Scribd
Upload
3K views2 pages

Fe2o3 Jcpds File

This document provides information about hematite, including its empirical formula (Fe2O3), crystallographic parameters such as space group and unit cell dimensions, calculated density, peak list from X-ray diffraction, and reference to the primary structure reference. Hematite crystallizes in the rhombohedral system with space group R-3c and unit cell parameters a=5.0206 Å, b=5.0206 Å, c=13.7196 Å. It has a calculated density of 5.31 g/cm3 and contains 6 formula units per unit cell.

Uploaded by

Himadri Chakraborti
Copyright
© © All Rights Reserved
We take content rights seriously. If you suspect this is your content, claim it here.
Available Formats
Download as PDF, TXT or read online on Scribd
3K views2 pages

Fe2o3 Jcpds File

This document provides information about hematite, including its empirical formula (Fe2O3), crystallographic parameters such as space group and unit cell dimensions, calculated density, peak list from X-ray diffraction, and reference to the primary structure reference. Hematite crystallizes in the rhombohedral system with space group R-3c and unit cell parameters a=5.0206 Å, b=5.0206 Å, c=13.7196 Å. It has a calculated density of 5.31 g/cm3 and contains 6 formula units per unit cell.

Uploaded by

Himadri Chakraborti
Copyright
© © All Rights Reserved
We take content rights seriously. If you suspect this is your content, claim it here.
Available Formats
Download as PDF, TXT or read online on Scribd

Name and formula

Reference code: 01-089-8103

Mineral name: Hematite, syn


ICSD name: Iron Oxide

Empirical formula: Fe2O3


Chemical formula: Fe2O3

Crystallographic parameters
Crystal system: Rhombohedral
Space group: R-3c
Space group number: 167

a (): 5.0206
b (): 5.0206
c (): 13.7196
Alpha (): 90.0000
Beta (): 90.0000
Gamma (): 120.0000

Calculated density (g/cm^3): 5.31


Volume of cell (10^6 pm^3): 299.49
Z: 6.00

RIR: 3.25

Subfiles and Quality


Subfiles: Inorganic
Mineral
Alloy, metal or intermetalic
Corrosion
ICSD Pattern
Quality: Calculated (C)

Comments
ICSD collection code: 088417

References
Primary reference: Calculated from ICSD using POWD-12++
Structure: Yu, S.-C., Lee, J.-S., Tung, S.-F., Lan, C.-L., J. Geol. Soc. China, 42,
349, (1999)
Peak list
No. h k l d [A] 2Theta[deg] I [%]
1 0 1 2 3.67242 24.216 32.4
2 1 0 4 2.69288 33.243 100.0
3 1 1 0 2.51030 35.740 72.3
4 0 0 6 2.28660 39.373 2.0
5 1 1 3 2.20057 40.980 19.2
6 2 0 2 2.07240 43.640 1.8
7 0 2 4 1.83621 49.607 34.7
8 1 1 6 1.69043 54.218 41.5
9 2 1 1 1.63171 56.339 0.5
10 1 2 2 1.59816 57.631 2.8
11 0 1 8 1.59534 57.743 8.3
12 2 1 4 1.48204 62.632 26.4
13 3 0 0 1.44932 64.212 25.1
14 1 2 5 1.40986 66.236 0.3
15 2 0 8 1.34644 69.794 2.5
16 1 0 10 1.30837 72.136 9.2
17 1 1 9 1.30297 72.483 2.0
18 2 1 7 1.25928 75.425 0.3
19 2 2 0 1.25515 75.717 5.4
20 0 3 6 1.22414 77.991 2.0
21 2 2 3 1.21039 79.049 0.9
22 1 3 1 1.20128 79.768 0.1
23 3 1 2 1.18654 80.962 3.5
24 0 2 10 1.16024 83.198 4.4
25 0 0 12 1.14330 84.715 0.2
26 1 3 4 1.13764 85.235 6.3
27 2 2 6 1.10029 88.868 5.8

Stick Pattern

You might also like