1.0639,0.5174,90,90,120 - black 7.40 A 31743
C-Mn-Sm Sm2 Mn17C1.8 Pr2Mn17C1.77 ,hR66,166 R-3m 0.881,0.881,1.2777,90,90,120 CaCu5-Zr4Al3 - 7.29 A 18953
C-Mn-Sn Mn3 SnC CaTiO3,cP5,221 Pm-3m 0.39911,0.39911,0.39911,90,90,90 perovskite family - 7.72 X 53826
C-Mn-Tb Tb10 Mn13C18 Dy10 (Dy0.14 Mn0.86)Mn12C18,cI82,217 I-43m 1.0201,1.0201,1.0201,90,90,90 - - 7.88 A 27414
C-Mn-Tb Tb12 Mn5C15 La12 Re5C15,hP32,189 P-62m 1.0518,1.0518,0.5071,90,90,120 - black 8.07 A 31743
C-Mn-Tb Tb2Mn17.54 C0.93 Y2Fe17N1.7 ,hP50,194 P63/mmc 0.86073,0.86073,0.84581,90,90,120 - - 7.91 X 33110
C-Mn-Tb Tb3Mn2C6 Gd3Mn2C6,hP22,176 P63/m 0.8105,0.8105,0.5005,90,90,120 - - 7.68 X 28210
C-Mn-Th ThMn11C2 LaMn11C1.5 ,tI56,141 I41/amd 1.03294,1.03294,0.66962,90,90,90 - - 8.00 A 20415
C-Mn-Th Th2Mn17C3 Pr2Mn17C1.77 ,hR66,166 R-3m 0.87861,0.87861,1.2649,90,90,120 CaCu5-Zr4Al3 - 8.45 A 20415
C-Mn-Tm Tm10 Mn13C18 Dy10 (Dy0.14 Mn0.86)Mn12C18,cI82,217 I-43m 1.0043,1.0043,1.0043,90,90,90 - - 8.59 A 27414
C-Mn-Tm Tm12 Mn5C15 La12 Re5C15,hP32,189 P-62m 1.0355,1.0355,0.4948,90,90,120 - black 8.97 A 31743
C-Mn-Tm Tm2 MnC4 Er2FeC4,oI28,72 Ibam 0.759,0.9299,0.5003,90,90,90 - gray 8.29 A 28182
C-Mn-Tm Tm2 Mn17C3 Tb2Mn17C2.5 ,hP44,194 P63/mmc 0.8658,0.8658,0.85,90,90,120 CaCu5-Zr4Al3 - 7.87 A 20415
C-Mn-U UMnC2 UMoC2,oP16,62 Pnma 0.504,0.3172,1.074,90,90,90 - - 12.26 A 6776
C-Mn-V V0.82 Mn0.18 C0.74 NaCl,cF8,225 Fm-3m 0.4158,0.4158,0.4158,90,90,90 rocksalt family - 5.59 X 6311
C-Mn-W W0.2Mn1.8 C0.9 *,h**,* - 0.2798,0.2798,0.4519,90,90,120 - - - N 6290
C-Mn-W W1.7Mn0.3 C orth Fe2N0.94 ,oP12,60 Pbcn 0.4696,0.5969,0.5163,90,90,90 - - 15.65 A 6290
C-Mn-W W1.74 Mn21.26 C6 rt Cr21 W2C6,cF116,225 Fm-3m 1.063,1.063,1.063,90,90,90 - - 8.63 A 6290
C-Mn-W W3Mn3C W3Fe3C,cF112,227 Fd-3m 1.111,1.111,1.111,90,90,90 η-carbide - 14.11 A 6290
C-Mn-W W8.8Mn3.2 C4 W10 Co3C3.4,hP34,194 P63/mmc 0.7764,0.7764,0.7775,90,90,120 - - 15.07 A 6290
C-Mn-Y Y10Mn13C18 Dy10 (Dy0.14 Mn0.86)Mn12C18,cI82,217 I-43m 1.0147,1.0147,1.0147,90,90,90 - - 5.78 A 27414
C-Mn-Y Y12Mn5C15 La12 Re5C15,hP32,189 P-62m 1.0494,1.0494,0.5038,90,90,120 - black 5.26 A 31743
C-Mn-Y Y2MnC4 Er2FeC4,oI28,72 Ibam 0.7635,0.9497,0.5088,90,90,90 - gray 5.06 A 28182
C-Mn-Y Y2Mn17C3 Tb2Mn17C2.5 ,hP44,194 P63/mmc 0.86989,0.86989,0.8527,90,90,120 CaCu5-Zr4Al3 - 6.82 A 20415
C-Mn-Yb Yb10.09 Mn12.91 C18 Dy10 (Dy0.14 Mn0.86)Mn12C18,cI82,217 I-43m 1.0014,1.0014,1.0014,90,90,90 - gray silver 8.84 X 27414
C-Mn-Zn ZnMn3C lt ZnMn3C,tP5,123 P4/mmm 0.3923,0.3923,0.38963,90,90,90 - - 6.71 X 7608
C-Mn-Zn ZnMn3C rt CaTiO3,cP5,221 Pm-3m 0.393,0.393,0.393,90,90,90 perovskite family - 6.63 X 20469
C-Mo-N MoC0.25 N0.25 ht2 NiAs,hP4,194 P63/mmc 0.298,0.298,0.4762,90,90,120 AlB2 family - 9.29 X 5464
C-Mo-N MoC0.5 N0.5 rt WC,hP2,187 P-6m2 0.289,0.289,0.2812,90,90,120 AlB2 family - 8.90 X 5464
C-Mo-Nb Nb0.3 Mo0.7 C0.5 ht2 NiAs,hP4,194 P63/mmc 0.3036,0.3036,0.48,90,90,120 AlB2 family - 8.76 X 1483
C-Mo-Nb Nb0.4 Mo0.6 C0.82 NaCl,cF8,225 Fm-3m 0.4382,0.4382,0.4382,90,90,90 rocksalt family - 8.26 X 16025
C-Mo-Nd Nd2 MoC2 Pr2MoC2,tP20,136 P42/mnm 0.58037,0.58037,1.02481,90,90,90 - gray silver 7.86 X 49520
C-Mo-Ni Mo3.35 Ni2.35 C W3Fe3C,cF112,227 Fd-3m 1.1188,1.1188,1.1188,90,90,90 η-carbide - 8.94 A 4879
C-Mo-Ni Mo6 Ni6C W6Fe6C,cF104,227 Fd-3m 1.08932,1.08932,1.08932,90,90,90 η-carbide - 9.66 X 21527
C-Mo-O Mo[CO]6 Cr[CO]6,oP52,62 Pnma 1.2019,1.1415,0.6488,90,90,90 - - 1.97 X 17652
C-Mo-Os Mo0.5 Os0.5 C0.33 ht NaCl,cF8,225 Fm-3m 0.405,0.405,0.405,90,90,90 rocksalt family - 14.70 X 12895
C-Mo-Pr Pr2MoC2 Pr2MoC2,tP20,136 P42/mnm 0.58129,0.58129,1.03253,90,90,90 - gray steel 7.65 X 44026
C-Mo-Pr Pr2Mo2C3 Pr2Mo2C3,mP28,14 P121/c1 0.59799,0.66515,1.1856,90,111.631,90 - gray dark 7.72 X 43972
C-Mo-Pt Mo0.6Pt0.4 C0.2 ht NaCl,cF8,225 Fm-3m 0.4029,0.4029,0.4029,90,90,90 rocksalt family - 14.02 X 6000
C-Mo-Pu PuMoC2 ht UMoC2,oP16,62 Pnma 0.5614,0.3218,1.0887,90,90,90 - - 12.29 A 3307
C-Mo-Re Mo0.5 Re0.5 C0.4 NaCl,cF8,225 Fm-3m 0.409,0.409,0.409,90,90,90 rocksalt family - 14.16 X 16396
C-Mo-Re Mo0.6 Re0.4 C0.2 NiAs,hP4,194 P63/mmc 0.2893,0.2893,0.57,90,90,120 AlB2 family - 10.81 X 6000
C-Mo-Rh Mo0.44 Rh0.56C0.22 NaCl,cF8,225 Fm-3m 0.3911,0.3911,0.3911,90,90,90 rocksalt family - 11.38 X 16396
C-Mo-Ru Mo0.34 Ru0.66C0.25 NaCl,cF8,225 Fm-3m 0.394,0.394,0.394,90,90,90 rocksalt family - 11.11 X 16396
C-Mo-Si Mo4.8 Si3C0.6 CuHf5Sn3,hP18,193 P63/mcm 0.7286,0.7286,0.5046,90,90,120 AlB2 family - 7.90 X 2476
C-Mo-Sm Sm2 Mo2C3 Ho2Cr2C3,mS14,12 C12/m1 1.1346,0.3439,0.5786,90,106.58,90 - - 8.12 X 49565
C-Mo-Ta Ta0.13 Mo0.87 C0.96 NaCl,cF8,225 Fm-3m 0.429,0.429,0.429,90,90,90 rocksalt family - 9.97 X 4075
C-Mo-Ta Ta0.88 Mo0.12 C0.5 NiAs,hP4,194 P63/mmc 0.3098,0.3098,0.491,90,90,120 AlB2 family - 14.38 X 4075
C-Mo-Tb TbMoC2 UMoC2,oP16,62 Pnma 0.567,0.3393,1.0831,90,90,90 - - 8.89 A 19771
C-Mo-Tb Tb2Mo 2C3 Er2Mo 2C3,mS14,12 C12/m1 1.17847,0.33381,0.57178,90,112.56,90 - gray dark 8.73 X 49565
C-Mo-Ti Ti0.011 Mo0.989 C0.011 W,cI2,229 Im-3m 0.31415,0.31415,0.31415,90,90,90 b.c.c. family - 10.23 F 3515
C-Mo-Ti Ti0.5 Mo0.5 C NaCl,cF8,225 Fm-3m 0.4313,0.4313,0.4313,90,90,90 rocksalt family - 6.95 X 10852
C-Mo-Ti Ti0.98 Mo0.02 C0.6 (Ti0.98 Mo0.02)C0.6,hP12,152 P3121 0.30738,0.30738,1.49111,90,90,120 - - 4.58 X 30765
C-Mo-Tm TmMoC2 UMoC2,oP16,62 Pnma 0.5603,0.3303,1.073,90,90,90 - - 9.66 A 19771
C-Mo-Tm Tm2 Mo2C3 Er2Mo 2C3,mS14,12 C12/m1 1.1502,0.3296,0.5629,90,111.05,90 - - 9.44 A 19771
C-Mo-U UMoC2 UMoC2,oP16,62 Pnma 0.5612,0.3241,1.0956,90,90,90 - - 11.93 X 21500
C-Mo-U U2Mo2C3 Er2Mo 2C3,mS14,12 C12/m1 1.1646,0.3239,0.5622,90,109.5,90 - - 11.70 A 58011
C-Mo-V V0.61 Mo0.39 C0.81 NaCl,cF8,225 Fm-3m 0.4213,0.4213,0.4213,90,90,90 rocksalt family - 6.95 X 272
C-Mo-W W0.36 Mo0.46 C NaCl,cF8,225 Fm-3m 0.4237,0.4237,0.4237,90,90,90 rocksalt family - 10.68 X 12578
C-Mo-W W0.5Mo0.5 C WC,hP2,187 P-6m2 0.2824,0.2824,0.2901,90,90,120 AlB2 family - 12.59 X 10048
C-Mo-Y YMoC2 UMoC2,oP16,62 Pnma 0.56604,0.3383,1.0818,90,90,90 - - 6.70 A 19771
C-Mo-Y Y1.8 Mo0.2C2.9 Pu2C3,cI40,220 I-43d 0.8239,0.8239,0.8239,90,90,90 - - 5.08 A 4710
C-Mo-Zr Zr0.003 Mo0.997 C0.003 W,cI2,229 Im-3m 0.3144,0.3144,0.3144,90,90,90 b.c.c. family - 10.26 F 3515
C-Mo-Zr Zr0.5Mo0.5 C NaCl,cF8,225 Fm-3m 0.446,0.446,0.446,90,90,90 rocksalt family - 7.91 X 5975
C-N-Na Na[CC3N3] Na[CC3N3],aP16,2 P-1 0.3705,0.7741,0.9198,74.24,88.31,79.84 - yellow 1.50 X 3404
366 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-N-Na Na[CN] lt1 K[CN],oI6,71 Immm 0.374,0.471,0.561,90,90,90 - - 1.65 X 154


C-N-Na Na[CN] lt2 Na[CN],oP6,59 Pmmn 0.363,0.545,0.485,90,90,90 - - 1.70 X 8928
C-N-Na Na[CN] rt K[CN],cF28,225 Fm-3m 0.59016,0.59016,0.59016,90,90,90 - colorless 1.58 A 41104
C-N-Na Na[NC2N2] Na[NC2N2 ],mP24,14 P121/c1 0.35725,1.4948,0.72036,90,116.174,90 - - 1.71 X 37235
C-N-Na Na2[NCN] K2[NCN],mS10,12 C12/m1 0.50456,0.5001,0.55359,90,110.078,90 - colorless 2.18 X 38214
C-N-Na Na3[C6N9 ] Na3[C6N9],mP72,14 P121/c1 0.35162,2.33806,1.11234,90,100.333,90 - - 1.97 X 37235
C-N-Na Na5[NCN]2[CN] Na5[NCN]2[CN],tI26,139 I4/mmm 0.7201,0.7201,0.6605,90,90,90 - colorless 2.14 X 59467
C-N-Nb NbC0.3 N0.7 NaCl,cF8,225 Fm-3m 0.445,0.445,0.445,90,90,90 rocksalt family - 8.01 X 3093
C-N-Nd Nd[NC2N2]3 Nd[NC2N2 ]3,oS64,63 Cmcm 0.78779,1.14459,1.01554,90,90,90 - pink 2.48 X 45253
C-N-Nd Nd2[NCN]3 Sm2[NCN]3,mS22,12 C12/m1 1.4754,0.39563,0.53084,90,96.027,90 - - 4.40 A 46500
C-N-Ni Ni[CC3N3 ][NC2N2] Co[CC3N3 ][NC2N2],oS52,40 Ama2 0.7309,1.6999,0.5562,90,90,90 - blue 2.06 A 37005
C-N-Ni Ni[CN]2 tet1 Ni[CN]2,tP20,131 P42 /mmc 0.48632,0.48632,1.2636,90,90,90 - - 2.46 X 47822
C-N-Ni Ni[NCN] Co[NCN],hP8,194 P63 /mmc 0.31533,0.31533,0.9272,90,90,120 - brown 4.11 X 48403
C-N-Ni Ni[NC2N2 ]2 Ni[NC2N2 ]2,oP22,58 Pnnm 0.59736,0.7032,0.72942,90,90,90 - blue light 2.07 X 34233
C-N-Ni Ni0.5 [CN] tet2 Ni0.5 [CN],tI18,139 I4/mmm 0.3434,0.3434,0.6401,90,90,90 - - 2.44 X 53229
C-N-O C[N3]2O C[N3]2O,oP32,62 Pnma 0.5431,0.5797,1.38,90,90,90 - colorless 1.71 X 54406
C-N-O C6N6O3 C6N6O3,hP30,176 P63 /m 0.91599,0.91599,0.5445,90,90,120 - yellow pale 1.71 X 32814
C-N-O C8N8O16 C8N8O16,mS128,15 C12/c1 1.27852,0.88395,1.39239,90,98.031,90 - white 1.98 X 36810
C-N-O [OCN][CN] lt [OCN][CN],oP40,61 Pbca 0.603,0.763,0.65,90,90,90 - - 1.51 X 53416
C-N-P P[CN]3 P[CN]3,tI112,122 I-42d 1.4,1.4,1.081,90,90,90 - colorless 1.37 X 2068
C-N-Pb Pb[CC3N3 ]2 Pb[CC3N3 ]2,hP45,157 P31m 1.4144,1.4144,0.40902,90,90,120 - colorless 2.72 X 47779
C-N-Pb Pb[NCN] Pb[NCN],oP16,62 Pnma 0.55566,0.38677,1.1735,90,90,90 - yellow 6.51 X 38120
C-N-Pb Pb[NC2N2 ]2 Ba[NC2N2 ]2,oP44,62 Pnma 1.35045,0.39989,1.19939,90,90,90 - colorless 3.48 X 40805
C-N-Pr Pr[NC2N2 ]3 Nd[NC2N2 ]3,oS64,63 Cmcm 0.79045,1.14619,1.01674,90,90,90 - green light 2.44 X 45253
C-N-Pr Pr2[NCN]3 Sm2[NCN]3,mS22,12 C12/m1 1.4853,0.39907,0.53243,90,96.125,90 - - 4.25 A 46500
C-N-Rb Rb[CN] mon KBr0.2 [CN]0.8 ,mS8,9 C1c1 0.78,0.4876,0.85028,90,108.63,90 - - 2.42 X 17384
C-N-Rb Rb[CN] rt K[CN],cF28,225 Fm-3m 0.68393,0.68393,0.68393,90,90,90 - - 2.31 A 41104
C-N-S CSN2 CSN2,mP16,14 P121/c1 0.3827,1.0485,0.6422,90,106.59,90 - - 1.94 X 14111
C-N-S CS2N2 CS2N2,mP40,14 P121/c1 0.6717,1.1701,0.90328,90,118.732,90 - blue royal 2.22 X 44671
C-N-S CS3N4 *,mP32,14 P121/c1 0.54507,0.8751,1.21772,90,106.622,90 - - 1.96 N 20134
C-N-S C2S[CN]2 C2S[CN]2,mP56,14 P121/c1 0.68962,1.83391,0.97823,90,134.481,90 - - 1.63 X 58105
C-N-S C4S[CN]4 C4S[CN]4,mP26,7 P1c1 0.707,0.656,1.0123,90,115.294,90 - - 1.44 X 3851
C-N-S S[CN]2 S[CN]2,oP40,61 Pbca 0.687,1.284,0.856,90,90,90 - white 1.48 X 2946
C-N-S S2[CN] *,mP32,14 P121/c1 0.8857,0.7942,1.0326,90,109.,90 - colorless - N 29498
C-N-S S3[CN] mon S3[CN],mS80,15 C12/c1 2.0024,0.58402,1.6568,90,115.15,90 - - 1.85 X 31614
C-N-S S3[CN] orth *,oP40,59 Pmmn 0.832,1.811,0.579,90,90,90 - - - N 1811
C-N-S S3[CN]2 S3[CN]2,oP28,62 Pnma 1.006,1.2715,0.424,90,90,90 - yellow 1.82 X 10395
C-N-S S9[CN]2 S9[CN]2,mP26,4 P1211 0.8359,0.5906,1.222,90,102.3,90 - - 1.92 X 27101
C-N-Se Se[CN] Se[CN],oP24,19 P212121 0.50448,0.64597,1.5589,90,90,90 - - 2.75 X 46481
C-N-Se Se[CN]2 S[CN]2,oP40,61 Pbca 0.6847,1.28151,0.8632,90,90,90 - colorless 2.30 X 50456
C-N-Se Se3[CN]2 S3[CN]2,oP28,62 Pnma 1.0054,1.3332,0.4454,90,90,90 - orange 3.21 X 46481
C-N-Si SiCNx 3C ZnS,cF8,216 F-43m 0.43592,0.43592,0.43592,90,90,90 adamantane structure black 3.22 X 2734
C-N-Si SiCNx 6H SiC,hP12,186 P63 mc 0.30825,0.30825,1.51005,90,90,120 adamantane structure colorless 3.22 A 2734
C-N-Si Si[NCN]2 ht Si[NCN]2,cP14,224 Pn-3m 0.61885,0.61885,0.61885,90,90,90 - - 1.52 X 32753
C-N-Si Si2CN4 Si2CN4,oS28,41 Aea2 0.544,1.358,0.481,90,90,90 - - 2.32 X 32753
C-N-Sm SmC0.19 N0.75 NaCl,cF8,225 Fm-3m 0.5052,0.5052,0.5052,90,90,90 rocksalt family - 8.41 X 13539
C-N-Sm Sm[NC2N2]3 Nd[NC2N2 ]3,oS64,63 Cmcm 0.7813,1.13864,1.01204,90,90,90 - yellow 2.57 X 45253
C-N-Sm Sm2[NCN]3 Sm2[NCN]3,mS22,12 C12/m1 1.4534,0.3888,0.52691,90,95.96,90 - - 4.72 X 46500
C-N-Sr Sr[NCN] hex Sr[NCN],hP28,194 P63 /mmc 1.0379,1.0379,0.6633,90,90,120 - colorless 2.74 X 2959
C-N-Sr Sr[NCN] orth Sr[NCN],oP16,62 Pnma 1.241,0.3963,0.5389,90,90,90 - colorless 3.20 X 28779
C-N-Sr Sr[NCN] rhom Ca[NCN],hR12,166 R-3m 0.39732,0.39732,1.5028,90,90,120 - colorless 3.10 X 42618
C-N-Sr Sr[NC2N2 ]2 rt Ca[NC2N2 ]2,mS44,15 C12/c1 1.27963,0.62476,0.81756,90,99.787,90 - white 2.27 X 39107
C-N-Sr Sr2[NCN][CN]2 Ba2[NCN][CN]2,hP50,194 P63 /mmc 1.03591,1.03591,0.66423,90,90,120 - - 2.88 X 31074
C-N-Sr Sr4[NCN]N2 (Sr0.27 Ca0.73)3Ca[NCN]N2,oP36,62 Pnma 1.22928,0.38261,1.43291,90,90,90 - colorless 4.12 X 44269
C-N-Ta TaC0.5 N0.5 NaCl,cF8,225 Fm-3m 0.443,0.443,0.443,90,90,90 rocksalt family - 14.82 X 9208
C-N-Tb Tb2[NCN]3 Sm2[NCN]3,mS22,12 C12/m1 1.4369,0.38201,0.5243,90,95.7,90 - - 5.08 A 46500
C-N-Th ThCN ht ThCN,hP6,164 P-3m1 0.4062,0.4062,0.7324,90,90,120 - - 8.19 X 13409
C-N-Th ThCN rt ThCN,mS12,12 C12/m1 0.70249,0.39461,0.72763,90,95.67,90 - - 8.54 X 6398
C-N-Th ThC0.5 N0.5 NaCl,cF8,225 Fm-3m 0.525,0.525,0.525,90,90,90 rocksalt family - 11.25 X 1917
C-N-Ti TiC0.48 N0.51 NaCl,cF8,225 Fm-3m 0.4284,0.4284,0.4284,90,90,90 rocksalt family - 5.14 X 18425
C-N-Ti TiC0.51 N0.12 Sc0.685 S,hR12,166 R-3m 0.306,0.306,1.491,90,90,120 - - 4.59 X 31663
C-N-Ti Ti2C0.05 N0.95 rt TiO2,tP6,136 P42 /mnm 0.4947,0.4947,0.3036,90,90,90 - - 4.90 A 11527
C-N-Tl Tl[CN] K[CN],cP9,221 Pm-3m 0.4005,0.4005,0.4005,90,90,90 - - 5.96 A 41104
C-N-Tl Tl[CN]2 Zn[CN]2,cP10,224 Pn-3m 0.666,0.666,0.666,90,90,90 - colorless 2.88 A 39149
C-N-Tl Tl2[CN]4 KB[CN]4,tI40,88 I41/a 0.75753,0.75753,1.5142,90,90,90 - colorless 3.92 A 44667
C-N-Tl Tl2[NCN] Tl2[NCN],aP15,2 P-1 0.5338,0.6626,0.9645,98.765,98.685,113.178 - orange red 7.42 X 49563
C-N-Tm Tm2[NCN]3 mon Sm2[NCN]3,mS22,12 C12/m1 1.4084,0.3721,0.51812,90,95.49,90 - brownish 5.63 A 50382
C-N-Tm Tm2[NCN]3 rhom Lu2[NCN]3,hR33,155 R32 0.63393,0.63393,1.4766,90,90,120 - - 4.44 A 46500
C-N-U UC0.5 N0.5 NaCl,cF8,225 Fm-3m 0.493,0.493,0.493,90,90,90 rocksalt family gray dark 13.92 X 5370
C-N-U UC1.70 N0.06 CaC2,tI6,139 I4/mmm 0.35009,0.35009,0.59566,90,90,90 - - 11.80 A 5898
C-N-V VC0.25 N0.25 ht NiAs,hP4,194 P63 /mmc 0.2867,0.2867,0.4535,90,90,120 AlB2 family - 5.91 X 2241
C-N-V VC0.8 N0.2 rt NaCl,cF8,225 Fm-3m 0.41625,0.41625,0.41625,90,90,90 rocksalt family - 5.83 X 52669
C-N-Y Y2[NCN]3 Sm2[NCN]3,mS22,12 C12/m1 1.4278,0.3781,0.5209,90,95.73,90 - - 3.54 A 46500
C-N-Yb Yb2[NCN]3 Yb2[NCN]3,hR66,167 R-3c 0.63002,0.63002,2.9474,90,90,120 - orange red 4.58 X 49762
C-N-Zn Zn[CC3N3 ]2 *,oP30,53 Pmna 0.7466,0.53171,1.0482,90,90,90 - - - N 24811
C-N-Zn Zn[CN]2 Zn[CN]2,cP10,215 P-43m 0.59002,0.59002,0.59002,90,90,90 - colorless 1.90 X 23435
C-N-Zn Zn[NCN] Zn[NCN],tI32,122 I-42d 0.88047,0.88047,0.54329,90,90,90 - colorless 3.32 X 38396
C-N-Zn Zn[NC2N2 ]2 rt Zn[NC2N2 ]2,oP44,62 Pnma 0.76209,0.75985,1.20477,90,90,90 - colorless 1.88 X 34370
Handbook of Inorganic Substances – Edition 2015 : Data 367

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-N-Zr ZrC0.5 N0.5 NaCl,cF8,225 Fm-3m 0.4635,0.4635,0.4635,90,90,90 rocksalt family - 6.95 X 9211
C-Na-O Na2[CO3] ht1 Na2[CO3]-b,mS24,12 C12/m1 0.90186,0.52063,0.64417,90,91.603,90 - - 2.33 X 30348
C-Na-O Na2[CO3] ht2 Na2[CO3],hP12,194 P63/mmc 0.52087,0.52087,0.6503,90,90,120 - - 2.30 X 30348
C-Na-O Na2[CO3] lt Na2[CO3],mP144,14 P121/c1 1.799,0.5237,1.93039,90,115.578,90 - white 2.57 X 41275
C-Na-O Na2[CO3] rt Na2[CO3]-a,mS24,12 C12/m1 0.892,0.5245,0.605,90,101.35,90 natrite colorless 2.54 X 41275
C-Na-O Na2[C2O4] Na2[C2O4],mP16,14 P121/c1 0.3333,0.5222,1.012,90,90.7,90 natroxalate - 2.53 X 47688
C-Na-O Na2[C2O6] *,hR30,167 R-3c 1.125,1.125,0.8325,90,90,120 - - - N 4227
C-Na-O Na2[C4O4] Na2[C4O4],mP20,14 P121/c1 0.34925,0.68152,1.03525,90,91.56,90 - - 2.13 X 45783
C-Na-O Na2[C6O6] Na2[C6O6],oF112,70 Fddd 0.79248,1.14835,1.43208,90,90,90 - - 2.18 X 44321
C-Na-Pd Na2PdC2 Na2PdC2,hP5,164 P-3m1 0.4464,0.4464,0.5267,90,90,120 - black 3.22 X 33738
C-Na-Pt Na2PtC2 Na2PdC2,hP5,164 P-3m1 0.4503,0.4503,0.5205,90,90,120 - black 4.82 X 33738
C-Na-Rb RbNa2[C60] hp RbNa2[C60],oP144,58 Pnnm 0.9898,1.4268,0.9347,90,90,90 fullerene family - 2.14 X 30932
C-Na-Rb RbNa2[C60] lt RbNa2[C60],mP8,14 P121/c1 0.9366,1.4466,1.35786,90,133.069,90 fullerene family - 2.11 X 35990
C-Na-Rb RbNa2[C60] rt cub1 K3[C60],cF492,225 Fm-3m 1.408,1.408,1.408,90,90,90 fullerene family - 2.03 A 30932
C-Na-Rb RbNa2[C60] rt cub2 RbNa2[C60],cP16,205 Pa-3 1.40163,1.40163,1.40163,90,90,90 fullerene family - 2.06 X 35990
C-Na-S Na2CS3 Na2CS3,mS24,15 C12/c1 1.0036,0.6337,0.8555,90,108.05,90 - orange 1.98 X 28115
C-Nb-Ni Nb4 Ni2C W4Co2C,cF112,227 Fd-3m 1.1659,1.1659,1.1659,90,90,90 η-carbide - 8.40 A 14089
C-Nb-O NbC0.8 O0.2 NaCl,cF8,225 Fm-3m 0.4435,0.4435,0.4435,90,90,90 rocksalt family - 8.05 X 20097
C-Nb-P Nb2 PC Cr2AlC,hP8,194 P63/mmc 0.3286,0.3286,1.156,90,90,120 - - 7.03 X 4177
C-Nb-Ru NbRu3C0.4 CaTiO3,cP5,221 Pm-3m 0.39,0.39,0.39,90,90,90 perovskite family - 11.22 X 16396
C-Nb-S Nb2 CS Cr2AlC,hP8,194 P63/mmc 0.331,0.331,1.154,90,90,120 - - 6.97 X 4177
C-Nb-S Nb2 CS2 rhom Ta2CS2,hR15,166 R-3m 0.3274,0.3274,2.5465,90,90,120 - - 5.52 X 40205
C-Nb-S Nb2 CS2 trig Ta2CS2,hP5,164 P-3m1 0.3268,0.3268,0.8547,90,90,120 - - 5.50 X 40205
C-Nb-Si Nb5 Si4C *,hP20,193 P63/mcm 0.7536,0.7536,0.5249,90,90,120 - - - N 23679
C-Nb-Sn Nb2 SnC Cr2AlC,hP8,194 P63/mmc 0.3245,0.3245,1.377,90,90,120 - - 8.37 A 2312
C-Nb-Ta Ta0.2 Nb0.8 C NaCl,cF8,225 Fm-3m 0.4459,0.4459,0.4459,90,90,90 rocksalt family golden 9.18 X 51800
C-Nb-Ti Ti0.18 Nb0.82 C0.5 ht2 NiAs,hP4,194 P63/mmc 0.312,0.312,0.4958,90,90,120 AlB2 family - 7.22 X 2307
C-Nb-Ti Ti0.8 Nb0.2 C0.96 NaCl,cF8,225 Fm-3m 0.43411,0.43411,0.43411,90,90,90 rocksalt family - 5.56 X 20104
C-Nb-U U0.5 Nb0.5 C NaCl,cF8,225 Fm-3m 0.4695,0.4695,0.4695,90,90,90 rocksalt family - 11.39 X 1961
C-Nb-V Nb0.5 V0.5 C NaCl,cF8,225 Fm-3m 0.432,0.432,0.432,90,90,90 rocksalt family gray silver 6.92 X 1273
C-Nb-W Nb0.05 W0.95 Cx W,cI2,229 Im-3m 0.3173,0.3173,0.3173,90,90,90 b.c.c. family - 18.64 X 7861
C-Nb-W Nb0.8 W0.2C NaCl,cF8,225 Fm-3m 0.4425,0.4425,0.4425,90,90,90 rocksalt family - 9.44 X 272
C-Nb-Y Y1.8 Nb0.2 C2.7 Pu2C3,cI40,220 I-43d 0.82389,0.82389,0.82389,90,90,90 - - 5.01 A 4710
C-Nb-Zn Zn4Nb8C3 Zn4Nb8C3,cF120,227 Fd-3m 1.1746,1.1746,1.1746,90,90,90 η-carbide - 8.53 X 2295
C-Nb-Zr Zr0.12 Nb0.88 C0.5 ht2 NiAs,hP4,194 P63/mmc 0.314,0.314,0.4986,90,90,120 AlB2 family - 7.70 X 2307
C-Nb-Zr Zr0.5 Nb0.5C0.89 NaCl,cF8,225 Fm-3m 0.4571,0.4571,0.4571,90,90,90 rocksalt family gray silver 7.15 X 8222
C-Nd-Ni NdNiC2 CeNiC2,oS8,38 Amm2 0.3769,0.4543,0.6137,90,90,90 - - 7.17 X 23652
C-Nd-Ni Nd2 Ni22C3 Ce2Ni22C2.75,oS216,64 Cmce 1.1386,1.5066,1.4665,90,90,90 - - 8.53 A 26142
C-Nd-O Nd2 [CO3]O2 Nd2[CO3]O2,hP24,194 P63/mmc 0.3974,0.3974,1.5703,90,90,120 - - 5.88 X 5050
C-Nd-Os Nd12 Os5C15 La12 Re5C15,hP32,189 P-62m 1.0893,1.0893,0.5274,90,90,120 - - 8.77 A 34625
C-Nd-Os Nd3.67 OsC6 La3.67 FeC6,hP24,176 P63/m 0.8716,0.8716,0.5191,90,90,120 - gray 7.70 A 39525
C-Nd-Os Nd5 Os3C3.17 La5Os3C4,hP24,193 P63/mcm 0.8978,0.8978,0.66742,90,90,120 - gray dark 9.48 X 33462
C-Nd-P Nd4 P 2.04 C1.92 La4P 1.92 C2.16,cI52,199 I213 0.86763,0.86763,0.86763,90,90,90 - - 6.74 X 55443
C-Nd-Pb Nd3 PbC0.65 CaTiO3,cP5,221 Pm-3m 0.505,0.505,0.505,90,90,90 perovskite family - 8.35 X 3665
C-Nd-Re Nd12 Re5C15 La12 Re5C15,hP32,189 P-62m 1.0916,1.0916,0.5301,90,90,120 - gray dark 8.63 A 29688
C-Nd-Re Nd2 ReC2 Pr2ReC2,oP20,62 Pnma 0.6651,0.5305,1.0146,90,90,90 - - 9.25 A 23790
C-Nd-Rh NdRhC2 CeNiC2,oS8,38 Amm2 0.3648,0.4698,0.6597,90,90,90 - - 7.97 X 21804
C-Nd-Rh NdRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.4171,0.4171,0.4171,90,90,90 perovskite family - 10.56 X 6791
C-Nd-Ru Nd3.67 RuC6 La3.67 FeC6,hP24,176 P63/m 0.8699,0.8699,0.5218,90,90,120 - gray 6.82 A 32658
C-Nd-Si Nd3 Si2C2 Pr3Si2C2,oS20,65 Cmmm 0.3949,1.6303,0.4375,90,90,90 - gray 6.05 A 34802
C-Nd-Si Nd5 Si3C0.5 *,o**,* - 0.771,0.7958,1.503,90,90,90 - - - N 17145
C-Nd-Sn Nd3 SnC CaTiO3,cP5,221 Pm-3m 0.5028,0.5028,0.5028,90,90,90 perovskite family - 7.36 X 3190
C-Nd-Th Th1.8 Nd0.2 C3 ht-hp Pu2C3,cI40,220 I-43d 0.85555,0.85555,0.85555,90,90,90 - - 10.24 A 7468
C-Nd-Tl TlNd3C CaTiO3,cP5,221 Pm-3m 0.5032,0.5032,0.5032,90,90,90 perovskite family - 8.46 X 33965
C-Nd-W Nd2 WC2 Pr2MoC2,tP20,136 P42/mnm 0.57892,0.57892,1.02776,90,90,90 - gray silver 9.57 X 49520
C-Ni-O Ni[CO]4 Ni[CO]4,cP72,205 Pa-3 1.0832,1.0832,1.0832,90,90,90 - - 1.78 X 27894
C-Ni-O Ni[CO3] Ca[CO3],hR30,167 R-3c 0.46117,0.46117,1.4735,90,90,120 gaspéite - 4.36 X 18817
C-Ni-Pr PrNiC2 CeNiC2,oS8,38 Amm2 0.3813,0.4539,0.6137,90,90,90 - - 6.99 X 26056
C-Ni-Pr Pr2Ni22C3 Ce2Ni22C2.75,oS216,64 Cmce 1.1396,1.5059,1.4684,90,90,90 - - 8.48 A 26142
C-Ni-Pu PuNiC2 CeNiC2,oS8,38 Amm2 0.36931,0.45204,0.60969,90,90,90 - gray 10.66 A 19389
C-Ni-Sc ScNiC2 ScCoC2,tP8,129 P4/nmm 0.3325,0.3325,0.7368,90,90,90 - - 5.21 A 18527
C-Ni-Sc Sc3NiC4 Sc3CoC4,oI16,71 Immm 0.34114,0.43911,1.1923,90,90,90 - black 4.49 X 53619
C-Ni-Sm SmNiC2 CeNiC2,oS8,38 Amm2 0.36965,0.45293,0.60955,90,90,90 - - 7.59 X 55268
C-Ni-Sm Sm2 Ni22C3 Ce2Ni22C2.75,oS216,64 Cmce 1.1364,1.5013,1.4605,90,90,90 - - 8.68 A 26142
C-Ni-Ta Ta4Ni2C W4Co2C,cF112,227 Fd-3m 1.159,1.159,1.159,90,90,90 η-carbide - 14.56 A 14089
C-Ni-Tb TbNiC2 CeNiC2,oS8,38 Amm2 0.3569,0.4518,0.6066,90,90,90 - - 8.21 X 26056
C-Ni-Tb Tb2Ni22C3 Ce2Ni22C2.75,oS216,64 Cmce 1.1344,1.4973,1.4574,90,90,90 - - 8.83 A 26142
C-Ni-Tb Tb4Ni13C4 Er4Ni13C4,oS42,65 Cmmm 1.1744,1.2014,0.39,90,90,90 - - 8.73 A 25377
C-Ni-Th Th2NiC2 Na2HgO2,tI10,139 I4/mmm 0.3758,0.3758,1.2356,90,90,90 - gray 10.41 X 25559
C-Ni-Th Th3Ni5C5 Th3Ni5C5,oS52,63 Cmcm 1.3925,0.7142,0.7042,90,90,90 - gray 9.96 X 25559
C-Ni-Th Th4Ni3C6 Th4Ni3C6,mS26,12 C12/m1 1.5368,0.3746,0.7624,90,113.23,90 - gray 9.69 X 25688
C-Ni-Ti Ti0.56 Ni0.44 C0.58 NaCl,cF8,225 Fm-3m 0.432,0.432,0.432,90,90,90 rocksalt family - 4.91 X 54763
C-Ni-Tm TmNiC2 CeNiC2,oS8,38 Amm2 0.3484,0.4484,0.6,90,90,90 - - 8.92 X 23652
C-Ni-Tm Tm11 Ni60C6 Yb11 Ni60C6,cI154,229 Im-3m 1.2453,1.2453,1.2453,90,90,90 - - 9.38 X 24099
C-Ni-Tm Tm4 Ni13C4 Er4Ni13C4,oS42,65 Cmmm 1.1677,1.1958,0.3841,90,90,90 - - 9.21 A 24669
C-Ni-Tm Tm4 Ni2C5 Yb4Ni2C5,oP11,25 Pmm2 0.3549,1.146,0.3666,90,90,90 - gray silver 9.50 A 28173
C-Ni-U UNiC2 ScCoC2,tP8,129 P4/nmm 0.35083,0.35083,0.7348,90,90,90 - gray 11.78 A 19389
C-Ni-U U2NiC3 U2NiC3,oP24,62 Pnma 0.64145,0.35457,1.32315,90,90,90 - gray 12.60 X 19739
368 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Ni-V V4Ni2C W4Co2C,cF112,227 Fd-3m 1.087,1.087,1.087,90,90,90 η-carbide - 6.89 A 14089


C-Ni-W W10Ni3C3.4 W10Co3C3.4 ,hP34,194 P63 /mmc 0.7837,0.7837,0.7837,90,90,120 - - 16.38 A 9445
C-Ni-W W4Ni2C W4Co2C,cF112,227 Fd-3m 1.1226,1.1226,1.1226,90,90,90 η-carbide - 16.24 A 9445
C-Ni-W W6Ni6C W6Fe6C,cF104,227 Fd-3m 1.09,1.09,1.09,90,90,90 η-carbide - 15.05 A 9445
C-Ni-Y YNiC2 CeNiC2,oS8,38 Amm2 0.3562,0.4509,0.6039,90,90,90 - - 5.88 A 22383
C-Ni-Y Y11Ni60C6 Yb11Ni60C6,cI154,229 Im-3m 1.2511,1.2511,1.2511,90,90,90 - - 7.75 A 26067
C-Ni-Y Y4Ni13C4 Er4Ni13C4 ,oS42,65 Cmmm 1.1707,1.2088,0.3893,90,90,90 - - 7.03 A 24711
C-Ni-Yb YbNiC2 CeNiC2,oS8,38 Amm2 0.3472,0.4494,0.5993,90,90,90 - - 9.08 A 19068
C-Ni-Yb Yb11Ni60C6 Yb11Ni60C6,cI154,229 Im-3m 1.2441,1.2441,1.2441,90,90,90 - black 9.48 X 26067
C-Ni-Yb Yb4Ni13C4 Er4Ni13C4 ,oS42,65 Cmmm 1.1654,1.194,0.3829,90,90,90 - - 9.37 A 24669
C-Ni-Yb Yb4Ni2C5 Yb4Ni2C5,oP11,25 Pmm2 0.35288,1.143,0.36616,90,90,90 - gray silver 9.78 X 28173
C-Ni-Zn ZnNi3C CaTiO3,cP5,221 Pm-3m 0.366,0.366,0.366,90,90,90 perovskite family - 8.59 X 47276
C-Np-O [NpO2][CO3] rt [UO2][CO3 ],oP14,59 Pmmn 0.482,0.917,0.424,90,90,90 - green tan 5.83 A 19138
C-O-Os Os[CO]4 mon Os[CO]4,mP108,14 P121/c1 0.80817,1.47683,1.53177,90,110.683,90 - yellow 3.52 X 10654
C-O-Os Os[CO]4 tricl *,aP*,2 P-1 0.9436,0.9482,1.4082,87.67,79.09,69.69 - orange - N 20115
C-O-Os Os11O3[CO]30 *,mP296,14 P121/c1 1.1736,2.1775,2.09278,90,114.002,90 - - 4.05 N 27518
C-O-Os Os2[CO]7 *,mS128,15 C12/c1 1.3275,1.3033,1.1593,90,90.435,90 - - 3.82 N 21668
C-O-Os Os4[CO]15 Os4[CO]15 ,mS272,15 C12/c1 1.2802,1.0217,1.638,90,91.39,90 - red dark 3.66 X 29939
C-O-Os Os5C[CO]15 *,mP288,14 P121/c1 1.6404,1.417,2.0789,90,91.71,90 - orange 3.80 N 13291
C-O-Os Os5C[CO]16 Os5C[CO]16,aP152,2 P-1 1.0017,1.5823,1.6507,96.78,103.2,93.41 - orange 3.72 X 16129
C-O-Os Os5[CO]16 Os5[CO]16 ,hP111,152 P3121 0.9204,0.9204,2.4818,90,90,120 - black 3.83 X 10379
C-O-Os Os5[CO]18 *,aP82,2 P-1 0.8847,1.0287,1.5519,73.62,83.85,70.89 - - 3.78 N 27609
C-O-Os Os5[CO]19 Os5[CO]19 ,aP86,2 P-1 0.888,1.0244,1.6529,99.98,93.44,110.37 - orange 3.58 X 15222
C-O-Os Os6O[CO]19 *,oP180,62 Pnma 1.6496,1.6906,1.0429,90,90,90 - - 3.86 N 16119
C-O-Pb Pb[CO3] hp Pb[CO3],mP20,14 P121/c1 0.5101,0.8303,0.5602,90,90.49,90 - - 7.48 X 55533
C-O-Pb Pb[CO3] Ca[CO3]-a,oP20,62 Pnma 0.61436,0.5182,0.84953,90,90,90 cerussite colorless 6.56 X 57748
C-O-Pb Pb[C2O4] Pb[C2O4],aP14,2 P-1 0.5557,0.55726,0.69772,70.446,88.802,66.39 - - 5.30 X 22041
C-O-Pb Pb2[CO3]O Pb2[CO3]O,oP28,19 P212121 0.51465,0.9014,0.9315,90,90,90 shannonite colorless 7.54 X 37829
C-O-Pb Pb3[CO3]O2 Pb3[CO3]O2,oP72,62 Pnma 2.2194,0.9108,0.57405,90,90,90 - colorless 8.17 X 37831
C-O-Pb Pb3[CO3]2 O *,aP12,1 P1 0.33246,0.34249,0.67868,84.493,80.254,80.55 - white - N 2543
C-O-Pu PuC0.84 O0.16 NaCl,cF8,225 Fm-3m 0.4975,0.4975,0.4975,90,90,90 rocksalt family - 13.84 X 27608
C-O-Rb Rb2[CO3] ht1 Rb2[CO3],oP24,62 Pnma 0.7684,0.58912,1.01437,90,90,90 - - 3.34 X 44416
C-O-Rb Rb2[CO3] ht2 Rb2[CO3],hP78,194 P63 /mmc 0.5896,0.5896,0.78026,90,90,120 - - 3.27 X 44416
C-O-Rb Rb2[CO3] rt K2[CO3],mP24,14 P121/c1 0.58745,1.0129,0.73073,90,97.292,90 - - 3.56 X 44416
C-O-Rb Rb2[C2O4 ] ht1 Rb2[C2O4],oP56,62 Pnma 0.81647,0.65809,1.09325,90,90,90 - - 2.93 X 44416
C-O-Rb Rb2[C2O4 ] ht2 K2[C2O4],hP148,194 P63 /mmc 0.64725,0.64725,0.82612,90,90,120 - - 2.87 X 44416
C-O-Rb Rb2[C2O4 ] mon Cs2[C2O4],mP32,14 P121/c1 0.63276,1.04548,0.82174,90,98.016,90 - - 3.20 X 41509
C-O-Rb Rb2[C2O4 ] orth K2[C2O4],oP16,55 Pbam 0.62948,1.1288,0.36221,90,90,90 - - 3.34 X 41509
C-O-Rb Rb2[C2O6 ] rt Rb2[C2O6],mP40,14 P121/c1 0.79129,1.05117,0.75559,90,102.001,90 - colorless 3.14 X 41336
C-O-Rb Rb2[C4O4 ] Rb2[C4O4],mS20,12 C12/m1 1.07908,0.68494,0.44521,90,92.39,90 - - 2.86 X 45783
C-O-Rb Rb2[OC2O] K2[OC2O],tI12,139 I4/mmm 0.4133,0.4133,1.3049,90,90,90 - yellow 3.38 X 2406
C-O-Re Re[CO]5 Mn[CO]5,mS88,15 C12/c1 1.77789,0.71188,1.46576,90,126.695,90 - - 2.91 X 14152
C-O-Rh Rh[CO]3 Rh[CO]3,mP112,14 P121/c1 0.9209,1.179,1.7721,90,89.54,90 - black 2.58 X 37465
C-O-Rh Rh12C2[CO]25 Rh12C2[CO]25,oP256,19 P212121 1.1605,1.8604,1.8695,90,90,90 - black 3.22 X 11588
C-O-Rh Rh3[CO]8 Ir3[CO]8,mS152,15 C12/c1 1.68916,0.978,1.7,90,117.707,90 - black 2.85 A 1905
C-O-Rh Rh8C[CO]19 Rh8C[CO]19,aP94,2 P-1 0.918,1.046,1.776,104.05,92.37,110.93 - - 2.97 X 9078
C-O-Ru Ru[CO]4 mon Os[CO]4,mP108,14 P121/c1 0.80796,1.4794,1.528,90,110.703,90 - yellow 2.49 X 43000
C-O-Ru Ru[CO]4 orth Ru[CO]4,oI36,72 Ibam 0.706,1.4147,0.572,90,90,90 - orange 2.48 X 27531
C-O-Ru Ru4C[CO]13 *,aP62,2 P-1 0.9282,0.94,1.3965,77.94,74.5,64.26 - - 2.46 N 19221
C-O-Ru Ru5C[CO]15 Ru5C[CO]15,mP288,14 P121/c1 1.6448,1.4274,2.0834,90,91.36,90 - red 2.55 X 16130
C-O-Ru Ru6C[CO]17 mon1 Ru6C[CO]17,mP164,14 P121/c1 0.919,3.2043,1.05211,90,122.193,90 - brown red 2.77 X 26204
C-O-Ru Ru6C[CO]17 mon2 Ru6C[CO]17,mP246,13 P12/c1 2.4057,0.9335,1.7668,90,97.96,90 - - 2.78 X 26204
C-O-S CSO CSO,hR9,160 R3m 0.61703,0.61703,0.58612,90,90,120 - - 1.55 X 14850
C-O-S C3S3O2 C3S3O2,mP32,14 P121/c1 0.6313,0.5688,1.6758,90,107.1,90 - - 1.90 X 4358
C-O-S C3S7O C3S7O,aP22,2 P-1 0.4204,0.8942,1.2017,103.02,96.64,90.47 - yellow 2.10 X 28686
C-O-S C4SO2 C4SO2,oP56,29 Pca21 1.4136,0.59985,0.9688,90,90,90 - - 1.81 X 47767
C-O-S C4S5O C4S5O,mP20,7 P1c1 0.39638,1.10211,0.88323,90,104.761,90 - orange 2.00 X 57691
C-O-S C6S8O2 C6S8O2,mP64,14 P121/c1 1.5461,0.9648,0.7852,90,98.71,90 - yellow 2.07 X 28686
C-O-Sc ScC0.5 O0.5 NaCl,cF8,225 Fm-3m 0.45754,0.45754,0.45754,90,90,90 rocksalt family gray 4.09 X 19123
C-O-Se SeC4O2 SeC4O2,oP28,58 Pnnm 0.41546,0.89429,1.16014,90,90,90 - orange 2.45 X 47767
C-O-Sn Sn[C2O4] Sn[C2O4],mS28,15 C12/c1 1.0375,0.5504,0.8234,90,125.11,90 - - 3.57 X 12543
C-O-Sr Sr[CO3] ht Na[NO3],hR48,166 R-3m 0.5092,0.5092,0.953,90,90,120 - - 3.44 X 8698
C-O-Sr Sr[CO3] rt Ca[CO3]-a,oP20,62 Pnma 0.59901,0.50914,0.83519,90,90,90 strontianite colorless 3.85 X 57748
C-O-Sr Sr[O2C4O2] Sr[O2C4O2],tI36,141 I41/amd 0.721,0.721,1.0338,90,90,90 - colorless 2.47 X 39899
C-O-Ta TaC0.44 O0.12 NiAs,hP4,194 P63 /mmc 0.31026,0.31026,0.49366,90,90,120 AlB2 family - 15.18 X 4226
C-O-Tc Tc[CO]5 Mn[CO]5,mS88,15 C12/c1 1.76269,0.69759,1.46162,90,127.196,90 - yellow pale 2.21 X 57243
C-O-Ti TiC0.545 O0.08 ht1 Zr0.65 S,cF64,227 Fd-3m 0.86371,0.86371,0.86371,90,90,90 rocksalt family - 4.60 X 41413
C-O-Ti TiC0.545 O0.08 rt (Ti0.98 Mo0.02 )C0.6,hP12,152 P3121 0.30604,0.30604,1.48628,90,90,120 - - 4.61 X 41413
C-O-Ti TiC0.97 O0.03 NaCl,cF8,225 Fm-3m 0.43265,0.43265,0.43265,90,90,90 rocksalt family - 4.92 X 11542
C-O-Tl Tl2[CO3] rt Tl2[CO3],mS24,12 C12/m1 1.2006,0.52173,0.7292,90,123.01,90 - colorless 8.13 X 49827
C-O-Tl Tl2[C2O4] Tl2[C2O4],mP16,14 P121/c1 0.66141,0.58404,0.6662,90,99.22,90 - - 6.49 X 44667
C-O-Tl Tl2[O2C4O2] Tl2[O2C4O2],oP40,19 P212121 0.62146,0.72413,1.467,90,90,90 - colorless 5.24 X 48727
C-O-U UC0.75 O0.25 NaCl,cF8,225 Fm-3m 0.4953,0.4953,0.4953,90,90,90 rocksalt family - 13.72 X 2216
C-O-U [UO2][CO3 ] [UO2][CO3 ],oI14,44 Imm2 0.484,0.9273,0.4298,90,90,90 rutherfordine yellow pale 5.68 X 35591
C-O-V VC0.43 O0.44 NaCl,cF8,225 Fm-3m 0.41255,0.41255,0.41255,90,90,90 rocksalt family - 5.97 X 13256
C-O-V V[CO]6 Cr[CO]6,oP52,62 Pnma 1.1905,1.1221,0.6397,90,90,90 - - 1.70 X 12167
C-O-W WCO Cu,cF4,225 Fm-3m 0.424,0.424,0.424,90,90,90 close-packed structure grayish 18.46 F 4044
C-O-W W[CO]6 Cr[CO]6,oP52,62 Pnma 1.1944,1.137,0.6459,90,90,90 - - 2.66 X 26877
Handbook of Inorganic Substances – Edition 2015 : Data 369

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-O-Y Y2[CO3]O2 Nd2[CO3]O2,hP24,194 P63/mmc 0.3848,0.3848,1.5078,90,90,120 - - 4.63 A 45234


C-O-Yb YbC0.5 O0.5 *,cF*,* - 0.485,0.485,0.485,90,90,90 - - - N 9017
C-O-Zn Zn[CO3] Ca[CO3],hR30,167 R-3c 0.46526,0.46526,1.50257,90,90,120 smithsonite - 4.44 X 14761
C-O-Zn Zn[C2O4] ht *,mP14,14 P121/c1 0.5331,0.5123,0.61586,90,119.514,90 - - - N 16484
C-O-Zn Zn[C2O4] rt *,oP7,58 Pnnm 0.5276,0.5389,0.2639,90,90,90 - - - N 16484
C-O-Zr ZrC0.03 O0.05 rt NiAs,hP4,194 P63/mmc 0.32421,0.32421,0.5175,90,90,120 close-packed structure - 6.51 X 7749
C-O-Zr ZrC0.5 O0.5 NaCl,cF8,225 Fm-3m 0.465,0.465,0.465,90,90,90 rocksalt family - 6.95 X 9211
C-O-Zr Zr2C1.2O0.8 LiTiO2,cF64,227 Fd-3m 0.93986,0.93986,0.93986,90,90,90 rocksalt family - 6.71 X 58325
C-Os-Pr Pr12 Os5C15 La12 Re5C15,hP32,189 P-62m 1.0928,1.0928,0.5302,90,90,120 - - 8.55 A 34625
C-Os-Pr Pr3.67 OsC6 La3.67 FeC6,hP24,176 P63/m 0.87531,0.87531,0.52413,90,90,120 - gray 7.44 X 39525
C-Os-Pr Pr5Os3C4 La5Os3C4,hP24,193 P63/mcm 0.9005,0.9005,0.66783,90,90,120 - gray dark 9.37 A 33462
C-Os-Sc Sc3OsC4 lt Sc3RuC4,mS32,12 C12/m1 1.2795,0.44856,0.6653,90,105.07,90 - - 6.72 X 52311
C-Os-Sc Sc3OsC4 rt Sc3CoC4,oI16,71 Immm 0.33271,0.44794,1.2357,90,90,90 - gray 6.73 X 52311
C-Os-Sm Sm12 Os5C15 La12 Re5C15,hP32,189 P-62m 1.0816,1.0816,0.518,90,90,120 - - 9.29 A 34625
C-Os-Sm Sm3.67 OsC6 La3.67 FeC6,hP24,176 P63/m 0.8642,0.8642,0.5123,90,90,120 - gray 8.16 A 39525
C-Os-Sm Sm5 Os3C4 La5Os3C4,hP24,193 P63/mcm 0.893,0.893,0.6644,90,90,120 - gray dark 9.92 A 33462
C-Os-Tb Tb12 Os5C15 La12 Re5C15,hP32,189 P-62m 1.0694,1.0694,0.508,90,90,120 - - 10.03 X 34625
C-Os-Tb Tb2OsC2 Pr2ReC2,oP20,62 Pnma 0.64382,0.51262,0.981,90,90,90 - - 10.92 X 33350
C-Os-Tm Tm12 Os5C15 La12 Re5C15,hP32,189 P-62m 1.0561,1.0561,0.4936,90,90,120 - - 11.00 A 34625
C-Os-U U2OsC2 Na2HgO2,tI10,139 I4/mmm 0.3461,0.3461,1.2593,90,90,90 - - 15.20 A 9441
C-Os-W W0.5 Os0.5C0.33 NaCl,cF8,225 Fm-3m 0.401,0.401,0.401,90,90,90 rocksalt family - 19.67 X 12895
C-Os-Y Y12Os5C15 La12 Re5C15,hP32,189 P-62m 1.0683,1.0683,0.5038,90,90,120 - - 7.33 A 34625
C-Os-Y Y2OsC2 Pr2ReC2,oP20,62 Pnma 0.645,0.50896,0.978,90,90,90 - - 8.11 A 33350
C-Os-Zr Zr4Os2C W4Co2C,cF112,227 Fd-3m 1.241,1.241,1.241,90,90,90 η-carbide - 10.53 A 3657
C-P-Pr Pr4P1.95 C2.1 La4P 1.92 C2.16,cI52,199 I213 0.88091,0.88091,0.88091,90,90,90 - - 6.31 X 55443
C-P-U UP 0.954 C0.046 NaCl,cF8,225 Fm-3m 0.556,0.556,0.556,90,90,90 rocksalt family - 10.36 X 3794
C-P-V V2PC Cr2AlC,hP8,194 P63/mmc 0.3077,0.3077,1.091,90,90,120 - - 5.38 X 4187
C-P-V V3PC Cr3(B0.5 C0.5)C,oS20,63 Cmcm 0.3119,0.9758,0.7531,90,90,90 - - 5.67 A 4188
C-P-V V32P 15C3 *,oP*,17 P222 1 0.3218,1.712,1.304,90,90,90 - - - N 7665
C-P-V V4P 2C V4P 2 C,hP21,189 P-62m 0.956,0.956,0.316,90,90,120 - - 5.53 X 7665
C-P-V V5P 2.83 C0.5 CuHf5Sn3,hP18,193 P63/mcm 0.694,0.694,0.482,90,90,120 AlB2 family - 5.75 A 7665
C-P-Zn Zn4P 4C *,hP*,* - 0.733,0.733,1.,90,90,120 - black - N 4797
C-Pb-Pd Pd3PbC0.5 CaTiO3,cP5,221 Pm-3m 0.3895,0.3895,0.3895,90,90,90 perovskite family - 14.96 X 1560
C-Pb-Pr Pr3PbC CaTiO3,cP5,221 Pm-3m 0.507,0.507,0.507,90,90,90 perovskite family - 8.18 X 3204
C-Pb-Pt Pt3PbC0.5 CaTiO3,cP5,221 Pm-3m 0.3875,0.3875,0.3875,90,90,90 perovskite family - 22.79 X 1560
C-Pb-S PbCS3 hex *,hP30,169 P61 0.6228,0.6228,1.9996,90,90,120 - - - N 3995
C-Pb-S PbCS3 orth *,oP20,31 Pmn21 0.8853,0.8054,0.6235,90,90,90 - - - N 3995
C-Pb-Sc Sc3PbC CaTiO3,cP5,221 Pm-3m 0.4528,0.4528,0.4528,90,90,90 perovskite family - 6.33 X 31208
C-Pb-Sm Sm3 PbC CaTiO3,cP5,221 Pm-3m 0.4988,0.4988,0.4988,90,90,90 perovskite family - 8.97 X 3196
C-Pb-Tb Tb3PbC CaTiO3,cP5,221 Pm-3m 0.4902,0.4902,0.4902,90,90,90 perovskite family - 9.81 X 3196
C-Pb-Ti Ti2PbC Cr2AlC,hP8,194 P63/mmc 0.3209,0.3209,1.381,90,90,120 - - 8.49 A 2312
C-Pb-Tm Tm3 PbC CaTiO3,cP5,221 Pm-3m 0.4791,0.4791,0.4791,90,90,90 perovskite family - 10.96 X 33965
C-Pb-Y Y3PbC CaTiO3,cP5,221 Pm-3m 0.4882,0.4882,0.4882,90,90,90 perovskite family - 6.93 X 33965
C-Pb-Yb Yb3PbC CaTiO3,cP5,221 Pm-3m 0.4834,0.4834,0.4834,90,90,90 perovskite family - 10.85 X 33965
C-Pb-Zr Zr2PbC Cr2AlC,hP8,194 P63/mmc 0.3384,0.3384,1.467,90,90,120 - - 9.17 A 2239
C-Pd-Rb Rb2PdC2 Na2PdC2,hP5,164 P-3m1 0.53581,0.53581,0.52888,90,90,120 - - 3.81 X 39429
C-Pd-Sn PdSn0.33 C0.17 CuAu,tP2,123 P4/mmm 0.28539,0.28539,0.38,90,90,90 close-packed structure - 7.92 X 1560
C-Pr-Re Pr12 Re5C15 La12 Re5C15,hP32,189 P-62m 1.0986,1.0986,0.5322,90,90,120 - gray dark 8.36 A 29688
C-Pr-Re Pr2ReC2 Pr2ReC2,oP20,62 Pnma 0.66559,0.53454,1.01835,90,90,90 - - 9.02 X 23790
C-Pr-Rh PrRhC2 CeNiC2,oS8,38 Amm2 0.36822,0.47089,0.6617,90,90,90 - - 7.75 A 22199
C-Pr-Rh PrRh3C CaTiO3,cP5,221 Pm-3m 0.4187,0.4187,0.4187,90,90,90 perovskite family - 10.44 X 53254
C-Pr-Ru Pr3.67 RuC6 La3.67 FeC6,hP24,176 P63/m 0.8709,0.8709,0.5249,90,90,120 - gray 6.65 A 32658
C-Pr-Si Pr3Si2C2 Pr3Si2C2,oS20,65 Cmmm 0.3967,1.6452,0.4399,90,90,90 - gray 5.82 X 39069
C-Pr-Sn Pr0.75 Sn0.25 C0.055 Cu,cF4,225 Fm-3m 0.5023,0.5023,0.5023,90,90,90 close-packed structure gray 7.13 F 6078
C-Pr-Sn Pr3SnC CaTiO3,cP5,221 Pm-3m 0.506,0.506,0.506,90,90,90 perovskite family - 7.09 X 3204
C-Pr-Th Th1.8 Pr0.2 C3 ht-hp Pu2C3,cI40,220 I-43d 0.85563,0.85563,0.85563,90,90,90 - - 10.22 A 7468
C-Pr-Tl TlPr3C CaTiO3,cP5,221 Pm-3m 0.5055,0.5055,0.5055,90,90,90 perovskite family - 8.22 X 33965
C-Pr-W Pr2WC2 Pr2MoC2,tP20,136 P42/mnm 0.57945,0.57945,1.0357,90,90,90 - gray silver 9.35 X 49520
C-Pt-Rb Rb2PtC2 Na2PdC2,hP5,164 P-3m1 0.53688,0.53688,0.52245,90,90,120 - - 4.97 X 39429
C-Pt-Sn Pt3SnC0.5 CaTiO3,cP5,221 Pm-3m 0.389,0.389,0.389,90,90,90 perovskite family - 20.03 X 1560
C-Pt-U UPt3C0.1 Mg3 Cd,hP8,194 P63/mmc 0.5759,0.5759,0.49068,90,90,120 close-packed structure - 19.43 F 21417
C-Pt-U U2PtC2 Na2HgO2,tI10,139 I4/mmm 0.3522,0.3522,1.2548,90,90,90 - - 14.83 A 5305
C-Pt-W W0.5Pt0.5 C0.1 NaCl,cF8,225 Fm-3m 0.399,0.399,0.399,90,90,90 rocksalt family - 19.94 X 12895
C-Pu-Ru PuRu3C CaTiO3,cP5,221 Pm-3m 0.4113,0.4113,0.4113,90,90,90 perovskite family - 13.35 X 8686
C-Pu-Ta Pu0.83 Ta0.17 C NaCl,cF8,225 Fm-3m 0.485,0.485,0.485,90,90,90 rocksalt family - 14.28 X 11619
C-Pu-Tc PuTcC2 *,m**,* - 0.54007,0.32112,1.07142,90,99.476,90 - - - N 9493
C-Pu-U U0.64 Pu1.36 C3 Pu2C3,cI40,220 I-43d 0.8117,0.8117,0.8117,90,90,90 - - 12.92 A 27608
C-Pu-U U0.65 Pu0.35 C NaCl,cF8,225 Fm-3m 0.496,0.496,0.496,90,90,90 rocksalt family - 13.72 X 1940
C-Pu-W PuWC2 UMoC2,oP16,62 Pnma 0.5621,0.3245,1.0877,90,90,90 - - 15.13 A 6792
C-Pu-W Pu2W2C3 Er2Mo 2C3,mS14,12 C12/m1 1.1609,0.3252,0.5616,90,109.83,90 - - 14.85 A 7527
C-Pu-Zr Pu0.24 Zr0.76 C NaCl,cF8,225 Fm-3m 0.475,0.475,0.475,90,90,90 rocksalt family - 8.67 X 11619
C-Pu-Zr Pu0.76 Zr0.24 C NaCl,cF8,225 Fm-3m 0.49,0.49,0.49,90,90,90 rocksalt family - 12.38 X 11619
C-Re-Sc Sc5Re2C7 Sc5Re2C7,oS28,65 Cmmm 0.77926,1.362,0.32062,90,90,90 - gray dark 6.65 X 26965
C-Re-Sm Sm2 ReC2 Pr2ReC2,oP20,62 Pnma 0.6613,0.5229,1.0019,90,90,90 - - 9.80 A 23790
C-Re-Tb Tb12 Re5C15 La12 Re5C15,hP32,189 P-62m 1.0733,1.0733,0.5105,90,90,120 - gray dark 9.84 A 29688
C-Re-Tb Tb2ReC2 Pr2ReC2,oP20,62 Pnma 0.65519,0.51176,0.98519,90,90,90 - - 10.62 X 30471
C-Re-Tm Tm2 ReC2 Pr2ReC2,oP20,62 Pnma 0.64795,0.50091,0.9691,90,90,90 - - 11.57 A 23790
C-Re-Tm Tm5 Re2C7 Sc5Re2C7,oS28,65 Cmmm 0.79202,1.43055,0.33594,90,90,90 - gray dark 11.35 A 33968
370 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Re-U UReC2 UMoC2,oP16,62 Pnma 0.5537,0.32114,1.09001,90,90,90 - - 15.36 A 9493


C-Re-U U2Re2C3 Er2Mo2C3 ,mS14,12 C12/m1 1.1643,0.3207,0.5569,90,109.87,90 - - 15.02 A 7529
C-Re-U U5Re3C8 U5Re3C8,tP32,127 P4/mbm 1.1313,1.1313,0.33029,90,90,90 - black 14.49 X 21610
C-Re-V V0.19 Re0.81 C0.27 NaCl,cF8,225 Fm-3m 0.3997,0.3997,0.3997,90,90,90 rocksalt family - 17.03 X 16965
C-Re-W W0.5 Re0.5C NaCl,cF8,225 Fm-3m 0.4101,0.4101,0.4101,90,90,90 rocksalt family - 18.98 X 6000
C-Re-W W3Re2C Mo3Al2C,cP24,213 P4132 0.6872,0.6872,0.6872,90,90,90 - - 19.16 A 6000
C-Re-Y Y12Re5C15 La12Re5C15 ,hP32,189 P-62m 1.0721,1.0721,0.5067,90,90,120 - gray dark 7.17 A 29688
C-Re-Y Y2ReC2 Pr2ReC2,oP20,62 Pnma 0.65569,0.50946,0.98442,90,90,90 - - 7.84 X 23790
C-Re-Yb Yb2ReC2 Pr2ReC2,oP20,62 Pnma 0.64591,0.49864,0.96605,90,90,90 - gray dark 11.88 A 33968
C-Re-Zr Zr0.98 Re0.02 C NaCl,cF8,225 Fm-3m 0.4682,0.4682,0.4682,90,90,90 rocksalt family - 6.80 X 7397
C-Rh-Sc ScRh3C CaTiO3,cP5,221 Pm-3m 0.4017,0.4017,0.4017,90,90,90 perovskite family gray silver 9.37 X 10736
C-Rh-Sc Sc3RhC4 Sc3RhC4,mS32,12 C12/m1 0.56016,1.2258,0.56016,90,106.08,90 - gray 5.14 X 45559
C-Rh-Sm SmRhC2 CeNiC2,oS8,38 Amm2 0.35891,0.46929,0.6567,90,90,90 - - 8.33 X 22199
C-Rh-Sm SmRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.4163,0.4163,0.4163,90,90,90 perovskite family - 10.76 X 6791
C-Rh-Tb TbRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.4128,0.4128,0.4128,90,90,90 perovskite family - 11.24 X 6791
C-Rh-Tb Tb8Rh5C12 Er8Rh5C12 ,mS50,12 C12/m1 2.7804,0.35682,0.7398,90,93.53,90 - - 8.75 A 22276
C-Rh-Th ThRh3C0.3 CaTiO3,cP5,221 Pm-3m 0.4173,0.4173,0.4173,90,90,90 perovskite family - 12.44 X 10786
C-Rh-Ti TiRh3C0.21 CaTiO3,cP5,221 Pm-3m 0.387,0.387,0.387,90,90,90 perovskite family - 10.29 X 16396
C-Rh-Tm TmRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.4098,0.4098,0.4098,90,90,90 perovskite family - 11.73 X 6791
C-Rh-Tm Tm8Rh5C12 Er8Rh5C12 ,mS50,12 C12/m1 2.7666,0.34674,0.7268,90,94.36,90 - - 9.60 A 22276
C-Rh-U U2RhC2 Na2HgO2,tI10,139 I4/mmm 0.34659,0.34659,1.25147,90,90,90 - - 13.32 A 4810
C-Rh-W W0.38 Rh0.62 C0.1 ht NaCl,cF8,225 Fm-3m 0.389,0.389,0.389,90,90,90 rocksalt family - 15.22 X 16396
C-Rh-Y YRh3C CaTiO3,cP5,221 Pm-3m 0.41262,0.41262,0.41262,90,90,90 perovskite family gray silver 9.68 X 46601
C-Rh-Y Y8Rh5C12 Er8Rh5C12 ,mS50,12 C12/m1 2.783,0.35351,0.73667,90,93.74,90 - - 6.29 A 22276
C-Rh-Yb YbRh3C0.7 CaTiO3,cP5,221 Pm-3m 0.4098,0.4098,0.4098,90,90,90 perovskite family - 11.83 X 6791
C-Rh-Zr ZrRh3C0.21 CaTiO3,cP5,221 Pm-3m 0.395,0.395,0.395,90,90,90 perovskite family - 10.84 X 16396
C-Ru-Sc ScRu3C CaTiO3,cP5,221 Pm-3m 0.4031,0.4031,0.4031,90,90,90 perovskite family - 9.13 X 10736
C-Ru-Sc Sc3RuC4 lt Sc3RuC4,mS32,12 C12/m1 1.2814,0.4486,0.6627,90,104.99,90 - - 5.13 X 52311
C-Ru-Sc Sc3RuC4 rt Sc3CoC4,oI16,71 Immm 0.3311,0.44892,1.2385,90,90,90 - gray 5.12 X 52311
C-Ru-Sm Sm3.67 RuC6 La3.67 FeC6 ,hP24,176 P63 /m 0.8627,0.8627,0.5147,90,90,120 - gray 7.26 A 32658
C-Ru-Ta TaRu3C0.4 CaTiO3,cP5,221 Pm-3m 0.3928,0.3928,0.3928,90,90,90 perovskite family - 13.40 X 16396
C-Ru-Tb Tb3Ru1.78 C4.95 Gd3Ru2C5 ,hP50,176 P63 /m 1.1304,1.1304,0.4946,90,90,120 - gray dark 8.69 X 39177
C-Ru-Th ThRu3C CaTiO3,cP5,221 Pm-3m 0.4227,0.4227,0.4227,90,90,90 perovskite family - 12.03 X 30191
C-Ru-Th Th11Ru12C18 Th11Ru12C18,cI82,217 I-43m 1.0754,1.0754,1.0754,90,90,90 - - 10.63 X 30191
C-Ru-Th Th2Ru6C5 Th2Ru6C5,tP26,127 P4/mbm 0.9096,0.9096,0.41774,90,90,90 - - 10.86 X 30191
C-Ru-Tm TmRu3C CaTiO3,cP5,221 Pm-3m 0.41147,0.41147,0.41147,90,90,90 perovskite family - 11.54 X 30191
C-Ru-Tm Tm7Ru2C11 Er7Ru2C11 ,oS80,63 Cmcm 0.34372,1.6437,1.9378,90,90,90 - gray 9.20 A 28260
C-Ru-U URuC2 UMoC2,oP16,62 Pnma 0.5489,0.3223,1.0742,90,90,90 - - 12.69 A 6776
C-Ru-U U2RuC2 Na2HgO2,tI10,139 I4/mmm 0.34489,0.34489,1.25708,90,90,90 - - 13.35 A 4810
C-Ru-V VRu3C0.4 CaTiO3,cP5,221 Pm-3m 0.389,0.389,0.389,90,90,90 perovskite family - 10.13 X 16396
C-Ru-W W0.29 Ru0.71 C0.2 ht NaCl,cF8,225 Fm-3m 0.3914,0.3914,0.3914,90,90,90 rocksalt family - 14.12 X 16396
C-Ru-Y Y1.8 Ru0.2 C2.7 Pu2C3,cI40,220 I-43d 0.82408,0.82408,0.82408,90,90,90 - - 5.05 A 4710
C-Ru-Y Y3Ru2C5 Gd3Ru2C5 ,hP50,176 P63 /m 1.1384,1.1384,0.4989,90,90,120 - gray dark 6.27 A 39177
C-Ru-Yb YbRu3C CaTiO3,cP5,221 Pm-3m 0.41111,0.41111,0.41111,90,90,90 perovskite family - 11.67 X 30191
C-Ru-Zr ZrRu3C0.7 CaTiO3,cP5,221 Pm-3m 0.404,0.404,0.404,90,90,90 perovskite family - 10.14 X 16396
C-S-Se Se8[C60][CS2] Se8[C60][CS2],mP284,14 P121/c1 1.33005,2.9006,0.98809,90,91.76,90 fullerene family black 2.49 X 45664
C-S-Se Se8[C70][CS2] Se8[C70][CS2],oP648,29 Pca21 3.3518,1.0056,2.5539,90,90,90 fullerene family red dark 2.39 X 49682
C-S-Sr SrCS3 *,hP30,169 P61 0.628,0.628,2.008,90,90,120 - - - N 3959
C-S-Ta Ta2CS2 ht Ta2CS2,hP5,164 P-3m1 0.3265,0.3265,0.8537,90,90,120 - - 9.23 X 5471
C-S-Ta Ta2CS2 rt Ta2CS2,hR15,166 R-3m 0.3276,0.3276,2.562,90,90,120 - - 9.16 X 5471
C-S-Ti Ti2CS Cr2AlC,hP8,194 P63 /mmc 0.321,0.321,1.12,90,90,120 - - 4.65 X 1343
C-S-Tl Tl2CS3 Na2CS3,mS24,15 C12/c1 1.14333,0.6278,0.9161,90,118.77,90 - orange 5.96 X 53511
C-S-Zr Zr2CS Cr2AlC,hP8,194 P63 /mmc 0.3396,0.3396,1.211,90,90,120 - - 6.22 X 1343
C-Sb-Zr Zr5Sb3C CuHf5Sn3,hP18,193 P63 /mcm 0.83017,0.83017,0.57126,90,90,120 AlB2 family - 8.12 A 23372
C-Sc-Si Sc5Si3C0.6 CuHf5Sn3,hP18,193 P63 /mcm 0.7875,0.7875,0.5846,90,90,120 AlB2 family - 3.35 A 20195
C-Sc-Sn Sc3SnC CaTiO3,cP5,221 Pm-3m 0.4516,0.4516,0.4516,90,90,90 perovskite family - 4.79 X 31208
C-Sc-Th ScThC3 ht-hp Pu2C3,cI40,220 I-43d 0.8543,0.8543,0.8543,90,90,90 - - 6.67 A 7468
C-Sc-Ti Sc0.27 Ti0.73 C0.63 NaCl,cF8,225 Fm-3m 0.4256,0.4256,0.4256,90,90,90 rocksalt family - 4.71 X 31966
C-Sc-Ti Sc2.9 Ti0.1 C3.8 Sc3C4,tP70,128 P4/mnc 0.7489,0.7489,1.5123,90,90,90 - - 3.54 A 31966
C-Sc-Tl TlSc3C CaTiO3,cP5,221 Pm-3m 0.4512,0.4512,0.4512,90,90,90 perovskite family - 6.35 X 33965
C-Sc-Zr Sc0.25 Zr0.75 C0.89 NaCl,cF8,225 Fm-3m 0.4702,0.4702,0.4702,90,90,90 rocksalt family - 5.77 X 34492
C-Sc-Zr Sc0.59 Zr0.39 C0.02 rt Mg,hP2,194 P63 /mmc 0.3301,0.3301,0.527,90,90,120 close-packed structure - 4.16 X 34492
C-Sc-Zr Sc2.86 Zr0.14 C4 Sc3C4,tP70,128 P4/mnc 0.7499,0.7499,1.504,90,90,90 - - 3.72 A 34492
C-Si-Sm Sm15Si9C La15FeGe9 ,hP50,186 P63 mc 1.4845,1.4845,0.6561,90,90,120 - - 6.69 A 56529
C-Si-Sm Sm3Si2C2 Pr3Si2C2,oS20,65 Cmmm 0.3913,1.6073,0.4316,90,90,90 - gray 6.50 A 34802
C-Si-Tb Tb15Si9C La15FeGe9 ,hP50,186 P63 mc 1.4629,1.4629,0.6418,90,90,120 - - 7.40 A 56529
C-Si-Tb Tb3Si2C2 Tb3Si2C2,oP32,57 Pbcm 0.4236,0.7707,1.5702,90,90,90 - gray 7.22 X 39069
C-Si-Tb Tb5Si3C0.33 Zr5Al3O0.5 ,hP52,186 P63 mc 1.46194,1.46194,0.64152,90,90,120 - - 7.41 X 56617
C-Si-Ti Ti0.85 Si0.15 C0.99 NaCl,cF8,225 Fm-3m 0.4323,0.4323,0.4323,90,90,90 rocksalt family - 4.67 X 10660
C-Si-Ti Ti3SiC2 Ti3SiC2,hP12,194 P63 /mmc 0.30656,0.30656,1.763,90,90,120 - gray 4.53 X 36094
C-Si-Ti Ti5Si3C0.50 CuHf5Sn3,hP18,193 P63 /mcm 0.74424,0.74424,0.51677,90,90,120 AlB2 family - 4.42 A 37280
C-Si-Tm Tm3Si2C2 Pr3Si2C2,oS20,65 Cmmm 0.3796,1.5328,0.4145,90,90,90 - gray 8.08 A 34802
C-Si-U U20Si16C3 U20Si16C3,hP39,191 P6/mmm 1.0377,1.0377,0.8005,90,90,120 - gray dark 11.67 X 27556
C-Si-U U3Si2C2 U3Si2C2,tI14,139 I4/mmm 0.35735,0.35735,1.8882,90,90,90 - gray dark 10.94 X 27556
C-Si-V V3Si0.5 C0.5 Cr3Si,cP8,223 Pm-3n 0.47267,0.47267,0.47267,90,90,90 Frank-Kasper phase - 5.44 X 14108
C-Si-Y Y1.8 Si0.2 C2.7 Pu2C3,cI40,220 I-43d 0.8272,0.8272,0.8272,90,90,90 - - 4.65 A 4710
C-Si-Y Y15Si9C La15FeGe9 ,hP50,186 P63 mc 1.4573,1.4573,0.6404,90,90,120 - - 4.51 A 56529
C-Si-Y Y3Si2C2 Y3Si2C2,oI36,74 Imma 0.8426,1.5634,0.3846,90,90,90 - gray 4.55 X 39069
Handbook of Inorganic Substances – Edition 2015 : Data 371

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

C-Si-Y Y5Si3C0.5 CuHf5Sn3,hP18,193 P63/mcm 0.8414,0.8414,0.6369,90,90,120 AlB2 family - 4.55 A 17130


C-Sm-Sn Sm0.75 Sn0.25 C0.11 Cu,cF4,225 Fm-3m 0.4984,0.4984,0.4984,90,90,90 close-packed structure gray 7.71 F 6078
C-Sm-Sn Sm3 SnC CaTiO3,cP5,221 Pm-3m 0.4979,0.4979,0.4979,90,90,90 perovskite family - 7.83 X 3196
C-Sm-Tl TlSm3C CaTiO3,cP5,221 Pm-3m 0.5024,0.5024,0.5024,90,90,90 perovskite family - 8.74 X 33965
C-Sn-Tb Tb3SnC CaTiO3,cP5,221 Pm-3m 0.4886,0.4886,0.4886,90,90,90 perovskite family - 8.65 X 3196
C-Sn-Ti Ti2SnC Cr2AlC,hP8,194 P63/mmc 0.31665,0.31665,1.37123,90,90,120 - - 6.32 A 48531
C-Sn-Ti Ti3SnC2 Ti3SiC2,hP12,194 P63/mmc 0.31366,0.31366,1.865,90,90,120 - - 5.99 X 48531
C-Sn-Tm Tm3 SnC CaTiO3,cP5,221 Pm-3m 0.4772,0.4772,0.4772,90,90,90 perovskite family - 9.74 X 3196
C-Sn-Y Y1.8 Sn0.2 C2.7 Pu2C3,cI40,220 I-43d 0.82431,0.82431,0.82431,90,90,90 - - 5.13 A 4710
C-Sn-Y Y3SnC CaTiO3,cP5,221 Pm-3m 0.4866,0.4866,0.4866,90,90,90 perovskite family - 5.73 X 33965
C-Sn-Yb Yb0.75 Sn0.25C0.12 Cu,cF4,225 Fm-3m 0.4845,0.4845,0.4845,90,90,90 close-packed structure - 9.40 F 6078
C-Sn-Yb Yb3SnC CaTiO3,cP5,221 Pm-3m 0.4843,0.4843,0.4843,90,90,90 perovskite family - 9.50 X 3196
C-Sn-Zr Zr2SnC Cr2AlC,hP8,194 P63/mmc 0.3347,0.3347,1.459,90,90,120 - - 7.35 A 1969
C-Sn-Zr Zr5Sn3C CuHf5Sn3,hP18,193 P63/mcm 0.84268,0.84268,0.58001,90,90,120 AlB2 family - 7.67 X 25881
C-Ta-Ti Ti0.57 Ta0.43 C NaCl,cF8,225 Fm-3m 0.43876,0.43876,0.43876,90,90,90 rocksalt family gray bright 9.21 X 21111
C-Ta-U U0.5 Ta0.5 C NaCl,cF8,225 Fm-3m 0.4685,0.4685,0.4685,90,90,90 rocksalt family - 14.31 X 1961
C-Ta-V Ta0.5 V0.5 C NaCl,cF8,225 Fm-3m 0.434,0.434,0.434,90,90,90 rocksalt family gray silver 10.40 X 1273
C-Ta-V Ta0.67 V0.33 C0.67 TiS,hR18,166 R-3m 0.3045,0.3045,2.181,90,90,120 - - 12.47 X 5318
C-Ta-W Ta0.23 W0.77 C0.5 NiAs,hP4,194 P63/mmc 0.3021,0.3021,0.4768,90,90,120 AlB2 family - 16.67 X 1714
C-Ta-W Ta0.7 W0.3 C NaCl,cF8,225 Fm-3m 0.441,0.441,0.441,90,90,90 rocksalt family - 15.01 X 1714
C-Ta-Zr Zr0.44 Ta0.56 C0.96 NaCl,cF8,225 Fm-3m 0.4535,0.4535,0.4535,90,90,90 rocksalt family gray silver 10.90 X 10667
C-Tb-Th Th1.8 Tb0.2 C3 ht-hp Pu2C3,cI40,220 I-43d 0.85415,0.85415,0.85415,90,90,90 - - 10.35 A 7468
C-Tb-Tl TlTb3C CaTiO3,cP5,221 Pm-3m 0.4913,0.4913,0.4913,90,90,90 perovskite family - 9.71 X 3196
C-Tb-W TbWC2 UMoC2,oP16,62 Pnma 0.5885,0.3603,1.0983,90,90,90 - - 10.46 A 34411
C-Tc-U UTcC2 UMoC2,oP16,62 Pnma 0.555,0.3232,1.0901,90,90,90 - - 12.23 A 9493
C-Tc-U UTc 3C rt *,t**,* - 0.503,0.503,1.2493,90,90,90 - - - N 12917
C-Tc-U UTc 3C0.55 CaTiO3,cP5,221 Pm-3m 0.41322,0.41322,0.41322,90,90,90 perovskite family - 12.68 X 12917
C-Te-U U2TeC2 *,tP*,* - 0.6564,0.6564,1.3959,90,90,90 - - - N 6082
C-Th-U Th0.2 U0.8 C2 ht1 CaC2,tI6,139 I4/mmm 0.3589,0.3589,0.6049,90,90,90 - - 11.12 A 3074
C-Th-U Th0.5 U0.5 C NaCl,cF8,225 Fm-3m 0.514,0.514,0.514,90,90,90 rocksalt family - 12.08 X 1475
C-Th-U Th0.9 U0.1 C2 rt ThC2,mS12,15 C12/c1 0.663,0.4183,0.669,90,103.86,90 - - 9.46 X 20371
C-Th-Y YThC2.9 Pu2C3,cI40,220 I-43d 0.8418,0.8418,0.8418,90,90,90 - - 7.92 A 5310
C-Th-Y Y0.5 Th0.5 C2 rt CaC2,tI6,139 I4/mmm 0.3693,0.3693,0.6036,90,90,90 - - 7.44 A 4710
C-Ti-Tl TlTi2C Cr2AlC,hP8,194 P63/mmc 0.3158,0.3158,1.398,90,90,120 - - 8.59 A 2312
C-Ti-Tl TlTi3C CaTiO3,cP5,221 Pm-3m 0.4209,0.4209,0.4209,90,90,90 perovskite family - 8.02 X 2313
C-Ti-V Ti0.21 V0.79 C0.5 ht NiAs,hP4,194 P63/mmc 0.291,0.291,0.463,90,90,120 AlB2 family - 5.51 X 3228
C-Ti-V Ti0.6 V0.4 C0.94 NaCl,cF8,225 Fm-3m 0.4258,0.4258,0.4258,90,90,90 rocksalt family gray silver 5.20 X 11545
C-Ti-V Ti0.8 V0.2 C0.62 cub Zr0.65 S,cF64,227 Fd-3m 0.85913,0.85913,0.85913,90,90,90 rocksalt family - 4.69 X 45420
C-Ti-V Ti0.8 V0.2 C0.62 rhom Sc0.685 S,hR12,166 R-3m 0.30342,0.30342,1.48522,90,90,120 - - 4.71 X 45420
C-Ti-W Ti0.95 W0.05C0.784 NaCl,cF8,225 Fm-3m 0.432,0.432,0.432,90,90,90 rocksalt family - 5.28 X 54719
C-Ti-W Ti2W4C3 *,hP*,* - 0.297,0.297,1.595,90,90,120 - - - N 30490
C-Ti-Y Y1.4 Ti0.6 C3 Pu2C3,cI40,220 I-43d 0.8237,0.8237,0.8237,90,90,90 - - 4.50 A 4710
C-Ti-Zn Zn0.9 Ti3.1 C0.5 CaTiO3,cP5,221 Pm-3m 0.4162,0.4162,0.4162,90,90,90 perovskite family - 4.91 X 4786
C-Ti-Zn Zn3Ti3C W3Fe3C,cF112,227 Fd-3m 1.1558,1.1558,1.1558,90,90,90 η-carbide - 6.05 A 2295
C-Ti-Zr Zr0.2 Ti0.8 C NaCl,cF8,225 Fm-3m 0.4335,0.4335,0.4335,90,90,90 rocksalt family gray silver 5.59 X 57906
C-Tl-Tm TlTm3C CaTiO3,cP5,221 Pm-3m 0.4793,0.4793,0.4793,90,90,90 perovskite family - 10.91 X 33965
C-Tl-Y TlY3C CaTiO3,cP5,221 Pm-3m 0.4878,0.4878,0.4878,90,90,90 perovskite family - 6.91 X 33965
C-Tl-Yb TlYb3C CaTiO3,cP5,221 Pm-3m 0.4844,0.4844,0.4844,90,90,90 perovskite family - 10.75 X 3196
C-Tl-Zr TlZr2C Cr2AlC,hP8,194 P63/mmc 0.3363,0.3363,1.479,90,90,120 - - 9.14 A 2239
C-Tm-W TmWC2 UMoC2,oP16,62 Pnma 0.5615,0.33097,1.0764,90,90,90 - - 12.51 A 19771
C-U-V UVC2 UMoC2,oP16,62 Pnma 0.55234,0.325,1.0714,90,90,90 - - 10.81 X 5220
C-U-W UWC2 UMoC2,oP16,62 Pnma 0.5614,0.3245,1.0964,90,90,90 - - 14.83 X 21500
C-U-W UW4C4 rt UW4C4,tP18,83 P4/m 0.83271,0.83271,0.31358,90,90,90 - gray 15.60 X 23534
C-U-W U2W2C3 Er2Mo 2C3,mS14,12 C12/m1 1.1637,0.3248,0.5626,90,109.41,90 - - 14.57 A 19771
C-U-Y Y1.7 U0.3 C2.9 hp Pu2C3,cI40,220 I-43d 0.8217,0.8217,0.8217,90,90,90 - - 6.16 A 4710
C-U-Zr U0.5 Zr0.5 C NaCl,cF8,225 Fm-3m 0.4828,0.4828,0.4828,90,90,90 rocksalt family - 10.43 X 1961
C-V-W V0.5 W0.5 C NaCl,cF8,225 Fm-3m 0.4226,0.4226,0.4226,90,90,90 rocksalt family - 11.39 X 10851
C-V-W V0.5 W0.5 C0.5 NiAs,hP4,194 P63/mmc 0.2955,0.2955,0.465,90,90,120 AlB2 family - 11.66 X 1717
C-V-Y Y1.8 V0.2 C2.9 Pu2C3,cI40,220 I-43d 0.824,0.824,0.824,90,90,90 - - 4.87 A 4710
C-V-Zr Zr0.96 V0.04 C NaCl,cF8,225 Fm-3m 0.4675,0.4675,0.4675,90,90,90 rocksalt family - 6.61 X 323
C-V-Zr Zr3V3C W3Fe3C,cF112,227 Fd-3m 1.212,1.212,1.212,90,90,90 η-carbide - 6.54 A 497
C-W-Y YWC2 UMoC2,oP16,62 Pnma 0.58858,0.35855,1.10417,90,90,90 - - 8.46 A 34411
C-W-Y Y1.8 W0.2 C2.9 Pu2C3,cI40,220 I-43d 0.8242,0.8242,0.8242,90,90,90 - - 5.50 A 4710
C-W-Zr Zr0.47 W0.53 C0.87 NaCl,cF8,225 Fm-3m 0.446,0.446,0.446,90,90,90 rocksalt family - 11.29 X 9815
C-Y-Zr Y1.8 Zr0.2 C2.9 Pu2C3,cI40,220 I-43d 0.8236,0.8236,0.8236,90,90,90 - - 5.07 A 4710
C-Zn-Zr Zn2Zr4C W3Fe3C,cF112,227 Fd-3m 1.216,1.216,1.216,90,90,90 η-carbide - 7.50 A 2295
Ca-Cd-Cu CaCu0.9 Cd0.1 Ca(Cu0.98 Ga0.02),oP40,31 Pmn21 0.4285,3.8828,0.5895,90,90,90 CrB(TlI)-FeB - 3.67 A 20215
Ca-Cd-Cu CaCu9Cd2 YNi9In2,tP24,127 P4/mbm 0.8442,0.8442,0.50472,90,90,90 - yellowish 7.73 X 59443
Ca-Cd-Cu Ca5Cu2Cd Mo5 SiB2,tI32,140 I4/mcm 0.80132,0.80132,1.48085,90,90,90 - gray 3.07 X 57413
Ca-Cd-Cu Ca6Cu6Cd27 Ca6Cu(Cu0.22 Cd0.78)18 Cd14,cP39,200 Pm-3 0.93914,0.93914,0.93914,90,90,90 - gray 7.33 X 57413
Ca-Cd-F Ca0.6 Cd0.4 F2 CaF2 ,cF12,225 Fm-3m 0.5432,0.5432,0.5432,90,90,90 fluorite family - 4.43 X 6250
Ca-Cd-Ga CaCd0.7 Ga1.3 KHg2,oI12,74 Imma 0.466,0.747,0.812,90,90,90 AlB2 family gray silver 4.92 X 26925
Ca-Cd-Ge CaCdGe ZrNiAl,hP9,189 P-62m 0.7317,0.7317,0.4481,90,90,120 Fe2P family - 5.40 X 20687
Ca-Cd-Hg Ca4Cd4.5 Hg4.5 Au6(Au0.5 In0.5 )6In,cP76,215 P-43m 1.113,1.113,1.113,90,90,90 γ-brass - 7.56 A 13877
Ca-Cd-Mg CaMgCd MgZn2,hP12,194 P63/mmc 0.6053,0.6053,0.9812,90,90,120 Friauf-Laves phase - 3.77 A 259
Ca-Cd-O Ca0.50 Cd0.50 O NaCl,cF8,225 Fm-3m 0.47448,0.47448,0.47448,90,90,90 rocksalt family - 5.74 X 56551
Ca-Cd-P CaCd2P 2 Ce2SO2,hP5,164 P-3m1 0.4277,0.4277,0.7031,90,90,120 - - 4.87 X 11120
Ca-Cd-P Ca2CdP 2 CdYb2Sb2,oS20,36 Cmc21 0.42066,1.612,0.70639,90,90,90 - red 3.53 X 56383
372 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-Cd-Pb CaCdPb ZrNiAl,hP9,189 P-62m 0.7731,0.7731,0.4735,90,90,120 Fe2P family - 7.31 X 20687


Ca-Cd-Pb Ca5CdPb3 CuHf5Sn3,hP18,193 P63 /mcm 0.93705,0.93705,0.7012,90,90,120 AlB2 family - 5.82 A 41564
Ca-Cd-Pd CaCd2Pd YPd2Si,oP16,62 Pnma 0.7946,0.8095,0.5547,90,90,90 - - 6.91 X 59755
Ca-Cd-Pd Ca2CdPd2 W2CoB2,oI10,71 Immm 0.44458,0.59025,0.86307,90,90,90 - gray dark 5.94 X 59769
Ca-Cd-Pt CaCd2Pt YPd2Si,oP16,62 Pnma 0.7966,0.8099,0.5526,90,90,90 - - 8.57 A 59755
Ca-Cd-Pt Ca2CdPt2 Ca2Cu2Ga,oI10,71 Immm 0.44514,0.58415,0.85976,90,90,90 - gray silver 8.66 X 59449
Ca-Cd-S Ca0.5 Cd0.5 S ht-hp NaCl,cF8,225 Fm-3m 0.556,0.556,0.556,90,90,90 rocksalt family - 4.19 X 13460
Ca-Cd-Sb CaCd2Sb2 Ce2SO2,hP5,164 P-3m1 0.4649,0.4649,0.7597,90,90,120 - gray silver 5.94 X 12020
Ca-Cd-Sb Ca14CdSb11.43 Ca14CdSb11.43 ,tI224,142 I41/acd 1.6583,1.6583,2.3167,90,90,90 - gray silver 4.31 X 29972
Ca-Cd-Sb Ca2CdSb2 Ca2CdSb2,oP20,62 Pnma 0.72536,0.4603,1.7521,90,90,90 - black 4.95 X 48525
Ca-Cd-Sn CaCdSn ZrNiAl,hP9,189 P-62m 0.76319,0.76319,0.46996,90,90,120 Fe2P family - 5.70 X 27798
Ca-Cd-Tl CaTl0.5 Cd0.5 CsCl,cP2,221 Pm-3m 0.38403,0.38403,0.38403,90,90,90 b.c.c. family - 5.82 X 8685
Ca-Ce-F CaCeF6 rt *,hP24,194 P63 /mmc 0.69,0.69,0.709,90,90,120 - white - N 3979
Ca-Ce-F Ca0.1 Ce0.9 F2.9 HoH3,hP24,165 P-3c1 0.711,0.711,0.728,90,90,120 - - 5.79 A 10184
Ca-Ce-F Ca0.80 Ce0.20 F2.20 CeH3,cF44,225 Fm-3m 0.5568,0.5568,0.5568,90,90,90 fluorite family - 3.92 A 50227
Ca-Ce-Ge Ca3Ce2Ge4 Sc3Ce2Si4 ,oP36,62 Pnma 0.76453,1.5423,0.80632,90,90,90 - gray silver 4.83 X 44779
Ca-Ce-N Ca0.5 Ce0.5 N NaCl,cF8,225 Fm-3m 0.49921,0.49921,0.49921,90,90,90 rocksalt family black 5.56 X 40870
Ca-Ce-O CaCeO3 CaTiO3,mP40,11 P121/m1 0.77,0.77,0.77,90,90.,90 - white 6.64 A 236
Ca-Ce-O Ca0.1 Ce0.9 O1.9 CaF2,cF12,225 Fm-3m 0.54139,0.54139,0.54139,90,90,90 fluorite family - 6.72 X 59051
Ca-Ce-S Ca0.6 Ce2.27 S4 Th3P 4,cI28,220 I-43d 0.8604,0.8604,0.8604,90,90,90 - - 4.91 A 59395
Ca-Ce-Se Ca0.98 Ce0.02 Se NaCl,cF8,225 Fm-3m 0.59316,0.59316,0.59316,90,90,90 rocksalt family - 3.85 X 53067
Ca-Cl-Cs CsCaCl3 lt SrZrO3,tI20,140 I4/mcm 0.5377,0.5377,0.7599,90,90,90 perovskite family - 8.45 A 19622
Ca-Cl-Cs CsCaCl3 rt CaTiO3,cP5,221 Pm-3m 0.5373,0.5373,0.5373,90,90,90 perovskite family - 2.99 X 19622
Ca-Cl-Cs Cs2CaCl4 K2NiF4,tI14,139 I4/mmm 0.5372,0.5372,1.723,90,90,90 high-Tc family - 2.99 A 4899
Ca-Cl-Cs Cs3Ca2Cl7 Sr3Ti2O7,tI24,139 I4/mmm 0.5387,0.5387,2.792,90,90,90 Ruddlesden-Popper - 2.98 A 4899
Ca-Cl-Eu Ca0.5 Eu0.5 Cl2 SrI2,oP24,61 Pbca 0.68,1.338,0.7052,90,90,90 - - 3.46 A 20391
Ca-Cl-F CaClF PbClF,tP6,129 P4/nmm 0.3894,0.3894,0.6818,90,90,90 rorisite - 3.04 X 10420
Ca-Cl-H CaClH PbClF,tP6,129 P4/nmm 0.3844,0.3844,0.6837,90,90,90 - colorless 2.52 X 16679
Ca-Cl-H Ca7Cl2H12 Zr2Fe12P 7,hP21,174 P-6 0.93651,0.93651,0.36865,90,90,120 - colorless 2.16 X 55600
Ca-Cl-K KCaCl3 ht1 KCuF3,tI20,140 I4/mcm 0.7387,0.7387,0.9645,90,90,90 - - 2.34 A 4899
Ca-Cl-K KCaCl3 ht2 CaTiO3,cP5,221 Pm-3m 0.5365,0.5365,0.5365,90,90,90 perovskite family - 2.00 X 18588
Ca-Cl-K KCaCl3 rt GdFeO3,oP20,62 Pnma 0.7561,1.048,0.7255,90,90,90 perovskite family - 2.14 A 18588
Ca-Cl-Mo CaMo6Cl14 HgMo6Cl14 ,cP84,201 Pn-3 1.278,1.278,1.278,90,90,90 Chevrel phase - 3.54 A 19381
Ca-Cl-N Ca2NCl NaFeO2,hR12,166 R-3m 0.36661,0.36661,1.9711,90,90,120 rocksalt family white 2.81 X 20784
Ca-Cl-O Ca[ClO2]2 Pb[ClO2]2 ,oS28,68 Ccce 0.57434,1.26002,0.57405,90,90,90 - white 2.80 X 44278
Ca-Cl-O Ca4Cl6O Ba4Cl6O,hP22,186 P63 mc 0.9033,0.9033,0.68327,90,90,120 - colorless 2.68 X 51644
Ca-Cl-P Ca0.925P0.425 Cl0.575 rt NaCl,cF8,225 Fm-3m 0.58278,0.58278,0.58278,90,90,90 rocksalt family yellow 2.37 X 19165
Ca-Cl-P Ca3PCl3 Mg3NF3,cP7,221 Pm-3m 0.5683,0.5683,0.5683,90,90,90 rocksalt family colorless 2.33 X 19165
Ca-Cl-Rb RbCaCl3 *,c**,* - 1.065,1.065,1.065,90,90,90 - - - N 4899
Ca-Cl-Rb Rb3Ca2Cl7 Sr3Ti2O7,tI24,139 I4/mmm 0.5317,0.5317,2.659,90,90,90 Ruddlesden-Popper - 2.58 A 4899
Ca-Cl-Sr Sr0.54 Ca0.46 Cl2 SrI2,oP24,61 Pbca 0.6817,1.3421,0.7053,90,90,90 - - 2.81 X 21516
Ca-Cl-Sr Sr0.7 Ca0.3 Cl2 SrBr2,tP30,85 P4/n 1.0898,1.0898,0.6744,90,90,90 - - 2.99 X 21516
Ca-Cl-Sr Sr0.85 Ca0.15 Cl2 CaF2,cF12,225 Fm-3m 0.6939,0.6939,0.6939,90,90,90 fluorite family - 3.01 X 1025
Ca-Cl-Tc CaTcCl6 *,oP16,59 Pmmn 0.699,0.993,0.703,90,90,90 - golden - N 20668
Ca-Cl-Tl CaTlCl3 *,o*40,* - 1.048,1.054,1.118,90,90,90 - - - N 11907
Ca-Cl-V CaVCl6 *,cF*,* - 1.038,1.038,1.038,90,90,90 - violet light - N 11949
Ca-Cl-W CaW6Cl14 HgMo6Cl14 ,cP84,201 Pn-3 1.2854,1.2854,1.2854,90,90,90 Chevrel phase - 5.13 A 57377
Ca-Co-F CaCoF5 CrMnF5,mS28,15 C12/c1 0.892,0.6444,0.7522,90,115.62,90 - mauve 3.31 A 5827
Ca-Co-Ga CaCo2Ga3 EuCo2Ga3 ,oS24,63 Cmcm 0.9779,0.7844,0.5215,90,90,90 - - 6.10 A 19543
Ca-Co-Ge CaCo2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.399,0.399,1.0298,90,90,90 - - 6.14 X 31728
Ca-Co-N Ca3CoN3 mon *,mP*,* - 0.5933,0.5137,0.6308,90,104.9,90 - - - N 30680
Ca-Co-N Ca3CoN3 orth *,o**,* - 0.479,0.548,1.206,90,90,90 - - - N 30680
Ca-Co-N Ca5Co2N4 Ca5Co2N4 ,tP44,130 P4/ncc 0.80767,0.80767,1.21401,90,90,90 - black 3.14 X 49709
Ca-Co-O CaCo2O4 CaV2O4,oP28,62 Pnma 0.8789,0.29006,1.0282,90,90,90 - black 5.62 X 49023
Ca-Co-O Ca0.26 CoO2 *,m**,* - 0.4961,0.2805,0.5671,90,106.7,90 - - - N 34883
Ca-Co-O Ca0.35 CoO2 *,hP8,* - 0.2812,0.2812,1.0874,90,90,120 - - - N 34883
Ca-Co-O Ca0.38 CoO2 Na0.5 CoO2 ,hP10,194 P63 /mmc 0.2813,0.2813,1.0911,90,90,120 - - 4.72 A 49342
Ca-Co-O Ca0.47 CoO2 Ca0.47 CoO2,aP16,1 P1 0.4924,0.5683,0.5685,75.4,89.974,81.261 - gray silver 4.80 X 52660
Ca-Co-O Ca0.5 CoO2 *,mP*,* - 0.4881,0.2826,0.5654,90,105.86,90 - - - N 34883
Ca-Co-O Ca2Co2O5 Ca2(Fe0.5 Al0.5)2O5,oI36,46 Ima2 1.488,0.546,0.546,90,90,90 - - 4.16 X 53207
Ca-Co-O Ca2Co2.62 O6.24 ht Ca2Co2.62 O6.24,mS30,12 C12/m1 0.4839,0.4553,1.0858,90,98.12,90 - colorless 4.69 X 50018
Ca-Co-O Ca3Co2O6 Ca3Co2O6 ,hR66,167 R-3c 0.9085,0.9085,1.03888,90,90,120 - black 4.48 X 52952
Ca-Co-P CaCo2P2 CeAl2Ga2,tI10,139 I4/mmm 0.3858,0.3858,0.9593,90,90,90 - brown gray 5.11 X 13872
Ca-Co-P Ca2Co12P7 Zr2Fe12P 7,hP21,174 P-6 0.9073,0.9073,0.3585,90,90,120 - gray 6.52 X 39440
Ca-Co-Pb Ca5CoPb3 CuHf5Sn3,hP18,193 P63 /mcm 0.93547,0.93547,0.7006,90,90,120 AlB2 family - 5.51 A 41564
Ca-Co-Sb Ca0.1 Co4Sb12 LaFe4P 12,cI34,204 Im-3 0.90429,0.90429,0.90429,90,90,90 - - 7.64 X 43392
Ca-Co-Si CaCo2Si2 CeAl2Ga2,tI10,139 I4/mmm 0.39161,0.39161,0.99184,90,90,90 - - 4.68 X 55501
Ca-Co-Sn Ca3.5 Co4Sn12.5 Yb3Rh4Sn13,cP40,223 Pm-3n 0.95809,0.95809,0.95809,90,90,90 - gray silver 7.02 X 47530
Ca-Cr-F CaCrF5 CaCrF5,mS28,9 C1c1 0.9005,0.6472,0.7533,90,115.85,90 - green 3.15 X 6185
Ca-Cr-F CaCrF6 LiSbF6,hR24,148 R-3 0.5336,0.5336,1.4153,90,90,120 - rose 2.94 X 7049
Ca-Cr-N Ca2CrN3 Ca2CrN3,aP12,2 P-1 0.55565,0.57202,0.63282,72.619,68.012,63.969 - green dark 3.50 X 41431
Ca-Cr-N Ca3CrN3 Ca3CrN3,oS28,63 Cmcm 0.8503,1.0284,0.5032,90,90,90 - red 3.23 X 23378
Ca-Cr-O CaCrO3 GdFeO3,oP20,62 Pnma 0.53169,0.7486,0.52888,90,90,90 perovskite family black 4.42 X 57201
Ca-Cr-O CaCr2O4 ht SrCr2O4,oP28,59 Pmmn 0.58239,1.10579,0.50553,90,90,90 - - 4.25 X 57178
Ca-Cr-O CaCr2O4 rt CaV2O4,oP28,62 Pnma 0.90801,0.29681,1.06203,90,90,90 - - 4.83 X 55255
Ca-Cr-O Ca[CrO4] rt Zr[SiO4],tI24,141 I41/amd 0.7222,0.7222,0.6285,90,90,90 chromatite yellow 3.16 X 32697
Ca-Cr-O Ca5[CrO4]3 Ca5[CrO4]3,oP80,62 Pnma 0.6733,1.6097,1.0334,90,90,90 - - 3.25 X 26022
Ca-Cr-Pb Ca5CrPb3 CuHf5Sn3,hP18,193 P63 /mcm 0.93591,0.93591,0.7015,90,90,120 AlB2 family - 5.45 A 41564
Handbook of Inorganic Substances – Edition 2015 : Data 373

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-Cs-D CsCaD3 CaTiO3,cP5,221 Pm-3m 0.46093,0.46093,0.46093,90,90,90 perovskite family colorless 3.04 X 35791
Ca-Cs-D Cs2CaD4 K2NiF4,tI14,139 I4/mmm 0.45972,0.45972,1.5528,90,90,90 high-Tc family - 3.18 X 33737
Ca-Cs-F CsCaF3 CaTiO3,cP5,221 Pm-3m 0.4532,0.4532,0.4532,90,90,90 perovskite family - 4.10 X 20697
Ca-Cs-F Cs2CaF4 K2NiF4,tI14,139 I4/mmm 0.4495,0.4495,1.4907,90,90,90 high-Tc family - 4.21 X 31946
Ca-Cs-I CsCaI3 GdFeO3,oP20,62 Pnma 0.86226,1.22823,0.85548,90,90,90 perovskite family - 4.06 A 32489
Ca-Cs-N Cs7Ca4[N3]15 Cs7Ca4[N3]15,aP56,2 P-1 0.9338,1.0786,1.1684,92.59,107.86,113.69 - colorless 2.84 X 17668
Ca-Cu-F CaCuF4 KBrF4-b,tI24,140 I4/mcm 0.5377,0.5377,1.032,90,90,90 - blue light 4.00 X 5771
Ca-Cu-Ga CaCuGa KHg2,oI12,74 Imma 0.4439,0.7207,0.7623,90,90,90 AlB2 family - 4.72 X 21348
Ca-Cu-Ga CaCu0.1 Ga0.9 TlI,oS8,63 Cmcm 0.4176,1.1436,0.4398,90,90,90 CrB(TlI)-FeB - 3.45 X 19110
Ca-Cu-Ga CaCu0.15 Ga3.85 Ca(Cu0.04 Ga0.96)4,mS10,12 C12/m1 1.15741,0.42264,0.43571,90,110.499,90 - - 5.29 X 30513
Ca-Cu-Ga CaCu0.5 Ga3.5 BaAl4,tI10,139 I4/mmm 0.41883,0.41883,1.1033,90,90,90 - - 5.42 X 28831
Ca-Cu-Ga CaCu0.9 Ga0.1 orth1 FeB-b,oP8,62 Pnma 0.7797,0.4272,0.5894,90,90,90 CrB(TlI)-FeB - 3.53 A 19110
Ca-Cu-Ga CaCu0.925 Ga0.075 orth2 CaCu,oP40,62 Pnma 3.888,0.4271,0.589,90,90,90 CrB(TlI)-FeB - 3.53 A 19110
Ca-Cu-Ga CaCu0.95 Ga0.05 ht TbNi,oP24,62 Pnma 2.3347,0.4267,0.5885,90,90,90 CrB(TlI)-FeB - 3.53 A 19110
Ca-Cu-Ga CaCu0.975 Ga0.025 Ca(Cu0.98 Ga0.02),oP40,31 Pmn21 0.4269,3.887,0.5883,90,90,90 CrB(TlI)-FeB - 3.53 X 19110
Ca-Cu-Ga Ca2Cu2Ga Ca2Cu2Ga,oI10,71 Immm 0.4274,0.5484,0.8994,90,90,90 - - 4.36 X 21348
Ca-Cu-Ge CaCuGe AuYbGe,oP36,62 Pnma 2.1249,0.436,0.7494,90,90,90 - gray 5.06 X 35156
Ca-Cu-Ge CaCu0.1 Ge0.9 TlI,oS8,63 Cmcm 0.4561,1.0846,0.4018,90,90,90 CrB(TlI)-FeB - 3.74 A 19110
Ca-Cu-Ge CaCu0.67 Ge1.33 AlB2 ,hP3,191 P6/mmm 0.4156,0.4156,0.4345,90,90,120 AlB2 family - 4.58 X 4789
Ca-Cu-Ge CaCu0.967 Ge0.013 CaCu,mP20,11 P121/m1 0.5879,0.4273,1.9447,90,94.4,90 CrB(TlI)-FeB - 3.49 A 19110
Ca-Cu-Ge CaCu2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.41374,0.41374,1.0221,90,90,90 - - 5.93 X 31728
Ca-Cu-Hg Ca4Cu4.5 Hg4.5 Au6(Au0.5 In0.5 )6In,cP76,215 P-43m 1.094,1.094,1.094,90,90,90 γ-brass - 6.84 A 13877
Ca-Cu-In CaCuIn2 MgCuAl2,oS16,63 Cmcm 0.4442,1.068,0.7449,90,90,90 - - 6.26 X 27202
Ca-Cu-In CaCu0.5 In1.5 KHg2,oI12,74 Imma 0.4755,0.7511,0.8302,90,90,90 AlB2 family - 5.47 X 27202
Ca-Cu-In CaCu4In MgCu4Sn,cF24,216 F-43m 0.7338,0.7338,0.7338,90,90,90 Friauf-Laves phase - 6.88 X 25678
Ca-Cu-In CaCu6.5 In5.5 ThMn12,tI26,139 I4/mmm 0.9242,0.9242,0.5413,90,90,90 CaCu5-Zr4Al3 - 7.79 X 27202
Ca-Cu-In CaCu8.2 In2.8 Ce(Mn0.55 Ni0.45)11,tP24,127 P4/mbm 0.8637,0.8637,0.5188,90,90,90 - - 7.57 X 27202
Ca-Cu-Ni CaCu0.9 Ni0.1 TlI,oS8,63 Cmcm 0.4152,1.0927,0.4256,90,90,90 CrB(TlI)-FeB - 3.55 A 20215
Ca-Cu-O CaCuO2 ht-hp1 LaNiO2,tP4,123 P4/mmm 0.38555,0.38555,0.31798,90,90,90 high-Tc family - 4.76 X 33725
Ca-Cu-O CaCuO2 ht-hp2 CaCuO2,mP16,4 P1211 0.31501,1.07079,0.5415,90,90.886,90 - - 4.93 X 33481
Ca-Cu-O Ca0.87 Cu2.13 O2.93 ht Ca0.87 Cu2.13 O2.93 ,oP14,59 Pmmn 0.40789,0.9946,0.346,90,90,90 - - 5.14 X 39283
Ca-Cu-O Ca2CuO3 ht Sr2CuO3,oI12,71 Immm 0.3249,0.3768,1.2208,90,90,90 high-Tc family - 4.26 X 22610
Ca-Cu-O Ca4.78 Cu6O11.60 rt Ca4.8 Cu6O11.6 ,mP92,13 P12/c1 1.09456,0.63192,1.68408,90,104.952,90 - red 4.48 X 37622
Ca-Cu-P CaCuP BeZrSi,hP6,194 P63/mmc 0.4055,0.4055,0.7803,90,90,120 AlB2 family red ruby 4.02 X 12038
Ca-Cu-P CaCu1.75 P2 CeAl2Ga2,tI10,139 I4/mmm 0.4014,0.4014,0.9627,90,90,90 - gray silver 4.57 X 13872
Ca-Cu-P CaCu4P 2 rhom CaCu4P 2,hR21,166 R-3m 0.4036,0.4036,2.2272,90,90,120 - gray 5.65 X 13898
Ca-Cu-P CaCu4P 2 tet ZrFe 4Si2,tP14,136 P42/mnm 0.729,0.729,0.3831,90,90,90 - blue gray 5.81 X 20786
Ca-Cu-P Ca2Cu6P 5 Ca2Cu6P 5,tI26,139 I4/mmm 0.4015,0.4015,2.4657,90,90,90 - gray steel 5.15 X 24149
Ca-Cu-P Ca5Cu17.8P 12 Ho5Ni19P 12,hP36,189 P-62m 1.2792,1.2792,0.3957,90,90,120 - - 5.04 A 24585
Ca-Cu-Pb Ca5CuPb3 Ca5CuPb3,hP18,165 P-3c1 0.9413,0.9413,0.7052,90,90,120 - - 5.44 X 41564
Ca-Cu-Sb CaCuSb BeZrSi,hP6,194 P63/mmc 0.444,0.444,0.814,90,90,120 AlB2 family - 5.39 X 8677
Ca-Cu-Si CaCu0.25 Si1.6 AlB2 ,hP3,191 P6/mmm 0.39937,0.39937,0.43423,90,90,120 AlB2 family - 2.79 X 47274
Ca-Cu-Si CaCu2Si2 CeAl2Ga2,tI10,139 I4/mmm 0.404,0.404,1.,90,90,90 - - 4.54 X 5607
Ca-Cu-Sn CaCuSn AuYbSn,oI36,44 Imm2 0.4597,2.2027,0.7939,90,90,90 - - 5.51 X 49583
Ca-Cu-Sn CaCu0.83 Sn0.17 Ca(Ag0.20 Cu0.80),oP40,62 Pnma 3.8764,0.4268,0.5875,90,90,90 CrB(TlI)-FeB - 3.86 A 20215
Ca-Cu-Sn CaCu0.925 Sn0.075 *,o*64,* - 0.427,0.588,6.2,90,90,90 - - - N 20215
Ca-Cu-Sn CaCu2Sn2 CaCu2Sn2,mS10,12 C12/m1 1.0943,0.4222,0.4834,90,107.94,90 - - 6.32 X 49583
Ca-Cu-Sn CaCu9Sn4 Pr0.7 Co9Ge4,tI56,140 I4/mcm 0.863,0.863,1.2402,90,90,90 - - 7.82 X 49583
Ca-Cu-Sn Ca3Cu8Sn4 Lu3Co 7.77 Sn4,hP30,186 P63mc 0.9125,0.9125,0.7728,90,90,120 - - 6.58 X 49583
Ca-Cu-Sn Ca4Cu1.30 Sn3 Ca4Cu1.3 Sn3,tI48,140 I4/mcm 1.2659,1.2659,0.605,90,90,90 - - 4.10 X 45199
Ca-Cu-Sn Ca6Cu2Sn7 Ca6Cu2Sn7,mS30,12 C12/m1 1.4257,0.4564,1.2376,90,93.979,90 - gray silver 4.95 X 44745
Ca-Cu-Zn CaCu0.6 Zn0.4 FeB-b,oP8,62 Pnma 0.7912,0.4308,0.5977,90,90,90 CrB(TlI)-FeB - 3.40 X 18083
Ca-Cu-Zn CaCu0.80 Zn0.20 Ca(Cu0.80 Zn0.20),oP32,62 Pnma 3.1281,0.4284,0.5923,90,90,90 CrB(TlI)-FeB - 3.48 X 18083
Ca-Cu-Zn CaCu0.9 Zn0.1 TbNi,oP24,62 Pnma 2.3383,0.4277,0.5899,90,90,90 CrB(TlI)-FeB - 3.51 X 18083
Ca-Cu-Zn CaCu0.975 Zn0.025 CaCu,mP20,11 P121/m1 0.5884,0.4274,1.9462,90,94.35,90 CrB(TlI)-FeB - 3.53 A 18083
Ca-D-Fe Ca2FeD6 K2PtCl6,cF36,225 Fm-3m 0.704,0.704,0.704,90,90,90 fluorite family - 2.82 A 24873
Ca-D-Ir Ca2IrD5.04 K2PtCl6,cF36,225 Fm-3m 0.72479,0.72479,0.72479,90,90,90 fluorite family - 4.93 X 43077
Ca-D-Ir Ca2IrD5.12 Sr2IrH5,tI18,139 I4/mmm 0.50314,0.50314,0.74373,90,90,90 - - 4.99 X 43077
Ca-D-Mg Ca19 Mg8D54 Mg8 Yb19H54,cI162,204 Im-3 1.20642,1.20642,1.20642,90,90,90 - gray light 2.01 X 35922
Ca-D-Mg Ca4Mg3D14 Ca4Mg3H14,hP21,189 P-62m 0.62902,0.62902,0.6854,90,90,120 - - 1.85 X 26131
Ca-D-N Ca[ND2]2 ht TiO2 ,tI12,141 I41/amd 0.5146,0.5146,1.0298,90,90,90 - - 1.85 X 34736
Ca-D-N Ca[ND2]2 lt Ca[NH2]2,mP12,14 P121/c1 0.63451,0.72434,0.63,90,109.956,90 - - 1.86 X 36611
Ca-D-N Ca[ND2]2 rt TiO2 ,tI12,141 I41/amd 0.5139,0.5139,1.0298,90,90,90 - - 1.86 X 34736
Ca-D-N Ca[ND3]6 Eu[NH3]6,cI14,229 Im-3m 0.90137,0.90137,0.90137,90,90,90 - - 0.73 X 9138
Ca-D-N Ca2ND LiTiO2,cF64,227 Fd-3m 1.0138,1.0138,1.0138,90,90,90 rocksalt family black 2.45 X 30031
Ca-D-Na Na0.001Ca0.999 D2 PbCl2,oP12,62 Pnma 0.59456,0.35919,0.67992,90,90,90 - indigo pale 2.02 X 52702
Ca-D-Ni CaNiD3 CaTiO3,cP5,221 Pm-3m 0.35437,0.35437,0.35437,90,90,90 perovskite family - 3.91 X 45222
Ca-D-Ni CaNi5D0.3 CaNi5H0.3 ,hP15,191 P6/mmm 0.49947,0.49947,0.39596,90,90,120 - - 6.49 X 34600
Ca-D-Ni CaNi5D0.77 rt CaNi5H0.77 ,oP32,51 Pmma 0.78557,0.86033,0.5081,90,90,90 - - 6.48 X 18287
Ca-D-Ni CaNi5D0.9 m CaNi5H0.9 ,oI52,44 Imm2 0.7897,0.8645,0.5102,90,90,90 - - 6.40 X 34600
Ca-D-Ni CaNi5D4.8 m CaNi5H4.8 ,oI64,44 Imm2 0.8126,0.9257,0.5293,90,90,90 - - 5.73 X 34600
Ca-D-Ni CaNi5D6.1 LaNi5H7,hP15,157 P31m 0.5333,0.5333,0.4262,90,90,120 - - 5.47 X 34600
Ca-D-O Ca[OD]2 hp EuI2 ,mP12,14 P121/c1 0.53979,0.60931,0.59852,90,103.581,90 - - 2.64 X 33480
Ca-D-O Ca[OD]2 rt Mn[OH]2,hP3,164 P-3m1 0.35175,0.35175,0.46186,90,90,120 - white 2.55 X 49244
Ca-D-Os Ca2OsD6 K2PtCl6,cF36,225 Fm-3m 0.7256,0.7256,0.7256,90,90,90 fluorite family - 4.91 A 24873
Ca-D-Pd CaPdD2 cub CaTiO3,cP5,221 Pm-3m 0.3687,0.3687,0.3687,90,90,90 perovskite family - 4.99 X 23550
Ca-D-Pd CaPdD2.0 trig CaPdH2,hP12,144 P31 0.52113,0.52113,0.62758,90,90,120 - - 5.08 X 53938
Ca-D-Pd CaPdD2.4 CaPdH2.4 ,hP15,144 P31 0.5203,0.5203,0.6309,90,90,120 - - 5.10 X 53938
374 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-D-Rb RbCaD3 CaTiO3,cP5,221 Pm-3m 0.45323,0.45323,0.45323,90,90,90 perovskite family - 2.35 X 52785


Ca-D-Rb Rb2CaD4 K2NiF4,tI14,139 I4/mmm 0.44976,0.44976,1.48294,90,90,90 high-Tc family - 2.43 X 38890
Ca-D-Rh Ca2RhD5.4 K2PtCl6,cF36,225 Fm-3m 0.7254,0.7254,0.7254,90,90,90 fluorite family black 3.37 X 35138
Ca-D-Rh Ca4Rh3D12 Ca4Rh3H12 ,cI38,229 Im-3m 0.7283,0.7283,0.7283,90,90,90 - brass 4.24 X 35167
Ca-D-Rh Ca8Rh5D23 Sr8Rh5H23 ,cP37,221 Pm-3m 0.7271,0.7271,0.7271,90,90,90 - black 3.81 X 35138
Ca-D-Ru Ca2RuD6 K2PtCl6,cF36,225 Fm-3m 0.723,0.723,0.723,90,90,90 fluorite family - 3.40 X 50634
Ca-D-Si CaSiD CaSiH,oP36,62 Pnma 1.42091,0.38338,1.14678,90,90,90 - - 2.24 X 47374
Ca-D-Si CaSiD1.2 CaSiH1.2 ,oP40,62 Pnma 1.45685,0.38203,1.12092,90,90,90 - - 2.25 X 47374
Ca-D-Si Ca5Si3D0.53 Ca5Sn3H,tI36,140 I4/mcm 0.76394,0.76394,1.47935,90,90,90 - - 2.20 X 50118
Ca-D-Sn Ca5Sn3D Ca5Sn3H,tI36,140 I4/mcm 0.81453,0.81453,1.50703,90,90,90 - - 3.71 X 38642
Ca-Dy-F Ca0.22 Dy0.78 F2.78 HoH3,hP24,165 P-3c1 0.6817,0.6817,0.7001,90,90,120 - - 6.66 A 10184
Ca-Dy-F Ca0.8 Dy0.2 F2.2 (Ca0.68 Y0.32 )F2.32 ,cF92,225 Fm-3m 0.55115,0.55115,0.55115,90,90,90 fluorite family - 4.22 X 34921
Ca-Dy-O Ca0.05 Dy1.95 O3 (Mn0.5 Fe0.5 )2O3,cI80,206 Ia-3 1.0678,1.0678,1.0678,90,90,90 - - 8.01 A 7411
Ca-Dy-O Ca0.83 Dy0.12 O NaCl,cF8,225 Fm-3m 0.4806,0.4806,0.4806,90,90,90 rocksalt family - 4.11 X 7411
Ca-Dy-S CaDy2S4 ht Th3P 4,cI28,220 I-43d 0.8361,0.8361,0.8361,90,90,90 - - 5.61 A 24034
Ca-Dy-S Ca0.90 Dy0.08 S NaCl,cF8,225 Fm-3m 0.5683,0.5683,0.5683,90,90,90 rocksalt family - 2.94 X 24034
Ca-Dy-Te Ca0.5 DyTe 2 NaFeO2,hR12,166 R-3m 0.4363,0.4363,2.174,90,90,120 rocksalt family - 6.08 A 4504
Ca-Er-F Ca0.30 Er0.70 F2.70 HoH3,hP24,165 P-3c1 0.6761,0.6761,0.6952,90,90,120 - - 6.53 A 10184
Ca-Er-F Ca0.90 Er0.10 F2.10 CeH3,cF44,225 Fm-3m 0.5488,0.5488,0.5488,90,90,90 fluorite family - 3.73 A 8431
Ca-Er-F Ca10Er5F35 Ca9(Er0.83 Ca0.17)6F35,tI102,87 I4/m 0.86998,0.86998,1.666,90,90,90 - - 5.01 X 19586
Ca-Er-F Ca8Er5F31 *,cF*,* - 7.193,7.193,7.193,90,90,90 - - - N 8396
Ca-Er-O Ca0.1 Er1.9O2.95 Sm2O3,mS30,12 C12/m1 1.3806,0.3492,0.8582,90,100.77,90 - - 9.05 X 16667
Ca-Er-O Ca0.5 Er1.5O2.75 (Ca0.25 Er0.75)2O2.75 ,mS24,12 C12/m1 0.6524,0.3546,1.1754,90,92.32,90 - - 7.70 X 16668
Ca-Er-S CaEr2S4 ht Yb(Yb0.67 Mn0.33 )2S4,oS28,36 Cmc21 0.384,1.277,1.309,90,90,90 - - 5.20 A 3489
Ca-Er-S CaEr2S4 rt CaLu2S4,oP28,62 Pnma 1.2845,0.3862,1.3001,90,90,90 - brown 5.18 X 48813
Ca-Er-S Ca0.46 Er2.36 S4 ht Th3P 4,cI28,220 I-43d 0.8285,0.8285,0.8285,90,90,90 - - 6.32 A 44137
Ca-Er-S Ca0.59 Er0.28 S NaCl,cF8,225 Fm-3m 0.5625,0.5625,0.5625,90,90,90 rocksalt family - 3.83 X 44137
Ca-Er-Se Ca0.44 Er0.38 Se NaCl,cF8,225 Fm-3m 0.581,0.581,0.581,90,90,90 rocksalt family - 5.42 X 2577
Ca-Er-Se Ca0.5 ErSe2 NaFeO2,hR12,166 R-3m 0.40709,0.40709,2.04488,90,90,120 rocksalt family - 5.86 A 2577
Ca-Er-Te Ca0.33 Er0.44 Te NaCl,cF8,225 Fm-3m 0.7672,0.7672,0.7672,90,90,90 rocksalt family - 3.15 X 4504
Ca-Er-Te Ca0.5 ErTe 2 NaFeO2,hR12,166 R-3m 0.4326,0.4326,2.178,90,90,120 rocksalt family - 6.25 A 4504
Ca-Eu-F Ca0.67 Eu0.33 F2.33 CeH3,cF44,225 Fm-3m 0.55686,0.55686,0.55686,90,90,90 fluorite family - 4.66 A 14710
Ca-Eu-In Ca4Eu4In3 Ca8In3,aP22,2 P-1 0.9752,0.98728,0.9928,99.119,101.06,119.608 - black 4.74 X 55460
Ca-Eu-Ni Ca0.7 Eu0.3 Ni5 CaCu5,hP6,191 P6/mmm 0.4944,0.4944,0.3947,90,90,120 - - 7.30 X 18341
Ca-Eu-S Ca0.3 Eu0.7 S NaCl,cF8,225 Fm-3m 0.5936,0.5936,0.5936,90,90,90 rocksalt family - 4.78 X 59395
Ca-Eu-Si Ca0.5 Eu0.5 Si2 ThSi2,tI12,141 I41/amd 0.4295,0.4295,1.359,90,90,90 - - 4.03 A 11620
Ca-F-Fe CaFeF5 CaFeF5,mP28,14 P121/c1 0.5492,1.0076,0.7599,90,110.02,90 - colorless 3.21 X 42371
Ca-F-Ga CaGaF5 mon *,mP28,14 P121/c1 0.747,0.642,0.888,90,115.2,90 - - - N 5103
Ca-F-Ga CaGaF5 orth *,oS112,20 C222 1 0.7541,2.039,0.9981,90,90,90 - - - N 5103
Ca-F-Gd Ca0.2 Gd0.8 F2.8 rt Na3As,hP8,194 P63 /mmc 0.3955,0.3955,0.7055,90,90,120 - - 6.50 X 18532
Ca-F-Gd Ca0.88 Gd0.12 F2.12 Pb0.95 Th0.05 F2.1 ,cF76,225 Fm-3m 0.55,0.55,0.55,90,90,90 fluorite family - 3.77 X 37791
Ca-F-Ge Ca5Ge3F0.66 Ca5Sn3H,tI36,140 I4/mcm 0.77093,0.77093,1.4789,90,90,90 - - 3.25 X 39140
Ca-F-H CaF0.76 H1.24 CaF2,cF12,225 Fm-3m 0.5452,0.5452,0.5452,90,90,90 fluorite family - 2.29 X 11709
Ca-F-H H2CaF4 H2CaF4,oF40,70 Fddd 0.55709,1.01111,1.05945,90,90,90 - colorless 2.63 X 50937
Ca-F-Ho Ca0.23 Ho0.77 F2.77 HoH3,hP24,165 P-3c1 0.6789,0.6789,0.6975,90,90,120 - - 6.76 A 10184
Ca-F-Ho Ca0.65 Ho0.35 F2.35 Th0.1 Pb0.9F2.2,cF124,225 Fm-3m 0.5529,0.5529,0.5529,90,90,90 fluorite family - 5.05 X 31528
Ca-F-Ho Ca8Ho5F31 *,cF*,* - 7.205,7.205,7.205,90,90,90 - - - N 8396
Ca-F-In Ca0.93 In0.07 F2.07 CeH3,cF44,225 Fm-3m 0.5456,0.5456,0.5456,90,90,90 fluorite family - 3.46 A 5132
Ca-F-K KCaF3 ht1 GdFeO3,oP20,62 Pnma 0.62149,0.87636,0.61648,90,90,90 perovskite family - 2.69 X 45447
Ca-F-K KCaF3 ht2 CaTiO3,cP5,221 Pm-3m 0.44584,0.44584,0.44584,90,90,90 perovskite family - 2.55 X 45550
Ca-F-K KCaF3 lt KCaF3,mP20,11 P121/m1 0.61661,0.8765,0.6218,90,90.039,90 perovskite family - 2.69 X 33668
Ca-F-La Ca0.2 La0.8 F2.8 HoH3,hP24,165 P-3c1 0.7177,0.7177,0.7346,90,90,120 - - 5.24 A 50245
Ca-F-La Ca0.65 La0.35 F2.35 CeH3,cF44,225 Fm-3m 0.56452,0.56452,0.56452,90,90,90 fluorite family - 4.41 X 31530
Ca-F-Lu Ca0.68 Lu0.32 F2.32 CeH3,cF44,225 Fm-3m 0.5495,0.5495,0.5495,90,90,90 fluorite family - 5.10 A 3558
Ca-F-Lu Ca2LuF7 rt Ca2YbF7,tI100,87 I4/m 0.86633,0.86633,1.65252,90,90,90 - - 5.20 X 23711
Ca-F-Lu Ca8Lu5F31 *,cF*,* - 7.153,7.153,7.153,90,90,90 - - - N 8396
Ca-F-Mn CaMnF5 CrMnF5,mS28,15 C12/c1 0.8938,0.6369,0.783,90,116.23,90 - red 3.16 X 24161
Ca-F-Mn CaMnF6 LiSbF6,hR24,148 R-3 0.5216,0.5216,1.4175,90,90,120 - yellow 3.12 A 5590
Ca-F-Mn Ca0.3 Mn0.7 F2 *,t**,* - 0.33746,0.33746,0.5394,90,90,90 - - - N 18482
Ca-F-Mn Ca0.53 Mn0.47 F2 CaF2,cF12,225 Fm-3m 0.5372,0.5372,0.5372,90,90,90 fluorite family - 3.64 X 18482
Ca-F-N Ca2NF cub Sr2NF,cF72,227 Fd-3m 1.00215,1.00215,1.00215,90,90,90 - yellow 2.99 X 44208
Ca-F-N Ca2NF tet LiFeO2,tI16,141 I41/amd 0.49018,0.49018,1.0516,90,90,90 rocksalt family yellow 2.97 X 39155
Ca-F-Nd Ca0.05 Nd0.95 F2.95 HoH3,hP24,165 P-3c1 0.7016,0.7016,0.7191,90,90,120 - - 6.34 X 34928
Ca-F-Nd Ca0.65 Nd0.35 F2.35 CeH3,cF44,225 Fm-3m 0.56095,0.56095,0.56095,90,90,90 fluorite family - 4.56 X 34927
Ca-F-Np Ca0.5 Np0.5 F3 HoH3,hP24,165 P-3c1 0.6918,0.6918,0.71,90,90,120 - green grass 6.62 A 3629
Ca-F-Pb Ca0.5 Pb0.5 F3 CoAs3,cI32,204 Im-3 0.8476,0.8476,0.8476,90,90,90 - colorless 3.94 A 988
Ca-F-Pd CaPdF4 KBrF4-b,tI24,140 I4/mcm 0.5525,0.5525,1.0561,90,90,90 - purple 4.58 X 15299
Ca-F-Pd CaPdF6 LiSbF6,hR24,148 R-3 0.519,0.519,1.459,90,90,120 - yellow 3.81 X 4297
Ca-F-Pr Ca0.05Pr0.95 F2.95 HoH3,hP24,165 P-3c1 0.7067,0.7067,0.7234,90,90,120 - - 6.11 A 10184
Ca-F-Pr Ca0.9 Pr0.1 F2.1 rt CeH3,cF44,225 Fm-3m 0.55155,0.55155,0.55155,90,90,90 fluorite family - 3.57 X 31524
Ca-F-Pt CaPtF6 LiSbF6,hR24,148 R-3 0.5245,0.5245,1.4784,90,90,120 - yellow 4.94 X 9417
Ca-F-Pu Ca0.5 Pu0.5 F3 HoH3,hP24,165 P-3c1 0.6918,0.6918,0.7097,90,90,120 - brown red 6.74 A 3629
Ca-F-Rb RbCaF3 rt CaTiO3,cP5,221 Pm-3m 0.44497,0.44497,0.44497,90,90,90 perovskite family - 3.44 X 13616
Ca-F-Rh CaRhF6 LiSbF6,hR24,148 R-3 0.5267,0.5267,1.4612,90,90,120 - yellow 3.65 X 8619
Ca-F-Sc Ca0.894 Sc0.106 F2.106 Ca0.89 Sc0.11 F2.11 ,cF92,225 Fm-3m 0.54519,0.54519,0.54519,90,90,90 - - 3.30 X 52065
Ca-F-Si CaSiF6 LiSbF6,hR24,148 R-3 0.53497,0.53497,1.35831,90,90,120 - - 2.70 X 57114
Ca-F-Si Ca5Si3F0.42 Ca5Sn3H,tI36,140 I4/mcm 0.76354,0.76354,1.4829,90,90,90 - - 2.25 X 39140
Ca-F-Sm Ca0.08 Sm0.92 F2.92 HoH3,hP24,165 P-3c1 0.6938,0.6938,0.712,90,90,120 - - 6.61 A 10184
Handbook of Inorganic Substances – Edition 2015 : Data 375

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-F-Sm Ca0.67 Sm0.33 F2.33 rt *,cF*,225 Fm-3m 0.55741,0.55741,0.55741,90,90,90 fluorite family - - N 14710
Ca-F-Sn CaSnF6 lt LiSbF6,hR24,148 R-3 0.5776,0.5776,1.455,90,90,120 - - 3.23 X 16323
Ca-F-Sn CaSnF6 rt NaSbF6,cF32,225 Fm-3m 0.8341,0.8341,0.8341,90,90,90 - - 3.12 X 16323
Ca-F-Sn CaSn2F6 CaSn2F6,aP18,2 P-1 0.4419,0.7191,0.9834,98.72,101.94,92.65 - - 4.32 X 38582
Ca-F-Sn Ca5Sn3F0.9 Ca5Sn3H,tI36,140 I4/mcm 0.81331,0.81331,1.5175,90,90,90 - - 3.80 X 38642
Ca-F-Sr Sr0.554 Ca0.446 F2 CaF2 ,cF12,225 Fm-3m 0.5658,0.5658,0.5658,90,90,90 fluorite family - 3.83 X 53021
Ca-F-Ta CaTaF7 CaTaF7,mP108,14 P121/c1 1.3359,1.1608,0.9793,90,90.539,90 - colorless 4.65 X 49514
Ca-F-Tb CaTbF6 CaTbF6,tP16,84 P42/m 0.52696,0.52696,0.77105,90,90,90 - white 4.86 X 44368
Ca-F-Tb Ca0.19 Tb0.81 F2.81 HoH3,hP24,165 P-3c1 0.6838,0.6838,0.7028,90,90,120 - - 6.64 A 10184
Ca-F-Tb Ca0.95 Tb0.05 F2.05 rt CeH3,cF44,225 Fm-3m 0.549,0.549,0.549,90,90,90 fluorite family - 3.41 A 4257
Ca-F-Th Ca0.5 Th0.5 F3 HoH3,hP24,165 P-3c1 0.6994,0.6994,0.7171,90,90,120 - - 6.33 A 3629
Ca-F-Th Ca0.925 Th0.075 F2.15 Pb0.95 Th0.05 F2.1 ,cF76,225 Fm-3m 0.5521,0.5521,0.5521,90,90,90 - - 3.76 X 19245
Ca-F-Ti CaTiF5 CrMnF5,mS28,15 C12/c1 0.90695,0.6614,0.7696,90,115.019,90 - brown 2.91 X 17214
Ca-F-Ti CaTiF6 CaTiF6,hR24,166 R-3m 0.5771,0.5771,1.4136,90,90,120 - - 2.47 X 5534
Ca-F-Tm Ca0.30 Tm0.70 F2.70 HoH3,hP24,165 P-3c1 0.6752,0.6752,0.6928,90,90,120 - - 6.61 A 10184
Ca-F-Tm Ca0.67 Tm0.33 F2.33 ht CeH3,cF44,225 Fm-3m 0.5515,0.5515,0.5515,90,90,90 fluorite family - 5.02 A 3558
Ca-F-Tm Ca2TmF7 rt *,t*100,* - 0.86833,0.86833,1.6596,90,90,90 - - - N 14710
Ca-F-Tm Ca8Tm5F31 *,cF*,* - 7.177,7.177,7.177,90,90,90 - - - N 8396
Ca-F-U Ca0.5 U0.5 F3 Na3As,hP8,194 P63/mmc 0.3997,0.3997,0.7103,90,90,120 - green 6.63 X 3887
Ca-F-U Ca0.94 U0.06F2.06 Pb0.95 Th0.05 F2.1 ,cF76,225 Fm-3m 0.54983,0.54983,0.54983,90,90,90 - - 3.64 X 38872
Ca-F-V CaVF5 rt *,o*224,* - 0.7498,1.984,2.038,90,90,90 - - 3.26 N 4560
Ca-F-Y Ca0.255 Y0.745 F2.745 rt HoH3,hP24,165 P-3c1 0.6781,0.6781,0.6969,90,90,120 - - 4.62 A 36386
Ca-F-Y Ca0.68 Y0.32 F2.32 ht (Ca0.68 Y0.32 )F2.32 ,cF92,225 Fm-3m 0.5498,0.5498,0.5498,90,90,90 fluorite family - 3.99 X 6093
Ca-F-Y Ca14 Y5F43 Ca13 (Ca0.17 Y0.83)6F43 ,hR192,148 R-3 1.6692,1.6692,0.96664,90,90,120 tveitite-(Y) - 3.89 X 15381
Ca-F-Y Ca2YF7 rt tet *,t*100,* - 0.87109,0.87109,1.6661,90,90,90 - - - N 14710
Ca-F-Y Ca3Y7F27 ht *,m*74,* - 0.7971,0.6716,1.72859,90,96.212,90 - - 4.53 N 11730
Ca-F-Y Ca7.475 Y5.525 F31.525 rt *,hR138,* - 1.41561,1.41561,0.95794,90,90,120 - - 4.16 N 11730
Ca-F-Y Ca8Y5F31 *,cF29744,* - 7.196,7.196,7.196,90,90,90 - - 4.08 N 8396
Ca-F-Y Ca9Y5F33 rt rhom *,hR141,* - 1.02548,1.02548,1.9486,90,90,120 - - 4.02 N 11730
Ca-F-Yb Ca0.33 Yb0.67 F2.67 HoH3,hP24,165 P-3c1 0.6735,0.6735,0.6909,90,90,120 - - 6.60 A 10184
Ca-F-Yb Ca0.8 Yb0.2 F2.2 ht CaF2 ,cF12,225 Fm-3m 0.54815,0.54815,0.54815,90,90,90 fluorite family - 4.37 X 31530
Ca-F-Yb Ca17 Yb10F64 Ca15 (Ca0.17 Yb0.83)12F64,cP372,205 Pa-3 1.652,1.652,1.652,90,90,90 - - 5.34 X 19586
Ca-F-Yb Ca2YbF7 rt Ca2YbF7,tI110,87 I4/m 0.868,0.868,1.6567,90,90,90 - - 5.14 X 21146
Ca-F-Yb Ca8Yb5F31 *,cF*,* - 7.164,7.164,7.164,90,90,90 - - - N 8396
Ca-F-Zn CaZnF4 Ca[WO4],tI24,88 I41/a 0.5279,0.5279,1.1021,90,90,90 - colorless 3.92 X 16737
Ca-F-Zr CaZrF6 NaSbF6,cF32,225 Fm-3m 0.847,0.847,0.847,90,90,90 - white 2.68 A 5832
Ca-F-Zr Ca0.91 Zr0.09 F2.18 Th0.1 Pb0.9F2.2,cF124,225 Fm-3m 0.5467,0.5467,0.5467,90,90,90 fluorite family - 3.50 X 20684
Ca-F-Zr Ca5Zr3F22 Sr5Zr3F22,oP60,18 P21212 0.74059,0.99844,0.99046,90,90,90 - colorless 4.05 X 57610
Ca-Fe-H Ca2FeH6 K2PtCl6,cF36,225 Fm-3m 0.7056,0.7056,0.7056,90,90,90 fluorite family - 2.69 A 24873
Ca-Fe-N Ca2FeN2 Ca2FeN2,mS20,12 C12/m1 1.093,0.496,0.6844,90,121.09,90 - - 3.43 X 26973
Ca-Fe-N Ca6FeN5 Ca6GaN5,hP24,193 P63/mcm 0.6237,0.6237,1.2332,90,90,120 - black 2.93 X 24233
Ca-Fe-O CaFeO2 LaNiO2,tP4,123 P4/mmm 0.38908,0.38908,0.33543,90,90,90 high-Tc family - 4.18 X 50529
Ca-Fe-O CaFeO3 ht-hp CaTiO3,cP5,221 Pm-3m 0.377,0.377,0.377,90,90,90 perovskite family - 4.46 X 5476
Ca-Fe-O CaFeO3 lt HoNiO3,mP20,14 P121/c1 0.53205,0.53488,0.92267,90,125.265,90 perovskite family - 4.46 X 38092
Ca-Fe-O CaFeO3 rt GdFeO3,oP20,62 Pnma 0.53512,0.7539,0.53255,90,90,90 perovskite family - 4.45 X 38092
Ca-Fe-O CaFe 2O4 hp CaFe 2O4,oP84,62 Pnma 0.8376,0.8353,0.9551,90,90,90 - - 6.43 X 49959
Ca-Fe-O CaFe 2O4 CaV2O4,oP28,62 Pnma 0.8202,0.27726,0.95079,90,90,90 harmunite - 6.63 X 53791
Ca-Fe-O CaFe 3O5 CaFe 3O5,oS36,63 Cmcm 0.3021,1.0009,1.2643,90,90,90 - - 5.00 X 13493
Ca-Fe-O CaFe 4O6 CaFe 4O6,oS44,63 Cmcm 0.305,0.9986,1.5321,90,90,90 - - 5.12 X 13493
Ca-Fe-O CaFe 5O7 CaFe 5O7,oS52,63 Cmcm 0.3052,1.0041,1.7966,90,90,90 - - 5.20 X 13493
Ca-Fe-O CaFe 6O8 *,t**,* - 1.7139,1.7139,1.7286,90,90,90 - - - N 30125
Ca-Fe-O Ca2Fe 2O5 ht Sr2Fe2O5,oI44,74 Imma 0.54931,1.5038,0.56511,90,90,90 - brown 3.87 X 44382
Ca-Fe-O Ca2Fe 2O5 rt Ca2Fe2O5,oP36,62 Pnma 0.54268,1.47631,0.55969,90,90,90 srebrodolskite black 4.03 X 42685
Ca-Fe-O Ca2Fe 22O33 Ca2Fe22O33,hR171,155 R32 0.6028,0.6028,6.2224,90,90,120 - - 4.67 X 24094
Ca-Fe-O Ca2Fe 7O11 Ca2Fe7O11,mS40,12 C12/m1 0.996,0.303,1.41568,90,100.404,90 - - 5.11 X 14477
Ca-Fe-O Ca2Fe 9O13 Ca2Fe9O13,mS48,12 C12/m1 1.0022,0.3047,1.6877,90,99.2,90 - - 5.16 X 14477
Ca-Fe-O Ca2.95 Fe14.85 O25 Ca2.95 Fe14.85 O25,hP86,165 P-3c1 0.5986,0.5986,3.1388,90,90,120 - - 4.59 X 15999
Ca-Fe-O Ca3Fe 14.82 O25 Ca2(Ca0.06 Fe0.96)16O25 ,hP44,150 P321 0.5985,0.5985,1.5748,90,90,120 - - 4.58 X 20713
Ca-Fe-O Ca3Fe 14.82 O25 Ca2(Ca0.06 Fe0.96)16O25 ,hR258,155 R32 0.6011,0.6011,9.469,90,90,120 - - 4.53 X 20712
Ca-Fe-O Ca3.5 Fe14O24.5 Ca3.5 Fe14O24.5 ,mS172,5 C121 1.0409,0.6005,3.164,90,96.3,90 - red 4.44 X 19409
Ca-Fe-O Ca4Fe 9O17 Ca4Fe9O17,mS60,5 C121 1.0441,0.6025,1.1384,90,98.8,90 - - 4.39 X 15451
Ca-Fe-P CaFe 2P 2 CeAl2Ga2,tI10,139 I4/mmm 0.3855,0.3855,0.9985,90,90,90 - brown gray 4.78 X 13872
Ca-Fe-Pb Ca5FePb3 CuHf5Sn3,hP18,193 P63/mcm 0.93554,0.93554,0.7009,90,90,120 AlB2 family - 5.49 X 41564
Ca-Fe-Sb CaFe 4Sb12 LaFe 4P 12,cI34,204 Im-3 0.9154,0.9154,0.9154,90,90,90 - gray 7.47 X 29486
Ca-Fe-Si CaFe 2Si2 CeAl2Ga2,tI10,139 I4/mmm 0.3939,0.3939,1.0185,90,90,90 - - 4.37 X 59701
Ca-Ga-Ge CaGaGe YPtAs,hP12,194 P63/mmc 0.42203,0.42203,1.72876,90,90,120 AlB2 family gray 4.54 X 53230
Ca-Ga-In CaGa0.55 In0.45 Ca(Ga0.55 In0.45 ),mP24,14 P121/c1 0.9361,1.1881,0.6185,90,101.73,90 - - 3.85 X 52438
Ca-Ga-In CaGa0.84 In0.16 Ca(Ga0.84 In0.16 ),mP32,14 P121/c1 1.2229,1.1679,0.612,90,95.24,90 - - 3.57 X 52438
Ca-Ga-In CaGa1.5 In0.5 CaIn2,hP6,194 P63/mmc 0.4626,0.4626,0.7502,90,90,120 AlB2 family gray silver 4.83 X 49752
Ca-Ga-In Ca10.74 Ga4.56 In2.7 Ca11 Ga7,cF144,225 Fm-3m 1.6294,1.6294,1.6294,90,90,90 - - 3.25 X 50550
Ca-Ga-Ir Ca3Ir2Ga3 Ce3Rh3Si2,oP32,62 Pnma 0.8136,1.4796,0.5806,90,90,90 - gray light 6.78 X 31082
Ca-Ga-N CaGaN NbCrN,tP6,129 P4/nmm 0.357,0.357,0.7558,90,90,90 - golden 4.27 X 7957
Ca-Ga-N Ca3Ga2N4 mon Ca3Al2As4,mS36,15 C12/c1 1.06901,0.83655,0.55701,90,88.806,90 - colorless 4.21 X 33023
Ca-Ga-N Ca3Ga2N4 tet Ca3Ga2N4,tI176,142 I41/acd 1.121,1.121,1.5914,90,90,90 - colorless 4.19 X 34534
Ca-Ga-N Ca5Ga2N4 Ca5Ga2N4,oS44,64 Cmce 0.4873,1.1105,1.4217,90,90,90 - gray 3.42 X 22017
Ca-Ga-N Ca6GaN5 Ca6GaN5,hP24,193 P63/mcm 0.6277,0.6277,1.2198,90,90,120 - yellow 3.03 X 24233
Ca-Ga-N Ca7Ga1.33 N4 Ca7Ag1.36 N4,oP34,55 Pbam 1.1474,1.208,0.3636,90,90,90 - - 2.83 X 45902
Ca-Ga-Ni CaNiGa2 MgCuAl2,oS16,63 Cmcm 0.40578,1.03639,0.69592,90,90,90 - gray 5.41 X 57478
376 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-Ga-Ni CaNi2Ga3 EuCo2Ga3 ,oS24,63 Cmcm 0.9765,0.7885,0.5165,90,90,90 - - 6.12 X 19543


Ca-Ga-Ni Ca3Ni4Ga4 Na3Pt4Ge4 ,cI22,217 I-43m 0.741,0.741,0.741,90,90,90 - - 5.17 X 16014
Ca-Ga-O CaGa2O4 hp CaV2O4,oP28,62 Pnma 0.91248,0.29855,1.05609,90,90,90 - - 5.62 X 45703
Ca-Ga-O CaGa2O4 mon CaGa2O4,mP56,14 P121/c1 0.7992,0.883,1.0585,90,94.72,90 - colorless 4.35 X 7823
Ca-Ga-O CaGa2O4 orth CaGa2O4,oP56,33 Pna21 1.03496,0.77383,0.91267,90,90,90 - - 4.43 X 47113
Ca-Ga-O CaGa4O7 CaAl4O7,mS48,15 C12/c1 1.316,0.9119,0.5625,90,105.4,90 - - 4.40 A 14394
Ca-Ga-O Ca2Ga2O5 Ca2(Fe0.5 Al0.5)2O5,oI36,46 Ima2 1.46666,0.55651,0.53525,90,90,90 - - 4.56 X 39567
Ca-Ga-O Ca3Ga4O9 Ca3Ga4O9 ,oS96,35 Cmm2 1.4358,1.6825,0.5321,90,90,90 - colorless 4.21 X 14471
Ca-Ga-O Ca5Ga6O14 rt Ca5Al6O14 ,oS100,36 Cmc21 1.1495,1.127,1.0479,90,90,90 - - 4.12 X 21799
Ca-Ga-P CaGa2P 2 EuIn2P 2,hP10,194 P63 /mmc 0.38289,0.38289,1.6393,90,90,120 - - 3.85 X 56142
Ca-Ga-P Ca14GaP 11 Sr14GaAs11 ,tI216,142 I41/acd 1.5347,1.5347,2.0762,90,90,90 - - 2.64 X 31504
Ca-Ga-P Ca3Ga2P 4 Ca3Al2As4 ,mS36,15 C12/c1 1.2623,0.987,0.64435,90,88.95,90 - red 3.17 X 58898
Ca-Ga-Pb Ca10.90 Ga5.24 Pb1.86 Ca11Ga7,cF144,225 Fm-3m 1.6202,1.6202,1.6202,90,90,90 - - 3.71 X 50550
Ca-Ga-Pd CaPd0.4 Ga1.6 KHg2,oI12,74 Imma 0.4462,0.7231,0.7745,90,90,90 AlB2 family gray dark 5.16 X 29497
Ca-Ga-Pd CaPd0.5 Ga3.5 BaAl4,tI10,139 I4/mmm 0.42137,0.42137,1.10331,90,90,90 - - 5.72 X 28831
Ca-Ga-Pd Ca3Pd2Ga2 La3Ni2Ga2 ,oP28,57 Pbcm 0.5823,0.7898,1.3865,90,90,90 - gray silver 4.92 X 31082
Ca-Ga-Pt CaPtGa TiNiSi,oP12,62 Pnma 0.7184,0.4429,0.7595,90,90,90 AlB2 family gray dark 8.38 X 29497
Ca-Ga-Pt CaPt0.5 Ga3.5 BaAl4,tI10,139 I4/mmm 0.42285,0.42285,1.1034,90,90,90 - - 6.42 X 28831
Ca-Ga-Pt Ca3Pt2Ga2 La3Ni2Ga2 ,oP28,57 Pbcm 0.5792,0.7884,1.3728,90,90,90 - gray silver 6.89 X 31082
Ca-Ga-Rh Ca3Rh2Ga3 Ce3Rh3Si2 ,oP32,62 Pnma 0.8063,1.4851,0.5826,90,90,90 - - 5.10 X 31082
Ca-Ga-S CaGa2S4 mon CaGa2S4,mP56,14 P121/c1 0.7231,2.7069,0.6841,90,109.413,90 - colorless 3.24 X 57624
Ca-Ga-S CaGa2S4 orth1 SrAl2Se4,oS28,66 Cccm 0.597,1.003,1.022,90,90,90 - gray 3.34 A 32320
Ca-Ga-S CaGa2S4 orth2 EuGa2S4,oF224,70 Fddd 1.2133,2.009,2.0122,90,90,90 - ochre 3.33 X 16533
Ca-Ga-Sb Ca11GaSb9 Ca11InSb9,oI84,45 Iba2 1.1832,1.2505,1.6674,90,90,90 - gray silver 4.32 X 29954
Ca-Ga-Sb Ca5Ga2Sb6 Ca5Ga2As6,oP26,55 Pbam 1.2106,1.4021,0.4452,90,90,90 - - 4.70 X 18729
Ca-Ga-Se CaGa2Se4 EuGa2S4,oF224,70 Fddd 1.266,2.1,2.106,90,90,90 - pink 4.70 X 14709
Ca-Ga-Si CaGaSi AlB2,hP3,191 P6/mmm 0.4117,0.4117,0.4426,90,90,120 AlB2 family gray 3.52 X 23024
Ca-Ga-Si CaGa0.2 Si0.8 TlI,oS8,63 Cmcm 0.45266,1.079,0.39566,90,90,90 CrB(TlI)-FeB - 2.63 X 52438
Ca-Ga-Sn CaGaSn YPtAs,hP12,194 P63 /mmc 0.444,0.444,1.753,90,90,120 AlB2 family gray 5.07 A 23024
Ca-Ga-Sn CaGa0.41 Sn0.59 TlI,oS8,63 Cmcm 0.46526,1.1329,0.4333,90,90,90 CrB(TlI)-FeB - 4.03 X 52438
Ca-Ga-Sn Ca10.82 Ga4.4 Sn2.78 Ca11Ga7,cF144,225 Fm-3m 1.6177,1.6177,1.6177,90,90,90 - - 3.36 X 50550
Ca-Ga-Te CaGa6 Te10 CaGa6 Te10 ,hR105,155 R32 1.442,1.442,1.765,90,90,120 - - 5.44 X 24276
Ca-Gd-O CaGd4O7 CaGd(Gd0.3 O0.7)10,mS48,12 C12/m1 2.2934,0.36261,0.9126,90,107.81,90 - - 7.18 X 15996
Ca-Gd-S CaGd2S7 *,oP20,* - 0.311,0.786,1.372,90,90,90 - - 5.73 N 23444
Ca-Gd-S Ca0.6 Gd2.27 S4 ht Th3P 4,cI28,220 I-43d 0.8431,0.8431,0.8431,90,90,90 - - 5.64 A 59395
Ca-Gd-S Ca0.90 Gd0.08 S NaCl,cF8,225 Fm-3m 0.5684,0.5684,0.5684,90,90,90 rocksalt family - 2.92 X 24034
Ca-Ge-H Ca5Ge3H Ca5Sn3H,tI36,140 I4/mcm 0.77218,0.77218,1.466,90,90,90 - - 3.19 X 39140
Ca-Ge-In Ca4InGe4 Ca4InGe4,mS36,15 C12/c1 1.8452,0.5819,0.8339,90,99.33,90 - - 4.25 X 58034
Ca-Ge-Ir CaIr2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.415,0.415,1.0321,90,90,90 - - 10.64 X 22553
Ca-Ge-Ir Ca3Ir4Ge13 Yb3Rh4Sn13,cP40,223 Pm-3n 0.9055,0.9055,0.9055,90,90,90 - - 8.20 A 19379
Ca-Ge-La Ca3.37 La1.63 Ge4 Sc3Ce2Si4 ,oP36,62 Pnma 0.7669,1.5525,0.8084,90,90,90 - gray silver 4.50 X 44779
Ca-Ge-Li LiCaGe TiNiSi,oP12,62 Pnma 0.7469,0.4484,0.8539,90,90,90 AlB2 family - 2.78 X 29477
Ca-Ge-Li LiCaGe2 LiCaSi2,oP16,62 Pnma 0.807,0.393,1.077,90,90,90 - gray 3.74 X 6349
Ca-Ge-Li LiCa2Ge Cu2MnAl,cF16,225 Fm-3m 0.6988,0.6988,0.6988,90,90,90 b.c.c. family - 3.11 X 27350
Ca-Ge-Li LiCa2Ge3 LiCa2Si3,oP24,58 Pnnm 1.073,1.138,0.443,90,90,90 - - 3.74 X 6348
Ca-Ge-Li LiCa6Ge LiCa6Ge,cF32,225 Fm-3m 0.9419,0.9419,0.9419,90,90,90 - - 2.54 X 27351
Ca-Ge-Li Li0.13 Ca0.9 Ge1.97 (Li0.1 Ca0.9)(Li0.03 Ge0.97)2,hP6,186 P63 mc 0.398,0.398,1.019,90,90,120 - - 4.28 X 5612
Ca-Ge-Li Li2CaGe Li2AgSb,cF16,216 F-43m 0.704,0.704,0.704,90,90,90 b.c.c. family - 2.41 X 27350
Ca-Ge-Li Li3CaGe *,h**,* - 1.7313,1.7313,0.5248,90,90,120 - - - N 39409
Ca-Ge-Li Li3Ca3Ge4 *,t**,* - 1.1922,1.1922,0.764,90,90,90 - - - N 39409
Ca-Ge-Li Li4Ca5Ge11 *,t**,* - 0.5155,0.5155,1.3923,90,90,90 - - - N 39409
Ca-Ge-Mg CaMgGe TiNiSi,oP12,62 Pnma 0.762,0.442,0.834,90,90,90 AlB2 family gray silver 3.24 X 7050
Ca-Ge-Mn CaMnGe PbClF,tP6,129 P4/nmm 0.4226,0.4226,0.7179,90,90,90 - gray 4.34 X 35122
Ca-Ge-Mn CaMn2Ge 2 CeAl2Ga2,tI10,139 I4/mmm 0.41558,0.41558,1.0857,90,90,90 - - 5.23 X 31728
Ca-Ge-N CaGeN2 CaGeN2,tI16,122 I-42d 0.5426,0.5426,0.7154,90,90,90 - - 4.44 X 5819
Ca-Ge-N Ca2GeN2 Sr2GeN2,tP40,135 P42 /mbc 1.12004,1.12004,0.50482,90,90,90 - black 3.79 X 37194
Ca-Ge-N Ca3GeN CaTiO3,cP5,221 Pm-3m 0.47573,0.47573,0.47573,90,90,90 perovskite family - 3.19 X 26375
Ca-Ge-N Ca4GeN4 Ca4GeN4,mP36,14 P121/c1 0.92823,0.60429,1.11612,90,116.498,90 - - 3.43 X 37194
Ca-Ge-N Ca5Ge2N6 *,oP96,61 Pbca 0.52342,2.1561,1.3125,90,90,90 - - - N 37194
Ca-Ge-N Ca7GeN6 Ca7GeN6,oP56,60 Pbcn 1.0826,0.6194,1.3121,90,90,90 - yellow 3.30 X 50394
Ca-Ge-Ni CaNiGe MnAlGe,tP6,129 P4/nmm 0.41934,0.41934,0.66264,90,90,90 - - 4.88 X 51479
Ca-Ge-Ni CaNiGe2 CeNiSi2,oS16,63 Cmcm 0.42213,1.7375,0.40514,90,90,90 - - 5.45 X 46488
Ca-Ge-Ni CaNi2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.40749,0.40749,0.9987,90,90,90 - - 6.06 X 31728
Ca-Ge-Ni CaNi5Ge3 CaNi5Ge3 ,tP36,127 P4/mbm 0.80855,0.80855,0.78466,90,90,90 - gray 7.14 X 56141
Ca-Ge-Ni Ca15Ni68Ge37 Ca15Ni68Ge37,hP120,189 P-62m 2.2436,2.2436,0.39684,90,90,120 - gray 6.99 X 56141
Ca-Ge-Ni Ca2Ni3Ge2 Ca2Ni3Ge2 ,oP14,51 Pmma 0.9097,0.40138,0.7019,90,90,90 - gray 5.20 X 55421
Ca-Ge-Ni Ca4Ni4Ge3 Ca4Ni4Ge3 ,oS44,63 Cmcm 0.41824,1.0415,1.9864,90,90,90 - - 4.70 X 55467
Ca-Ge-Ni Ca5Ni17Ge 8 Ca5Ni17Ge8,oS60,38 Amm2 0.40255,2.5226,0.89861,90,90,90 - gray silver 6.47 X 59457
Ca-Ge-Ni Ca7Ni48.9 Ge22.1 Ca7Ni48.9 Ge22.1 ,hP91,191 P6/mmm 1.7381,1.7381,0.4046,90,90,120 - gray 7.46 X 56141
Ca-Ge-O CaGeO3 hp cub *,c*40,* - 0.7448,0.7448,0.7448,90,90,90 - - 5.17 N 4842
Ca-Ge-O CaGeO3 hp tet MnSiO3,tI160,88 I41/a 1.2535,1.2535,1.237,90,90,90 garnet family - 4.39 X 44361
Ca-Ge-O CaGeO3 orth GdFeO3,oP20,62 Pnma 0.52688,0.74452,0.52607,90,90,90 perovskite family - 5.17 X 15911
Ca-Ge-O CaGeO3 tricl CaSiO3-a,aP30,2 P-1 0.7269,0.7526,0.8094,103.44,94.42,90.11 - colorless 3.73 X 33868
Ca-Ge-O CaGe[GeO4]O rt CdGe[GeO4]O,aP16,2 P-1 0.54278,0.55181,0.68616,104.844,102.124,106.77 - - 4.87 X 43684
Ca-Ge-O CaGe2O5 hp DyMn2O5 ,oP32,55 Pbam 0.7306,0.8268,0.5714,90,90,90 - colorless 5.10 X 48043
Ca-Ge-O CaGe2O5 ht CaGe2O5,mS32,15 C12/c1 0.65699,0.88212,0.68845,90,112.955,90 - - 4.80 X 43684
Ca-Ge-O Ca2GeO4 hp K2NiF4,tI14,139 I4/mmm 0.37,0.37,1.188,90,90,90 high-Tc family - 4.43 X 5419
Ca-Ge-O Ca2Ge6[GeO4]O12 Ca2Ge6[GeO4]O12,oP50,32 Pba2 1.134,1.134,0.464,90,90,90 - colorless 4.70 X 12296
Handbook of Inorganic Substances – Edition 2015 : Data 377

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-Ge-O Ca2Ge 7O16 Ca2Ge7O16,tP50,117 P-4b2 1.13391,1.13391,0.46371,90,90,90 - colorless 4.70 X 47857


Ca-Ge-O Ca2[GeO4] ht Ca2[SiO4],hP14,186 P63mc 0.5517,0.5517,0.7164,90,90,120 - - 3.81 A 5621
Ca-Ge-O Ca2[GeO4] lt Mg2 [SiO4],oP28,62 Pnma 1.13919,0.678,0.52424,90,90,90 - white 3.56 X 50002
Ca-Ge-O Ca3GeO GdFeO3,oP20,62 Pnma 0.6688,0.9451,0.6681,90,90,90 perovskite family black 3.28 X 43978
Ca-Ge-O Ca3GeO5 hex *,hP*,186 P63mc 0.7223,0.7223,0.5681,90,90,120 - - - N 19457
Ca-Ge-O Ca3GeO5 ht Ca3[GeO4]O,mP72,11 P121/m1 0.9515,0.7196,1.19025,90,109.284,90 - - 3.53 X 19750
Ca-Ge-O Ca3GeO5 rhom1 *,hR216,160 R3m 0.7228,0.7228,6.742,90,90,120 - - - N 19457
Ca-Ge-O Ca3[GeO4]O rhom2 Ca3[GeO4]O,hR234,160 R3m 0.719,0.719,2.5243,90,90,120 - - 3.61 X 19750
Ca-Ge-O Ca3[GeO4]O rhom3 Ca3[GeO4]O,hR336,160 R3m 0.7228,0.7228,6.742,90,90,120 - - 3.56 X 17862
Ca-Ge-O Ca5Ge 3O11 mon *,m**,* - 1.0935,0.8707,1.105,90,96.86,90 - - - N 23241
Ca-Ge-O Ca5Ge 3O11 tricl Ca5Ge3O11,aP38,2 P-1 0.69502,0.69704,1.0998,85.327,84.558,77.519 - colorless 3.82 X 33868
Ca-Ge-P Ca3Ge 2P 4 Ca3Si2As4,mP36,14 P121/c1 0.7123,1.7459,0.7045,90,111.79,90 - - 3.18 X 15759
Ca-Ge-Pd CaPd2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.433,0.433,0.9989,90,90,90 - - 7.06 X 22553
Ca-Ge-Pt CaPtGe TiNiSi,oP12,62 Pnma 0.7169,0.4409,0.7438,90,90,90 AlB2 family gray silver 8.70 X 26080
Ca-Ge-Pt CaPtGe2 YIrGe 2,oI32,71 Immm 0.4412,0.884,1.601,90,90,90 - - 8.09 A 20165
Ca-Ge-Pt CaPt2Ge2 LaPt2Ge2,mP10,4 P1211 0.4376,0.4439,0.9628,90,91.85,90 - - 10.22 A 22355
Ca-Ge-Pt Ca10 Pt7Ge3 Ba10 Al3Ge7,hP40,193 P63/mcm 0.88059,0.88059,1.389,90,90,120 - black 7.06 X 58245
Ca-Ge-Pt Ca3Pt4.1Ge12.6 Ca3Pt4.1Ge12.6 ,cI320,199 I213 1.80578,1.80578,1.80578,90,90,90 - - 8.28 X 58072
Ca-Ge-Rh CaRh2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.4143,0.4143,1.0356,90,90,90 - - 7.31 X 22553
Ca-Ge-Rh Ca3Rh4Ge13 Yb3Rh4Sn13,cP40,223 Pm-3n 0.9025,0.9025,0.9025,90,90,90 - - 6.67 A 19379
Ca-Ge-Ru CaRu2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.4252,0.4252,0.9993,90,90,90 - - 7.12 X 22553
Ca-Ge-S Ca2GeS4 Mg2 [SiO4],oP28,62 Pnma 1.3607,0.8184,0.63,90,90,90 - - 2.66 X 5148
Ca-Ge-Sn CaSn0.52 Ge1.48 KSnAs,hP6,186 P63mc 0.4117,0.4117,1.03,90,90,120 - - 4.60 X 27798
Ca-Ge-Sr SrCaGe TiNiSi,oP12,62 Pnma 0.8124,0.4949,0.9184,90,90,90 AlB2 family gray silver 3.60 X 47122
Ca-Ge-Zn CaZnGe BeZrSi,hP6,194 P63/mmc 0.4298,0.4298,0.8197,90,90,120 AlB2 family - 4.51 X 20687
Ca-Ge-Zn CaZn2Ge2 CeAl2Ga2,tI10,139 I4/mmm 0.421,0.421,1.085,90,90,90 - - 5.46 X 5607
Ca-H-I CaIH PbClF,tP6,129 P4/nmm 0.4071,0.4071,0.8941,90,90,90 - colorless 3.77 X 821
Ca-H-Ir Ca2IrH5 K2PtCl6,cF36,225 Fm-3m 0.72476,0.72476,0.72476,90,90,90 fluorite family brown 4.84 A 56285
Ca-H-La Ca0.61 La0.39 H1.84 CaF2 ,cF12,225 Fm-3m 0.5619,0.5619,0.5619,90,90,90 fluorite family - 3.01 X 3070
Ca-H-Mg Ca19 Mg8H54 Mg8 Yb19H54,cI162,204 Im-3 1.21457,1.21457,1.21457,90,90,90 - gray light 1.87 A 35922
Ca-H-Mg Ca4Mg3H14 Ca4Mg3H14,hP21,189 P-62m 0.63056,0.63056,0.6882,90,90,120 - - 1.73 A 26131
Ca-H-N Ca[NH] NaCl,cF8,225 Fm-3m 0.5143,0.5143,0.5143,90,90,90 rocksalt family yellow 2.69 X 32437
Ca-H-N Ca[NH2]2 TiO2 ,tI12,141 I41/amd 0.5147,0.5147,1.0294,90,90,90 - - 1.76 X 2036
Ca-H-N Ca[NH3]6 rt Eu[NH3]6,cI14,229 Im-3m 0.92,0.92,0.92,90,90,90 - - 0.61 A 5418
Ca-H-N Ca2NH Ca2NH,cF160,227 Fd-3m 1.013,1.013,1.013,90,90,90 - yellow 2.43 X 9970
Ca-H-Ni CaNiH3 CaTiO3,cP5,221 Pm-3m 0.3553,0.3553,0.3553,90,90,90 perovskite family - 3.77 X 47441
Ca-H-Ni CaNi2H3.44 MgCu2,cF24,227 Fd-3m 0.77,0.77,0.77,90,90,90 Friauf-Laves phase - 4.68 F 13569
Ca-H-Ni CaNi3H4.5 PuNi3,hR36,166 R-3m 0.5444,0.5444,2.656,90,90,120 Laves-CaCu5 - 4.84 F 37340
Ca-H-Ni CaNi5H *,oI24,44 Imm2 0.78395,0.86044,0.50965,90,90,90 - - - P 17314
Ca-H-Ni CaNi5H4.5 CaCu5,hP6,191 P6/mmm 0.5305,0.5305,0.4009,90,90,120 - - 5.75 F 13569
Ca-H-O Ca[OH]2 Mn[OH]2,hP3,164 P-3m1 0.35966,0.35966,0.49278,90,90,120 portlandite - 2.23 X 20345
Ca-H-O Ca[O2][H2O]8 Ca[O2][H2O]8,tP22,124 P4/mcc 0.6197,0.6197,1.0967,90,90,90 - - 1.70 X 45889
Ca-H-Os Ca2OsH6 K2PtCl6,cF36,225 Fm-3m 0.72513,0.72513,0.72513,90,90,90 fluorite family - 4.82 A 24873
Ca-H-Pb Ca3PbH2 Ca3SnH2,oS24,63 Cmcm 0.8937,1.147,0.52551,90,90,90 - - 4.06 X 33040
Ca-H-Pd CaPdH2 CaTiO3,cP5,221 Pm-3m 0.369,0.369,0.369,90,90,90 perovskite family - 4.91 X 23550
Ca-H-Pd CaPdH2.1 CaPdH2.4 ,hP15,144 P31 0.5255,0.5255,0.633,90,90,120 - - 4.89 A 59029
Ca-H-Pd CaPd3H TiNi3,hP16,194 P63/mmc 0.58617,0.58617,0.97793,90,90,120 - gray dark 8.22 P 37866
Ca-H-Rb RbCaH3 CaTiO3,cP5,221 Pm-3m 0.4547,0.4547,0.4547,90,90,90 perovskite family - 2.27 X 21098
Ca-H-Rb Rb2CaH4 K2NiF4,tI14,139 I4/mmm 0.4507,0.4507,1.4863,90,90,90 high-Tc family - 2.37 X 21098
Ca-H-Rh Ca2RhH5 *,cF12,225 Fm-3m 0.7248,0.7248,0.7248,90,90,90 fluorite family - - P 35138
Ca-H-Rh Ca4Rh3H12 Ca4Rh3H12,cI38,229 Im-3m 0.7296,0.7296,0.7296,90,90,90 - brass 4.11 A 35167
Ca-H-Rh Ca8Rh5H23 Sr8Rh5H23,cP37,221 Pm-3m 0.7277,0.7277,0.7277,90,90,90 - black 3.70 A 35167
Ca-H-Ru Ca2RuH6 K2PtCl6,cF36,225 Fm-3m 0.724,0.724,0.724,90,90,90 fluorite family - 3.28 A 6120
Ca-H-Sb Ca5Sb3H0.5 *,oP*,62 Pnma 1.2522,0.9561,0.8298,90,90,90 - - - N 34418
Ca-H-Si CaSiH1.06 *,oP24,62 Pnma 1.44884,0.38247,1.12509,90,90,90 - - 2.21 P 53429
Ca-H-Sn Ca3SnH2 Ca3SnH2,oS24,63 Cmcm 0.8866,1.1371,0.522,90,90,90 - - 3.04 X 33040
Ca-H-Sn Ca5Sn3H Ca5Sn3H,tI36,140 I4/mcm 0.81433,0.81433,1.5096,90,90,90 - - 3.70 X 38642
Ca-Hf-O CaHfO3 ht1 *,hR30,* - 0.58404,0.58404,1.4113,90,90,120 perovskite family - - N 25310
Ca-Hf-O CaHfO3 ht2 GdFeO3,oP20,62 Pnma 0.57311,0.7981,0.557,90,90,90 perovskite family white 6.95 A 50549
Ca-Hf-O CaHfO3 ht3 BaTiO3,tP5,99 P4mm 0.4085,0.4085,0.4044,90,90,90 perovskite family - 6.56 A 25310
Ca-Hf-O CaHfO3 ht4 BaTiO3,tP5,99 P4mm 0.40496,0.40496,0.4095,90,90,90 perovskite family - 6.59 A 25310
Ca-Hf-O CaHfO3 ht5 CaTiO3,cP5,221 Pm-3m 0.4091,0.4091,0.4091,90,90,90 perovskite family - 6.47 X 25310
Ca-Hf-O CaHfO3 rt *,m**,* - 0.7998,0.9038,0.8001,90,91.52,90 perovskite family - - N 25310
Ca-Hf-O CaHf4O9 CaZr4O9,mS224,15 C12/c1 1.7698,1.45,1.2021,90,119.468,90 - - 8.88 A 8459
Ca-Hf-O Ca0.165 Hf0.835 O1.835 ht CaF2 ,cF12,225 Fm-3m 0.51,0.51,0.51,90,90,90 fluorite family - 9.26 X 31690
Ca-Hf-O Ca2Hf7O16 Ca2Hf7O16,hR75,148 R-3 0.63294,0.63294,2.6396,90,90,120 fluorite family - 8.63 X 9158
Ca-Hf-O Ca6Hf19O44 Ca6Hf19O44,hR414,167 R-3c 1.82435,1.82435,1.76125,90,90,120 fluorite family - 8.51 X 9168
Ca-Hf-S CaHfS3 GdFeO3,oP20,62 Pnma 0.6983,0.9537,0.6518,90,90,90 perovskite family - 4.82 A 13008
Ca-Hg-Li Li6Ca17Hg9 Li6Ca17Hg9,cI128,229 Im-3m 1.5601,1.5601,1.5601,90,90,90 - - 4.42 X 51932
Ca-Hg-O CaHgO2 CuFeO2,hR12,166 R-3m 0.35911,0.35911,1.8673,90,90,120 - - 6.51 X 30836
Ca-Hg-Pb CaHgPb BeZrSi,hP6,194 P63/mmc 0.4909,0.4909,0.7367,90,90,120 AlB2 family - 9.67 X 27411
Ca-Hg-Sn CaHgSn LiGaGe,hP6,186 P63mc 0.4796,0.4796,0.7771,90,90,120 AlB2 family - 7.71 X 20687
Ca-Hg-Sn CaHg1.3 Sn0.7 Hg2U,hP3,191 P6/mmm 0.485,0.485,0.37,90,90,120 AlB2 family - 8.46 X 27411
Ca-Hg-Zn Ca4Zn4.5 Hg4.5 Au6(Au0.5 In0.5 )6In,cP76,215 P-43m 1.1,1.1,1.1,90,90,90 γ-brass - 6.77 A 13877
Ca-Ho-O CaHoO2.5 CaHoO2.5 ,mP10,11 P121/m1 0.5894,0.3567,0.6566,90,92.3,90 - - 5.90 X 11114
Ca-Ho-O Ca0.07 Ho1.86 O2.86 Sm2 O3,mS30,12 C12/m1 1.3901,0.3502,0.8606,90,100.4,90 - - 8.59 X 11114
Ca-Ho-S CaHo 2S4 ht Th3P 4,cI28,220 I-43d 0.8363,0.8363,0.8363,90,90,90 - - 5.66 A 3489
Ca-Ho-S CaHo 2S4 rt CaLu2S4,oP28,62 Pnma 1.29,0.386,1.304,90,90,90 - - 5.10 A 3489
378 Handbook of Inorganic Substances – Edition 2015 : Data

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-Ho-Se Ca0.5 HoSe 2 NaFeO2,hR12,166 R-3m 0.4089,0.4089,2.04785,90,90,120 rocksalt family - 5.76 A 2577
Ca-Ho-Te Ca0.5 HoTe 2 NaFeO2,hR12,166 R-3m 0.4348,0.4348,2.178,90,90,120 rocksalt family - 6.15 A 4504
Ca-I-In CaInI3 UFeS3,oS20,63 Cmcm 0.45466,1.49756,1.16268,90,90,90 - - 4.49 A 32489
Ca-I-K KCaI3 UFeS3,oS20,63 Cmcm 0.4561,1.50862,1.16393,90,90,90 - - 3.81 A 32489
Ca-I-N Ca2IN hex1 Cr2AlC,hP8,194 P63 /mmc 0.38095,0.38095,1.453,90,90,120 - brown light 4.02 X 21924
Ca-I-N Ca2IN hex2 Li0.67 NbS2 ,hP8,194 P63 /mmc 0.38053,0.38053,1.45527,90,90,120 - yellow 4.02 X 45148
Ca-I-O Ca[IO3]2 Ca[IO3]2,mP36,14 P121/c1 0.71432,1.12969,0.86458,90,126.097,90 lautarite white 4.59 X 11337
Ca-I-P Ca2PI NaFeO2,hR12,166 R-3m 0.431,0.431,2.219,90,90,120 rocksalt family yellow 3.32 X 21924
Ca-I-P Ca3PI3 Ca3PI3,cI56,214 I4132 1.2315,1.2315,1.2315,90,90,90 - colorless 3.78 X 8090
Ca-I-Rb RbCaI3 [NH4]CdCl3,oP20,62 Pnma 1.04017,0.46586,1.71731,90,90,90 - - 4.04 A 32489
Ca-I-Sb Ca2SbI NaFeO2,hR12,166 R-3m 0.45081,0.45081,2.20906,90,90,120 rocksalt family - 4.21 A 8090
Ca-I-Sb Ca3SbI3 Ca3PI3,cI56,214 I4132 1.276,1.276,1.276,90,90,90 - yellow 3.98 A 7331
Ca-I-Th CaThI6 rt NaSb([OH]0.33 F0.67)6,hP16,163 P-31c 0.76977,0.76977,1.3959,90,90,120 - - 4.79 A 28165
Ca-I-Th Ca0.5 Th0.5 I3 hp Th0.5 Pb0.5I3,oS20,63 Cmcm 0.4278,1.402,1.01,90,90,90 - - 5.67 A 28165
Ca-I-Tl CaTlI3 UFeS3,oS20,63 Cmcm 0.45448,1.49652,1.16169,90,90,90 - - 5.26 A 32489
Ca-I-U CaUI6 NaSb([OH]0.33 F0.67)6,hP16,163 P-31c 0.761,0.761,1.3838,90,90,120 - - 4.97 A 28165
Ca-In-Ir CaIrIn2 CaRhIn2,oP32,62 Pnma 1.5887,0.7808,0.574,90,90,90 - gray light 8.62 X 38217
Ca-In-Ir CaIrIn4 LaCoAl4,oP12,51 Pmma 0.8695,0.42411,0.7464,90,90,90 - gray light 8.34 X 37008
Ca-In-Li Li5Ca18In25.07 Li5Ca18In25.07 ,oS106,65 Cmmm 0.99151,2.6432,1.02116,90,90,90 - black 4.51 X 42970
Ca-In-N Ca19In8N7 K19Pb8O4[OH]3,cF136,225 Fm-3m 1.47252,1.47252,1.47252,90,90,90 - - 3.70 X 45668
Ca-In-N Ca2InN Ca2AuN,oS16,63 Cmcm 0.3532,2.0204,0.4969,90,90,90 - red dark 3.91 X 41661
Ca-In-N Ca4In2N Ca4In2N,tI28,141 I41/amd 0.4915,0.4915,2.9102,90,90,90 - gray 3.82 X 20927
Ca-In-N Ca7In1.02 N4 Ca7Ag1.36 N4,oP34,55 Pbam 1.1681,1.2129,0.3643,90,90,90 - - 2.92 X 45902
Ca-In-Ni CaNiIn2 MgCuAl2,oS16,63 Cmcm 0.4314,1.049,0.7651,90,90,90 - - 6.30 A 20011
Ca-In-Ni CaNiIn4 YNiAl4,oS24,63 Cmcm 0.4401,1.6549,0.7294,90,90,90 - - 6.98 X 27202
Ca-In-Ni Ca3Ni8In4 Lu3Co7.77 Sn4,hP30,186 P63 mc 0.8989,0.8989,0.7522,90,90,120 - gray light 6.62 X 39173
Ca-In-O CaIn2O4 CaMn2O4,oP28,57 Pbcm 0.321,1.13,0.965,90,90,90 - - 6.33 A 2266
Ca-In-O Ca3In2O6 Ca(Ca0.5 In0.5 )4O6,oP44,55 Pbam 1.0908,1.645,0.3228,90,90,90 - - 5.11 X 7806
Ca-In-P CaIn2P 2 EuIn2P 2,hP10,194 P63 /mmc 0.4022,0.4022,1.7408,90,90,120 - black 4.52 X 51703
Ca-In-P Ca3InP 3 Ca3AlAs3,oP28,62 Pnma 1.2019,0.4138,1.346,90,90,90 - - 3.25 X 18707
Ca-In-Pd CaPdIn TiNiSi,oP12,62 Pnma 0.7302,0.4343,0.8489,90,90,90 AlB2 family - 6.45 A 18064
Ca-In-Pd CaPdIn2 MgCuAl2,oS16,63 Cmcm 0.44435,1.038,0.78132,90,90,90 - gray light 6.93 X 36671
Ca-In-Pd CaPdIn4 YNiAl4,oS24,63 Cmcm 0.4467,1.665,0.7543,90,90,90 - gray light 7.17 X 37008
Ca-In-Pd Ca2Pd2In Ca2Ir2Si,mS20,15 C12/c1 1.0176,0.5741,0.8127,90,104.54,90 - - 5.89 X 49626
Ca-In-Pt CaPtIn TiNiSi,oP12,62 Pnma 0.728,0.4372,0.8356,90,90,90 AlB2 family gray dark 8.74 X 29497
Ca-In-Pt CaPtIn2 MgCuAl2,oS16,63 Cmcm 0.43965,1.0438,0.78122,90,90,90 - gray light 8.61 X 36671
Ca-In-Pt Ca2Pt2In Ca2Ir2Si,mS20,15 C12/c1 1.0043,0.5689,0.8131,90,104.25,90 - - 8.63 X 49626
Ca-In-Rh CaRhIn TiNiSi,oP12,62 Pnma 0.73,0.4331,0.8288,90,90,90 AlB2 family gray light 6.54 X 38217
Ca-In-Rh CaRhIn2 CaRhIn2,oP32,62 Pnma 1.5862,0.7814,0.5709,90,90,90 - gray light 7.00 X 38217
Ca-In-Rh CaRhIn4 LaCoAl4,oP12,51 Pmma 0.8676,0.42291,0.7452,90,90,90 - gray light 7.32 X 37008
Ca-In-Rh Ca3Rh4In12 Gd3Ru4Al12,hP38,194 P63 /mmc 0.9445,0.9445,1.0427,90,90,120 - - 7.87 X 40745
Ca-In-S CaIn2S4 MgAl2O4,cF56,227 Fd-3m 1.0774,1.0774,1.0774,90,90,90 spinel family colorless 4.23 X 353
Ca-In-S Ca0.24 In1.76 S2.88 In2S3,tI80,141 I41/amd 0.7634,0.7634,3.2352,90,90,90 - - 4.28 A 41109
Ca-In-S Ca0.76 In2.84 S5 Ca0.76 In2.84 S5,oP36,55 Pbam 1.2619,1.5988,0.3843,90,90,90 - orange red 4.43 X 25644
Ca-In-S Ca3.1 In6.6 S13 Ca3.1 In6.6 S13,mS92,12 C12/m1 3.763,0.38358,1.37129,90,91.65,90 - yellow 4.36 X 6831
Ca-In-Sb Ca11InSb9 Ca11InSb9,oI84,45 Iba2 1.1894,1.2594,1.673,90,90,90 - gray silver 4.38 X 18740
Ca-In-Sb Ca5In2Sb6 Ca5Ga2As6,oP26,55 Pbam 1.2133,1.4256,0.4572,90,90,90 - - 4.87 X 18729
Ca-In-Se CaIn2Se4 *,oP28,18 P21212 1.286,1.304,0.39,90,90,90 - black - N 21771
Ca-In-Te Ca0.25 In0.5 Te TlSe,tI16,140 I4/mcm 0.842,0.842,0.714,90,90,90 - gray 5.12 X 14709
Ca-In-Tl CaTl0.5 In0.5 CsCl,cP2,221 Pm-3m 0.38504,0.38504,0.38504,90,90,90 b.c.c. family - 5.81 X 8685
Ca-Ir-O CaIrO3 hex *,h*25,* - 0.5441,0.5441,0.6392,90,90,120 - - - N 2830
Ca-Ir-O CaIrO3 ht GdFeO3,oP20,62 Pnma 0.55929,0.76769,0.53505,90,90,90 perovskite family - 8.10 X 57132
Ca-Ir-O CaIrO3 rt orth1 UFeS3,oS20,63 Cmcm 0.31444,0.9862,0.72969,90,90,90 - black 8.23 X 53521
Ca-Ir-O CaIrO3 rt orth2 NaMgF3,oS20,36 Cmc21 0.3101,0.96588,0.72111,90,90,90 - - 8.62 X 48034
Ca-Ir-O Ca2Ir2O7 Ca2Nb2O7 ,cF88,227 Fd-3m 1.023,1.023,1.023,90,90,90 pyrochlore family black 7.15 A 8428
Ca-Ir-O Ca4IrO6 K4CdCl6,hR66,167 R-3c 0.9303,0.9303,1.10864,90,90,120 - black 5.38 X 38379
Ca-Ir-O Ca4.74 Ir3O12 Ca4.74 Ir3O12,hP20,189 P-62m 0.94235,0.94235,0.31945,90,90,120 - - 6.48 X 27855
Ca-Ir-P CaIr2P 2 EuIr2P 2,hP15,152 P3121 0.661,0.661,0.7031,90,90,120 - gray 9.11 X 40853
Ca-Ir-P Ca2Ir12P7 Zr2Rh12P 7 ,hP22,176 P63 /m 0.9512,0.9512,0.3923,90,90,120 - gray 14.07 X 40964
Ca-Ir-P Ca4Ir8P 7 Ca4Ir8P 7,mP38,11 P121/m1 1.256,0.3945,1.3042,90,98.81,90 - gray silver 9.96 X 43983
Ca-Ir-P Ca5Ir19P12 Ho5Ni19P 12 ,hP36,189 P-62m 1.2577,1.2577,0.3954,90,90,120 - gray 12.95 X 40964
Ca-Ir-Si CaIrSi3 BaNiSn3,tI10,107 I4mm 0.41833,0.41833,0.98728,90,90,90 - - 6.09 X 57127
Ca-Ir-Si CaIr3Si7 ScRh3Si7,hR66,167 R-3c 0.75782,0.75782,2.00091,90,90,120 - - 8.14 X 57127
Ca-Ir-Si Ca2Ir2Si Ca2Ir2Si,mS20,15 C12/c1 0.96567,0.58252,0.73019,90,100.212,90 - - 8.10 X 40888
Ca-Ir-Si Ca3Ir4Si4 Na3Pt4Ge4 ,cI22,217 I-43m 0.74171,0.74171,0.74171,90,90,90 - - 8.15 X 40888
Ca-Ir-Sn CaIrSn2 MgCuAl2,oS16,63 Cmcm 0.4295,1.0795,0.7586,90,90,90 - gray dark 8.87 X 36789
Ca-Ir-Sn Ca3Ir4Sn13 Yb3Rh4Sn13,cP40,223 Pm-3n 0.9718,0.9718,0.9718,90,90,90 - - 8.80 A 13582
Ca-K-Te K4Ca0.67 Te 3 CePu4Co3 ,tI32,140 I4/mcm 1.3662,1.3662,0.6273,90,90,90 - black violet3.21 X 26105
Ca-La-N Ca0.66 La0.34 N0.78 NaCl,cF8,225 Fm-3m 0.51732,0.51732,0.51732,90,90,90 rocksalt family - 4.06 X 33404
Ca-La-Ni Ca0.5 La0.5 Ni3 PuNi3,hR36,166 R-3m 0.50657,0.50657,2.4768,90,90,120 Laves-CaCu5 - 7.21 A 37340
Ca-La-O Ca0.09 La1.91 O2.955 La2O3,hP5,164 P-3m1 0.393,0.393,0.613,90,90,120 - - 6.40 A 1418
Ca-La-S CaLa2S4 Th3P 4,cI28,220 I-43d 0.8683,0.8683,0.8683,90,90,90 - - 4.53 A 17341
Ca-La-S Ca0.70 La0.29 S NaCl,cF8,225 Fm-3m 0.57691,0.57691,0.57691,90,90,90 rocksalt family - 3.47 X 33439
Ca-La-Si Ca0.2 La0.8 Si2 ThSi2,tI12,141 I41/amd 0.433,0.433,1.375,90,90,90 - - 4.52 X 29027
Ca-Li-N LiCaN LiCaN,oP12,62 Pnma 0.8471,0.3676,0.5537,90,90,90 - orange 2.35 X 22144
Ca-Li-P LiCaP TiNiSi,oP12,62 Pnma 0.7073,0.42,0.772,90,90,90 AlB2 family green 2.26 A 33892
Ca-Li-Pb LiCaPb AgYbPb,hP9,187 P-6m2 0.4933,0.4933,1.099,90,90,120 - gray silver 5.47 X 39598
Ca-Li-Sb LiCaSb TiNiSi,oP12,62 Pnma 0.765,0.4629,0.8301,90,90,90 AlB2 family black 3.81 A 33892
Handbook of Inorganic Substances – Edition 2015 : Data 379

System Substance Prototype H-M Unit Cell Parameters a,b,c,α,β,γ (nm,°) Family Color DX C Ref.

Ca-Li-Sb Li1.38 Ca10.62 Sb9 LiCa10MgSb9,tP84,136 P42/mnm 1.19053,1.19053,1.7152,90,90,90 - - 4.18 X 46419


Ca-Li-Si LiCaSi2 orth LiCaSi2,oP16,62 Pnma 0.7968,0.38,1.0715,90,90,90 - gray 2.11 X 45623
Ca-Li-Si LiCaSi2 tet *,t**,* - 1.6262,1.6262,0.3779,90,90,90 - - - N 39409
Ca-Li-Si LiCa2Si Cu2MnAl,cF16,225 Fm-3m 0.7139,0.7139,0.7139,90,90,90 b.c.c. family - 2.10 X 32367
Ca-Li-Si LiCa2Si3 LiCa2Si3,oP24,58 Pnnm 1.0487,1.1252,0.4393,90,90,90 - gray 2.20 X 45623
Ca-Li-Si Li2CaSi Li2AgSb,cF16,216 F-43m 0.7123,0.7123,0.7123,90,90,90 b.c.c. family - 1.51 X 32367
Ca-Li-Si Li3CaSi *,t**,* - 0.9724,0.9724,0.7972,90,90,90 - - - N 39409
Ca-Li-Si Li3.7 Ca3.3 Si8 Li2(Li0.85 Ca0.15 )2Ca3Si8,oP30,58 Pnnm 1.03,1.358,0.437,90,90,90 - gray 2.08 X 5608
Ca-Li-Si Li5Ca2Si3 *,t**,* - 1.1072,1.1072,0.8708,90,90,90 - - - N 39409
Ca-Li-Sn LiCaSn LiCaSn,hP9,156 P3m1 0.494,0.494,1.09,90,90,120 AlB2 family - 3.58 X 8668
Ca-Li-Sn Li5Ca7Sn11 Li5Ca7Sn11,oS92,63 Cmcm 0.4666,1.7059,3.1619,90,90,90 - - 4.28 X 44707
Ca-Li-Sn Li8.84 CaSn6.16 Li8(Li0.71 Sn0.29 )EuSn6,oS64,63 Cmcm 0.464,2.7111,1.149,90,90,90 - - 3.83 X 44707
Ca-Lu-O CaLu2O4 CaV2O4,oP28,62 Pnma 0.9731,0.3304,1.1573,90,90,90 - - 8.10 X 5594
Ca-Lu-S CaLu2S4 ht Yb(Yb0.67 Mn0.33 )2S4 ,oS28,36 Cmc21 0.383,1.269,1.301,90,90,90 - - 5.44 A 3489
Ca-Lu-S CaLu2S4 rt CaLu2S4,oP28,62 Pnma 1.2767,0.3829,1.2958,90,90,90 - - 5.43 X 10564
Ca-Lu-S Ca0.38 Lu0.41 S Tm0.76 Se,oP32,48 Pnnn 0.785,0.7863,1.1119,90,90,90 - - 4.61 A 51333
Ca-Lu-S Ca0.65 Lu0.23 S Yb0.88 S,cF64,216 F-43m 1.1264,1.1264,1.1264,90,90,90 rocksalt family - 3.66 A 51333
Ca-Lu-S Ca0.93 Lu0.05 S NaCl,cF8,225 Fm-3m 0.5684,0.5684,0.5684,90,90,90 rocksalt family - 2.82 X 51333
Ca-Lu-S Ca1.75 Lu1.50 S4 *,hR21,166 R-3m 0.7886,0.7886,1.9314,90,90,120 - - 2.21 N 51333
Ca-Lu-Se Ca0.44 Lu0.38 Se NaCl,cF8,225 Fm-3m 0.58,0.58,0.58,90,90,90 rocksalt family - 5.55 X 2577
Ca-Lu-Se Ca0.5 LuSe2 NaFeO2,hR12,166 R-3m 0.40302,0.40302,2.04764,90,90,120 rocksalt family - 6.10 A 2577
Ca-Lu-Te Ca0.5 LuTe2 NaFeO2,hR12,166 R-3m 0.4315,0.4315,2.179,90,90,120 rocksalt family - 6.38 A 4504
Ca-Mg-N CaMg2N2 Ce2SO2,hP5,164 P-3m1 0.35577,0.35577,0.6096,90,90,120 - colorless 2.90 X 39530
Ca-Mg-Ni CaMgNi4 MgCu4Sn,cF24,216 F-43m 0.70117,0.70117,0.70117,90,90,90 Friauf-Laves phase - 5.77 X 40242
Ca-Mg-Ni CaMg2Ni9 Mg2 LaNi9,hR36,166 R-3m 0.49048,0.49048,2.37868,90,90,120 - - 6.20 X 35821
Ca-Mg-Ni Ca1.5 Mg0.5 Ni7 Gd2Co 7,hR54,166 R-3m 0.49702,0.49702,3.5811,90,90,120 Laves-CaCu5 - 6.28 X 51680
Ca-Mg-O Ca0.036Mg0.964 O NaCl,cF8,225 Fm-3m 0.4235,0.4235,0.4235,90,90,90 rocksalt family - 3.57 X 1909
Ca-Mg-O Ca0.866Mg0.134 O NaCl,cF8,225 Fm-3m 0.4748,0.4748,0.4748,90,90,90 rocksalt family - 3.35 X 1909
Ca-Mg-Pb CaMgPb TiNiSi,oP12,62 Pnma 0.7904,0.4772,0.888,90,90,90 - gray silver 5.39 A 37651
Ca-Mg-Pd CaMgPd TiNiSi,oP12,62 Pnma 0.7365,0.4304,0.8519,90,90,90 AlB2 family - 4.20 X 40421
Ca-Mg-Pd Ca0.94 Mg2.06Pd YPd2Si,oP16,62 Pnma 0.7922,0.8034,0.572,90,90,90 - - 3.54 X 59755
Ca-Mg-Pd Ca4MgPd Gd4RhIn,cF96,216 F-43m 1.4545,1.4545,1.4545,90,90,90 - - 2.51 A 59572
Ca-Mg-Pt CaMg2Pt YPd2Si,oP16,62 Pnma 0.7885,0.7927,0.5665,90,90,90 - - 5.32 A 59755
Ca-Mg-Rh CaMg2Rh YPd2Si,oP16,62 Pnma 0.787,0.7838,0.571,90,90,90 - - 3.61 A 59755
Ca-Mg-S Ca0.86 Mg0.14 S NaCl,cF8,225 Fm-3m 0.5614,0.5614,0.5614,90,90,90 rocksalt family - 2.63 X 293
Ca-Mg-Sb CaMg2Sb2 Ce2SO2,hP5,164 P-3m1 0.466,0.466,0.758,90,90,120 - gray silver 3.87 X 11115
Ca-Mg-Sb Ca10 Mg2Sb9 Ca10 Mg2Sb9,tP84,136 P42/mnm 1.18438,1.18438,1.7297,90,90,90 - - 4.23 X 46419
Ca-Mg-Si CaMgSi TiNiSi,oP12,62 Pnma 0.74752,0.44272,0.83149,90,90,90 AlB2 family gray 2.23 X 53971
Ca-Mg-Si Ca7Mg7.5 Si14 Ca7Mg7.5 Si14,hP42,191 P6/mmm 1.2696,1.2696,0.44025,90,90,120 - gray 2.31 X 34198
Ca-Mg-Sn CaMgSn TiNiSi,oP12,62 Pnma 0.786,0.466,0.874,90,90,90 AlB2 family gray silver 3.80 X 7050
Ca-Mg-Sn Ca4Mg0.78 Sn3.22 CePu4Co3,tI32,140 I4/mcm 1.24062,1.24062,0.60852,90,90,90 -

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