CLCULO DE TEMPERATURA ADIABTICA DE

LLAMA
THERMO CALC version M for PC / Windows NT
Copyright (1993,1995) Foundation for Computational Thermodynamics,
Stockholm, Sweden
Double precision version linked at 08-17-98 16:31:34
For use at: Pontificia Universidade Catolica
By only: Fernando Rizzo, Roberto R. de Avillez
SYS: go tab
TAB: tab - re
Reaction: C2H2+3N2O1=2C1O1+H2O1<G>+3N2
&
Use one of these databases
KP
= Kaufman binary alloys database
PURE = SGTE pure element database
GEO
= Saxena geochemical database
G35
= Semiconductor III-V binary database
AQ
= TC public aqueous solution database
PSUB = TC public pure substance database
PION = TC public ionic database
BIN97 = TC public binary solution database
BIN
= Binary database
TER98 = TC public ternary solution database
SUB94 = TC Banco de dados das substancias
SSOL = TC banco de dados SGTE das substancias
POT
= TC banco de dados para diagramas de potenciais
IRSID = IRSID database
ION
= Ionic KTH database
CHAT = Chatenary post-transitional binarys
SLAG = Fe slag database
IFACO = Interstitial Free Steel database
COST = Cost507 version 1999 database
FRIB = Fridberg Dilute Fe-alloy Database
BISH = Bishop Dilute Al-alloy Database
MOB2 = TCAB Alloy Mobility Solution Database
OIKA = Oikawa Dilute Fe-alloy Database
USER = User defined Database
DATABASE NAME: sub94
THERMODYNAMIC DATABASE module running on PC/WINDOWS NT
Current database: TC Banco de dados das substancias
VA DEFINED
VA DEFINED
REINITIATING GES5 .....
N2O1
C2H2
C1O1
N2 DEFINED
ELEMENTS .....
SPECIES ......

H2O1

PHASES .......
PARAMETERS ...
List of references for assessed data
C1O1<G> JANAF THERMOCHEMICAL TABLES SGTE **
STANDARD STATE : CODATA KEY VALUE. /CP FROM JANAF PUB. 9/65
C2H2<G> T.C.R.A.S Class: 2
H2O1<G> T.C.R.A.S Class: 1
N2<G> JANAF THERMOCHEMICAL TABLES SGTE **
PUBLISHED BY JANAF AT 09/65
N2O1<G> T.C.R.A.S Class: 1
H2O1 T.C.R.A.S Class: 4 modified by atd 12/9/94
The list of references can be obtained in the Gibbs Energy System also
by the command LIST_DATA and option R
-OKPressure /100000/: 101325
Low temperature limit /298.15/:
High temperature limit /2000/:
Step in temperature /100/:
Output file /SCREEN/:
OUTPUT FROM THERMO-CALC
10.11.12
11.35.13
Reaction: 3N2O1+C2H2=H2O1<G>+2C1O1+3N2
N2O1 stable as GAS
C2H2 stable as GAS
H2O1<GAS>
C1O1 stable as GAS
N2 stable as GAS
**********************************************************
T
Delta-Cp
Delta-H
Delta-S
Delta-G
(K)
(Joule/K)
(Joule)
(Joule/K)
(Joule)
********************************************************
298.15 1.93903E+01 -9.35083E+05 2.97835E+02 -1.02388E+06
300.00 1.89634E+01 -9.35048E+05 2.97954E+02 -1.02443E+06
400.00 1.87571E+00 -9.34087E+05 3.00834E+02 -1.05442E+06
500.00 -8.63452E+00 -9.34461E+05 3.00044E+02 -1.08448E+06
600.00 -1.58172E+01 -9.35705E+05 2.97795E+02 -1.11438E+06
700.00 -2.07859E+01 -9.37551E+05 2.94959E+02 -1.14402E+06
800.00 -2.40057E+01 -9.39804E+05 2.91956E+02 -1.17337E+06
900.00 -2.60619E+01 -9.42312E+05 2.89004E+02 -1.20242E+06
1000.00 -2.79296E+01 -9.45018E+05 2.86155E+02 -1.23117E+06
1100.00 -2.91754E+01 -9.47878E+05 2.83431E+02 -1.25965E+06
1200.00 -2.99744E+01 -9.50837E+05 2.80856E+02 -1.28786E+06
1300.00 -3.05662E+01 -9.53866E+05 2.78432E+02 -1.31583E+06
1400.00 -3.10043E+01 -9.56945E+05 2.76150E+02 -1.34356E+06
1500.00 -3.13249E+01 -9.60063E+05 2.73999E+02 -1.37106E+06

1600.00 -3.15534E+01
1700.00 -3.17056E+01
1800.00 -3.19205E+01
1900.00 -3.20907E+01
2000.00 -3.22482E+01
TAB: go p-3

-9.63207E+05
-9.66371E+05
-9.69553E+05
-9.72753E+05
-9.75970E+05

2.71970E+02
2.70052E+02
2.68234E+02
2.66503E+02
2.64853E+02

POLY version 3.30, Feb 1996

POLY_3: s-i-a n(C2H2)=1 n(N2O1)=3
POLY_3: s-c p=101325 h=472200
POLY_3: c-e
Forcing automatic start values
Automatic start values will be set
162 ITS, CPU TIME USED 0 SECONDS
POLY_3: l-e
Output file: /SCREEN/:
Options /VWCS/:
Output from POLY-3, equilibrium number =

-1.39836E+06
-1.42546E+06
-1.45237E+06
-1.47911E+06
-1.50568E+06

1, label A0

Conditions:
N(C)=2, N(H)=2, N(N)=6, N(O)=3, P=101325, H=472200
DEGREES OF FREEDOM 0

Temperature 4384.84, Pressure 1.013250E+05

Number of moles of components 1.30000E+01, Mass 1.58074E+02
Total Gibbs energy -7.32624E+06, Enthalpy 4.72200E+05, Volume
2.15886E+00
Component
C
H
N
O

Moles

W-Fraction Activity Potential Ref.state

2.0000E+00 1.5195E-01 5.5432E-07 -5.2519E+05 SER

2.0000E+00 1.2752E-02 5.7038E-05 -3.5626E+05 SER
6.0000E+00 5.3165E-01 2.3553E-07 -5.5640E+05 SER
3.0000E+00 3.0364E-01 1.4630E-09 -7.4165E+05 SER

GAS#1
Status ENTERED
Driving force 0.0000E+00
Number of moles 1.3000E+01, Mass 1.5807E+02
Mass fractions:
N 5.31650E-01 O 3.03643E-01 C 1.51954E-01 H 1.27522E-02
Constitution:
N2 5.00000E-01 H2O1 1.66667E-01 C2H2 5.27178E-08
C1O1 3.33333E-01 N2O1 1.58153E-07
POLY_3:
NOTA: LA TEMPERATURA OBTENIDA EN THERMOCALC ES DE 4384.84 K
(4111.84C), utilizando valores de entalpia del HSC. En el Updhyaya se
obtiene una temperatura de 3934C.