T 298-1300K 298-1000K 500-1700K 298-1300K

Component CH4 CS2 H2O CO

A -0.703029 35.85 30.092 25.56759
B 108.4773 52.49 6.832514 6.09613
C -42.52157 -40.83 6.793435 4.054656
D 5.862788 12 -2.53448 -2.671301
E 0.678565 -0.22 0.082139 0.131021
F -76.84376 103.5 -250.881 -118.0089
G 158.7163 266.159 223.3967 227.3665
H -74.8731 116.94 -241.8264 -110.5271

Δh,f_not (298 K) ΔS_not (298 K)

Component
kJ/mol J/(mol*K)
CH4 -74.9 186.31
CS2 116.94 237.95
CO2 -393.77 213.78
H2O -242 188.87
CO -110.62 198.04
H2 0 130.67
H2S -20.6 205.81
Δh,f (KJ/mol)
Temp Temperature t 1 1
°C K T/1000 CH4 H20
25 298.15 0.29815 -74.898802889 -241.9994731
700 973.15 0.97315 -38.634988039 -217.10104154
800 1073.15 1.07315 -31.366869045 -212.94528927
900 1173.15 1.17315 -23.734844952 -208.66443703
1000 1273.15 1.27315 -15.781839987 -204.26166162
1100 1373.15 1.37315 92.420553777 -199.74175254
1200 1473.15 1.47315 100.90793777 -195.11108078
1300 1573.15 1.57315 109.62027074 -190.37757951

Δh,f (KJ/mol)
Temp Temperature t -1 -2
°C K T/1000 CH4 h2s
25 298.15 0.29815 -74.898802889 -20.578285087
700 973.15 0.97315 -38.634988039 6.1532190033
800 1073.15 1.07315 -31.366869045 10.761426057
900 1173.15 1.17315 -23.734844952 15.511228626
1000 1273.15 1.27315 -15.781839987 20.387276675
1100 1373.15 1.37315 92.420553777 25.372052504
1200 1473.15 1.47315 100.90793777 -233.78822873
1300 1573.15 1.57315 109.62027074 -228.61878925

Component Intial Change final

CH4 n1 0 n1+x1 n1+x1
CS2 n2 0 n2-x1 n2+x2
 H20 n3 0 n3+2x1 n3+x1
H2 n4 3 n4+2x1 n4-3x1+4x2
CO n5 1 n5 n5-x1
H2S n6 2 n6-2x2
n1+n2+n3+n4+n5+n6-2x1+3x2

x1 x2 Temp Temperature yCH4 yH2

°C K
0.17799 0.00109345324335674 700 973.15 0.0315177124 0.4374486354
0.061084 0.00466259107997712 800 1073.15 0.0103675228 0.4812433713
0.000968 0.00073910399805369 900 1173.15 0.0001612996 0.4999853464
0.000597 0.00376114744832073 1000 1273.15 9.9329581E-05 0.5013658548
0.00138 0.843511055024282 1100 1373.15 0.0001618542 0.7469598114
0.004578 0.00047547005937244 1200 1473.15 0.0007639501 0.4986704679
0.009851 0.00051348978750084 1300 1573.15 0.0016467716 0.4969210605

Temp Temperature mCO mH2

°C K
700 973.15 0.8220100109 2.4704038458
800 1073.15 0.9389164155 2.8353996108
900 1173.15 0.9990321571 3.0000528874
1000 1273.15 0.9994030203 3.0132536508
1100 1373.15 0.9986197444 6.3699034534
1200 1473.15 0.9954222042 2.988168493
1300 1573.15 0.9901492776 2.9725017918

6
moles of reactats and products

0
600 800 1000 1200 1400 1600 1800
Temperature T / K
 2

moles
1

0
600 800 1000 1200 1400 1600 1800
Temperature T / K
 298-1000K 298-1400 1400-6000 1300-6000 1000-6000 1300-6000 1000-2500
H2 H2S H2S ch4 CS2 CO H2
33.06617 26.88 51.22 85.81 61.25 35.15 18.56
-11.363417 18.67 4.14 11.26 1.37 1.3 12.256
11.432816 3.43 -0.64 -2.11 -0.14 -0.2 -2.85
-2.772874 -3.37 0.04 0.13 0.009 0.01 0.26
-0.158558 0.13 -10.4 -26.42 -3.24 -3.28 1.97
-9.980797 -28.91 -55.87 -53.53 90.07 -127.83 -1.14
172.707974 233.37 243.69 224.41 299.4 231.71 156.288
0 -20.5 -20.5 -74.87 116.94 -110.52 0

Δh,f (KJ/mol)
-1 -3 Temp Temperature small_t
CO H2 °C K
-110.616773 0.00014686 25 298.15 0.29815
-89.8221112 19.8702062 700 973.15 0.97315
-86.4910853 22.9113736 800 1073.15 1.07315
-83.1066376 25.9775388 900 1173.15 1.17315
-79.6781565 29.0855612 1000 1273.15 1.27315
-76.213228 32.2370194 1100 1373.15 1.37315
-72.7130034 35.4321897 1200 1473.15 1.47315
-69.1844055 38.6705096 1300 1573.15 1.57315

Δh,f (KJ/mol)
1 4 Temp Temperature small_t
Cs2 H2 °C K
116.9225615 0.00014686 25 298.15 0.29815
153.6157212 19.8702062 700 973.15 0.97315
159.5537767 22.9113736 800 1073.15 1.07315
165.5588997 25.9775388 900 1173.15 1.17315
171.6152378 29.0855612 1000 1273.15 1.27315
177.7137446 32.2370194 1100 1373.15 1.37315
183.8477772 35.4321897 1200 1473.15 1.47315
190.0123344 38.6705096 1300 1573.15 1.57315
n4+n5+n6-2x1+3x2

yCS2 yCO yH20 yH2S K1 K2 eq1

0.000193624 0.14555805 0.031517712 0.353764269 0.08152522 0.0017975665 2.5188526E-08

0.000791367 0.1593593 0.010367523 0.337870915 0.00605171 0.0358641251 -2.293839E-10
0.000123178 0.16649754 0.0001613 0.333071332 1.2502E-06 0.4301850358 1.4384916E-05
0.000625806 0.16628754 9.93296E-05 0.331522136 4.708E-07 3.6220527127 2.3144641E-06
0.098913408 0.11710206 0.000161854 0.036701012 5.3677E-07 141242.08742 -2.601957E-08
7.934722E-05 0.16611769 0.00076395 0.333604592 2.8332E-05 0.05771083 -5.835847E-07
8.584146E-05 0.1655259 0.001646772 0.334173657 0.00013352 0.0284622298 -2.711839E-06

mCH4 cs2 mH2O h2s

Conversion (%)
0.177989989 0.00109345 0.177989989 2.002186906 CH4
0.061083584 0.00466259 0.061083584 2.009325182 #DIV/0!
0.000967843 0.0007391 0.000967843 2.001478208 #DIV/0!
0.00059698 0.00376115 0.00059698 2.007522295 #DIV/0!
0.001380256 0.84351106 0.001380256 3.68702211 #DIV/0!
0.004577796 0.00047547 0.004577796 2.00095094 #DIV/0!
0.009850722 0.00051349 0.009850722 2.00102698 #DIV/0!
#DIV/0!

mCO
mH2
mCH4
cs2
mH2O
h2s

1400 1600 1800

K
 mH2O
h2s

1400 1600 1800

K
 ΔS J/(mol*K) Δh,f ΔS ln(Kp1) Kp1
1 1 -1 -3 KJ/mol J/(mol*K)
CH4 h20 CO H2
186.2547011 188.83526917 197.6629 130.6802 -206.2819 -214.6134 57.40433 8.51894E+24
245.6084833 231.62155445 233.6332 165.3952 -225.5245 -252.5886 -2.506818 0.081527283
252.71473576 235.68550997 236.891 168.3615 -226.5552 -253.5754 -5.107416 0.0060517
259.5121632 239.49868164 239.906 171.0931 -227.2253 -254.1743 -7.275219 0.000692488
266.01618159 243.09955888 242.7104 173.6352 -227.622 -254.5003 -9.106784 0.000110911
272.21154958 246.51666366 245.3313 176.0179 -127.819 -254.6569 -19.43377 3.63097E-09
278.17680139 249.77138092 247.7916 178.2638 -127.7867 -254.6349 -20.19378 1.69806E-09
283.89805685 252.87984953 250.109 180.3905 -127.5844 -254.5026 -20.85655 8.75214E-10

ΔS J/(mol*K) Δh,f ΔS ln(Kp2) Kp2

-1 -2 1 4 KJ/mol J/(mol*K)
ch4 h2s cs2 H2
186.2547011 205.79886548 237.9534 130.6802 232.9785 162.8216 -74.40368 4.86287E-33
245.6084833 251.32736429 300.733 165.3952 259.4251 214.0504 -6.318552 0.001802552
252.71473576 255.83371091 306.5241 168.3615 261.0433 215.5881 -3.327091 0.035897377
259.5121632 260.06462032 311.874 171.0931 262.1814 216.6048 -0.827549 0.437119278
266.01618159 264.05265328 316.8279 173.6352 262.9648 217.2473 1.287076 3.62217802
272.21154958 267.82132982 321.439 176.0179 163.4972 217.6565 11.85823 141241.7113
278.17680139 271.37591731 325.7508 178.2638 692.2451 217.8775 -30.314 6.83593E-14
283.89805685 274.7707501 329.7994 180.3905 692.3117 217.9219 -26.72096 2.48448E-12
eq2 sqeq1 sqeq2 sum

1.9665351E-08 6.344618E-16 3.867E-16 1.021E-15

3.9354217E-08 5.261696E-20 1.549E-15 1.549E-15
1.240814E-07 2.069258E-10 1.54E-14 2.069E-10
1.3679813E-09 5.356744E-12 1.871E-18 5.357E-12
-8.199917E-08 6.770178E-16 6.724E-15 7.401E-15
-4.906664E-06 3.405711E-13 2.408E-11 2.442E-11
-5.234156E-06 7.35407E-12 2.74E-11 3.475E-11

Conversion (%)
CO2 H2O
#DIV/0! 82.201001094
#DIV/0! 93.891641551
#DIV/0! 99.903215714
#DIV/0! 99.940302033
#DIV/0! 99.861974443
#DIV/0! 99.542220425
#DIV/0! 99.014927757
 T 298-1300K 298-1200K 500-1700K 298-1300K
Component CH4 CO2 H2O CO
A -0.703029 24.99735 30.092 25.56759
B 108.4773 55.18696 6.832514 6.09613
C -42.52157 -33.69137 6.793435 4.054656
D 5.862788 7.948387 -2.53448 -2.671301
E 0.678565 -0.136638 0.082139 0.131021
F -76.84376 -403.6075 -250.881 -118.0089
G 158.7163 228.2431 223.3967 227.3665
H -74.8731 -393.5224 -241.8264 -110.5271

Δh,f_not (298 K) ΔS_not (298 K)

Component
kJ/mol J/(mol*K)
CH4 -74.9 186.31
O2 0 205.15
CO2 -393.77 213.78
H2O -242 188.87
CO -110.62 198.04
H2 0 130.67

Δh,f (KJ/mol)
Temp Temperature t -1 -1
°C K T/1000 CH4 CO2
25 298.15 0.29815 -74.898802889 -393.77292024
400 673.15 0.67315 -57.797172406 -377.33925689
450 723.15 0.72315 -54.912796856 -374.86300715
500 773.15 0.77315 -51.896977523 -372.33759517
550 823.15 0.82315 -48.75541237 -369.76731463
600 873.15 0.87315 -45.493955789 -367.15608539
650 923.15 0.92315 -42.118516695 -364.507474
700 973.15 0.97315 -38.634988039 -361.82470788

Δh,f (KJ/mol)
Temp Temperature t -1 -1
°C K T/1000 CO H2O
25 298.15 0.29815 -110.61677292 -241.9994731
400 673.15 0.67315 -99.429308646 -228.81155736
450 723.15 0.72315 -97.87132269 -226.93756113
500 773.15 0.77315 -96.295661862 -225.03295986
550 823.15 0.82315 -94.702494207 -223.09727849
600 873.15 0.87315 -93.092160601 -221.13018251
650 923.15 0.92315 -91.465155069 -219.1314657
700 973.15 0.97315 -89.822111181 -217.10104154
 Component Intial Change final
CH4 n1 1 n1-x1 n1-x1
CO2 n2 1 n2-x1 n2-x1+x2
CO n3 0 n3+2x1 n3+2x1-x2
H2 n4 0 n4+2x1 n4+2x1+x2
H2O n5 1 n5 n5-x2

x1 x2 Temp Temperature yCO yH2

°C K
0.180939 0.28127138077247 400 673.15 0.0239764082 0.1913063675
0.167045 0.231622556588938 450 723.15 0.0307330085 0.1696750382
0.174503 0.207345086242844 500 773.15 0.0422991712 0.1661240517
0.363885 0.319995908113297 550 823.15 0.1093880704 0.281070314
0.553935 0.375596700730444 600 873.15 0.1782608768 0.3611278072
0.754908 0.421086305772603 650 923.15 0.2414132014 0.4281553553
0.901884 0.443958011461823 700 973.15 0.2830714922 0.467908911

Temp Temperature mCO mH2

°C K
400 673.15 0.0806057381 0.6431484996
450 723.15 0.1024665902 0.5657117034
500 773.15 0.1416601457 0.5563503182
550 823.15 0.4077735028 1.047765319
600 873.15 0.7322723363 1.4834657378
650 923.15 1.0887289353 1.9309015468
700 973.15 1.3598096918 2.2477257148

2.5
moles of reactats and products

1.5
mCO
mH2
1 mCH4
mCO2
mH2O
0.5

0
600 650 700 750 800 850 900 950 1000
Temperature T / K
 mH2O
0.5

moles
0
600 650 700 750 800 850 900 950 1000
Temperature T / K
 298-1000K
H2
33.06617
-11.363417
11.432816
-2.772874
-0.158558
-9.980797
172.707974
0

Δh,f (KJ/mol) ΔS J/(mol*K)

2 2 Temp Temperature small_t -1
CO H2 °C K CH4
-110.616773 0.00014686 25 298.15 0.29815 186.2547011
-99.4293086 10.9587788 400 673.15 0.67315 222.22947271
-97.8713227 12.4306379 450 723.15 0.72315 226.361547
-96.2956619 13.9066491 500 773.15 0.77315 230.39312573
-94.7024942 15.3877306 550 823.15 0.82315 234.3296683
-93.0921606 16.874785 600 873.15 0.87315 238.17548187
-91.4651551 18.3686748 650 923.15 0.92315 241.93409222
-89.8221112 19.8702062 700 973.15 0.97315 245.6084833

Δh,f (KJ/mol) ΔS J/(mol*K)

1 1 Temp Temperature small_t -1
CO2 H2 °C K CO
-393.77292 0.00014686 25 298.15 0.29815 197.66288409
-377.339257 10.9587788 400 673.15 0.67315 221.85325522
-374.863007 12.4306379 450 723.15 0.72315 224.08565039
-372.337595 13.9066491 500 773.15 0.77315 226.19237961
-369.767315 15.3877306 550 823.15 0.82315 228.18899461
-367.156085 16.874785 600 873.15 0.87315 230.08808902
-364.507474 18.3686748 650 923.15 0.92315 231.89998001
-361.824708 19.8702062 700 973.15 0.97315 233.63320352
 yCH4 yCO2 yH20 K1 K2 eq1 eq2

0.243632177 0.32729716 0.213787891 0.00026385 12.215308251 -2.066453E-05 1.1261973E-07

0.249829981 0.319301 0.230460977 0.00034088 7.6491953431 -1.805285E-05 3.2937602E-07
0.246490324 0.30840276 0.236683689 0.00064955 5.1174144157 9.2117908E-05 4.3290809E-08
0.17064234 0.25648346 0.182415814 0.02159851 3.612783179 2.4281006E-06 -1.156981E-06
0.108588048 0.20002151 0.152001754 0.19079861 2.6658333821 2.7790096E-08 3.5843407E-07
0.054346435 0.14771751 0.128367497 1.33082745 2.040879086 2.5907741E-08 -4.509996E-08
0.020424832 0.11284354 0.115751223 7.6116656 1.6114480135 6.3086522E-08 -6.473133E-08

mCH4 mCO2 mH2O

Conversion (%)
0.819061441 1.10033282 0.718728619 CH4 CO2
0.832955427 1.06457798 0.768377443 18.093855943 -10.033282134
0.825497384 1.03284247 0.792654914 16.704457342 -6.4577983172
0.636115295 0.9561112 0.680004092 17.450261596 -3.2842470283
0.446065481 0.82166218 0.624403299 36.388470544 4.3888797324
0.245092379 0.66617869 0.578913694 55.393451854 17.833781781
0.098116148 0.54207416 0.556041989 75.490762051 33.382131474
90.188385165 45.792584019

mCO
mH2
mCH4
mCO2
mH2O

950 1000
 mH2O

950 1000
 ΔS J/(mol*K) Δh,f ΔS ln(Kp1) Kp1
-1 2 2 KJ/mol J/(mol*K)
CO2 CO H2
213.78763414 197.6629 130.6802 247.4385 256.6438 -68.95224 1.1335E-30
248.82419634 221.8533 154.4548 258.1954 281.5625 -12.26851 4.69736E-06
252.37214693 224.0857 156.5639 258.8944 282.5655 -9.074313 0.000114571
255.74859671 226.1924 158.5375 259.4565 283.3181 -6.286462 0.001861333
258.96966765 228.189 160.3937 259.8932 283.8661 -3.832566 0.021653984
262.04906827 230.0881 162.1475 260.2153 284.2466 -1.65653 0.190799887
264.99860898 231.9 163.8112 260.433 284.4896 0.285803 1.330830678
267.82858793 233.6332 165.3952 260.5559 284.6196 2.029686 7.611692967

ΔS J/(mol*K) Δh,f ΔS ln(Kp2) Kp2

-1 1 1 KJ/mol J/(mol*K)
H2O CO2 H2
188.83526917 213.7876 130.6802 -41.15653 -42.03036 11.54791 103560.1954
217.2768111 248.8242 154.4548 -38.13961 -35.85104 2.502692 12.21533022
219.96193144 252.3721 156.5639 -37.62349 -35.1115 2.034607 7.649241847
222.50839753 255.7486 158.5375 -37.10232 -34.41467 1.63265 5.11741874
224.93419648 258.9697 160.3937 -36.57981 -33.7598 1.284462 3.612725197
227.25396414 262.0491 162.1475 -36.05896 -33.14549 0.980522 2.66584661
229.47974623 264.9986 163.8112 -35.54218 -32.56994 0.71338 2.040877631
231.62155445 267.8286 165.3952 -35.03135 -32.03102 0.477132 1.611446038
 sqeq1 sqeq2 sum

4.270228E-10 1.268E-14 4.27E-10

3.259053E-10 1.085E-13 3.26E-10
8.485709E-09 1.874E-15 8.486E-09
5.895672E-12 1.339E-12 7.234E-12
7.722894E-16 1.285E-13 1.292E-13
6.71211E-16 2.034E-15 2.705E-15
3.979909E-15 4.19E-15 8.17E-15

version (%)
H2O
28.127138077
23.162255659
20.734508624
31.999590811
37.559670073
42.108630577
44.395801146
 T 298-1300K 298-1200K 500-1700K 298-1300K
Component CH4 CO2 H2O CO
A -0.703029 24.99735 30.092 25.56759
B 108.4773 55.18696 6.832514 6.09613
C -42.52157 -33.69137 6.793435 4.054656
D 5.862788 7.948387 -2.53448 -2.671301
E 0.678565 -0.136638 0.082139 0.131021
F -76.84376 -403.6075 -250.881 -118.0089
G 158.7163 228.2431 223.3967 227.3665
H -74.8731 -393.5224 -241.8264 -110.5271

Δh,f_not (298 K) ΔS_not (298 K)

Component
kJ/mol J/(mol*K)
CH4 -74.9 186.31
O2 0 205.15
CO2 -393.77 213.78
H2O -242 188.87
CO -110.62 198.04
H2 0 130.67

Δh,f (KJ/mol)
Temp Temperature t -1 -1
°C K T/1000 CH4 CO2
25 298.15 0.29815 -74.898802889 -393.77292024
400 673.15 0.67315 -57.797172406 -377.33925689
450 723.15 0.72315 -54.912796856 -374.86300715
500 773.15 0.77315 -51.896977523 -372.33759517
550 823.15 0.82315 -48.75541237 -369.76731463
600 873.15 0.87315 -45.493955789 -367.15608539
650 923.15 0.92315 -42.118516695 -364.507474
700 973.15 0.97315 -38.634988039 -361.82470788

Δh,f (KJ/mol)
Temp Temperature t -1 -1
°C K T/1000 CO H2O
25 298.15 0.29815 -110.61677292 -241.9994731
400 673.15 0.67315 -99.429308646 -228.81155736
450 723.15 0.72315 -97.87132269 -226.93756113
500 773.15 0.77315 -96.295661862 -225.03295986
550 823.15 0.82315 -94.702494207 -223.09727849
600 873.15 0.87315 -93.092160601 -221.13018251
650 923.15 0.92315 -91.465155069 -219.1314657
700 973.15 0.97315 -89.822111181 -217.10104154
 Component Intial Change final
CH4 n1 1 n1-x1 n1-x1
CO2 n2 1 n2-x1 n2-x1+x2
CO n3 0 n3+2x1 n3+2x1-x2
H2 n4 0 n4+2x1 n4+2x1+x2
H2O n5 4 n5 n5-x2

x1 x2 Temp Temperature yCO yH2

°C K
0.161468 0.306941477624697 400 673.15 0.0025294761 0.0996177645
0.140792 0.260373294352329 450 723.15 0.0033768005 0.0862773093
0.135033 0.240709123872281 500 773.15 0.0046819725 0.0814623914
0.238775 0.399349868349193 550 823.15 0.0120723755 0.1353751406
0.852023 1.18838891627875 600 873.15 0.0669333732 0.3754436807
0.955158 1.21627435882797 650 923.15 0.0877389125 0.3952548727
0.988611 1.16638464116302 700 973.15 0.1016441354 0.3940728942

Temp Temperature mCO mH2

°C K
400 673.15 0.0159937135 0.6298766687
450 723.15 0.0212116592 0.5419582479
500 773.15 0.0293562739 0.5107745216
550 823.15 0.0781994074 0.8768991441
600 873.15 0.5156578366 2.8924356692
650 923.15 0.6940426084 3.1265913261
700 973.15 0.8108378871 3.1436071694

3.5
moles of reactats and products

2.5
mCO
2
mH2
1.5 mCH4
mCO2
1 mH2O
0.5

0
600 650 700 750 800 850 900 950 1000
Temperature T / K
 1 mH2O

moles
0.5

0
600 650 700 750 800 850 900 950 1000
Temperature T / K
 298-1000K
H2
33.06617
-11.363417
11.432816
-2.772874
-0.158558
-9.980797
172.707974
0

Δh,f (KJ/mol) ΔS J/(mol*K)

2 2 Temp Temperature small_t -1
CO H2 °C K CH4
-110.616773 0.00014686 25 298.15 0.29815 186.2547011
-99.4293086 10.9587788 400 673.15 0.67315 222.22947271
-97.8713227 12.4306379 450 723.15 0.72315 226.361547
-96.2956619 13.9066491 500 773.15 0.77315 230.39312573
-94.7024942 15.3877306 550 823.15 0.82315 234.3296683
-93.0921606 16.874785 600 873.15 0.87315 238.17548187
-91.4651551 18.3686748 650 923.15 0.92315 241.93409222
-89.8221112 19.8702062 700 973.15 0.97315 245.6084833

Δh,f (KJ/mol) ΔS J/(mol*K)

1 1 Temp Temperature small_t -1
CO2 H2 °C K CO
-393.77292 0.00014686 25 298.15 0.29815 197.66288409
-377.339257 10.9587788 400 673.15 0.67315 221.85325522
-374.863007 12.4306379 450 723.15 0.72315 224.08565039
-372.337595 13.9066491 500 773.15 0.77315 226.19237961
-369.767315 15.3877306 550 823.15 0.82315 228.18899461
-367.156085 16.874785 600 873.15 0.87315 230.08808902
-364.507474 18.3686748 650 923.15 0.92315 231.89998001
-361.824708 19.8702062 700 973.15 0.97315 233.63320352
 yCH4 yCO2 yH20 K1 K2 eq1 eq2

0.132617586 0.18116173 0.584073442 2.6428E-06 12.215330221 4.9360803E-08 1.2947803E-12

0.136781963 0.17823222 0.595331709 3.4817E-06 7.6492417348 2.7082479E-06 2.2560926E-10
0.137951879 0.17634209 0.599561669 5.9798E-06 5.1174123596 4.5134662E-05 1.7910171E-08
0.117517495 0.17916888 0.555866112 0.00012685 3.6144195088 0.000453264 -1.136989E-05
0.019207649 0.1734628 0.364952495 0.1895372 2.6660734364 4.2070378E-06 -5.540792E-06
0.005668738 0.15942672 0.351910758 1.3307346 2.040861572 8.6830366E-08 4.9582927E-07
0.001427657 0.14764204 0.355213277 7.6117399 1.6114434612 -9.892738E-09 9.3031556E-08

mCH4 mCO2 mH2O

Conversion (%)
0.838532404 1.14547388 3.693058522 CH4 CO2
0.859207523 1.11958082 3.739626706 16.146759555 -14.547388207
0.864967301 1.10567642 3.759290876 14.079247677 -11.958081759
0.761225362 1.16057523 3.600650132 13.503269889 -10.567642499
0.147976624 1.33636554 2.811611084 23.877463788 -16.057523046
0.044841516 1.26111588 2.783725641 85.202337646 -33.636553982
0.011388736 1.17777338 2.833615359 95.515848363 -26.11158752
98.861126413 -17.777337703

mCO
mH2
mCH4
mCO2
mH2O

950 1000
 mH2O

950 1000
 ΔS J/(mol*K) Δh,f ΔS ln(Kp1) Kp1
-1 2 2 KJ/mol J/(mol*K)
CO2 CO H2
213.78763414 197.6629 130.6802 247.4385 256.6438 -68.95224 1.1335E-30
248.82419634 221.8533 154.4548 258.1954 281.5625 -12.26851 4.69736E-06
252.37214693 224.0857 156.5639 258.8944 282.5655 -9.074313 0.000114571
255.74859671 226.1924 158.5375 259.4565 283.3181 -6.286462 0.001861333
258.96966765 228.189 160.3937 259.8932 283.8661 -3.832566 0.021653984
262.04906827 230.0881 162.1475 260.2153 284.2466 -1.65653 0.190799887
264.99860898 231.9 163.8112 260.433 284.4896 0.285803 1.330830678
267.82858793 233.6332 165.3952 260.5559 284.6196 2.029686 7.611692967

ΔS J/(mol*K) Δh,f ΔS ln(Kp2) Kp2

-1 1 1 KJ/mol J/(mol*K)
H2O CO2 H2
188.83526917 213.7876 130.6802 -41.15653 -42.03036 11.54791 103560.1954
217.2768111 248.8242 154.4548 -38.13961 -35.85104 2.502692 12.21533022
219.96193144 252.3721 156.5639 -37.62349 -35.1115 2.034607 7.649241847
222.50839753 255.7486 158.5375 -37.10232 -34.41467 1.63265 5.11741874
224.93419648 258.9697 160.3937 -36.57981 -33.7598 1.284462 3.612725197
227.25396414 262.0491 162.1475 -36.05896 -33.14549 0.980522 2.66584661
229.47974623 264.9986 163.8112 -35.54218 -32.56994 0.71338 2.040877631
231.62155445 267.8286 165.3952 -35.03135 -32.03102 0.477132 1.611446038
sqeq1 sqeq2 sum

2.436489E-15 1.676E-24 2.436E-15

7.334607E-12 5.09E-20 7.335E-12
2.037138E-09 3.208E-16 2.037E-09
2.054483E-07 1.293E-10 2.056E-07
1.769917E-11 3.07E-11 4.84E-11
7.539512E-15 2.458E-13 2.534E-13
9.786626E-17 8.655E-15 8.753E-15

H2O
7.6735369406
6.5093323588
6.0177280968
9.9837467087
29.709722907
30.406858971
29.159616029
 7

moles of reactats and products 5 Temperatu

4
K
mCO
673.15
mH2
3 723.15
mCH4
2 cs2 773.15
mH2O 823.15
1 873.15
0
923.15
600 800 1000 1200 1400 1600 1800 973.15
Temperature T / K

2.5
Temperatu
K
moles of reactats and products

2 673.15
723.15
1.5 773.15
mCO
mH2
823.15
1 mCH4 873.15
mCO2 923.15
mH2O 973.15
0.5

0
600 650 700 750 800 850 900 950 1000
Temperature T / K

4
Temperatu
3.5
K
moles of reactats and products

3 673.15
2.5 723.15
mCO 773.15
2
mH2 823.15
1.5 mCH4 873.15
mCO2
1
923.15
mH2O
973.15
0.5

0
600 650 700 750 800 850 900 950 1000
Temperature T / K
0.5

0
600 650 700 750 800 850 900 950 1000
Temperature T / K
 Conversion (%) Component Intial
CH4 CO2 H2O CH4 n1 0.6 S/C 4
#DIV/0! #DIV/0! 82.201 CO2 n2 0.4 C/C 0.666667
#DIV/0! #DIV/0! 93.89164 CO n3 0
#DIV/0! #DIV/0! 99.90322 H2 n4 0
#DIV/0! #DIV/0! 99.9403 H2O n5 2.4
#DIV/0! #DIV/0! 99.86197
#DIV/0! #DIV/0! 99.54222
#DIV/0! #DIV/0! 99.01493

Conversion (%)
CH4 CO2 H2O Component Intial
18.09386 -10.03328 28.12714 CH4 n1 1 S/C 1
16.70446 -6.457798 23.16226 CO2 n2 1 C/C 1
17.45026 -3.284247 20.73451 CO n3 0
36.38847 4.38888 31.99959 H2 n4 0
55.39345 17.83378 37.55967 H2O n5 1
75.49076 33.38213 42.10863
90.18839 45.79258 44.3958

Conversion (%) Component Intial

CH4 CO2 H2O CH4 n1 1 S/C 4
16.14676 -14.54739 7.673537 CO2 n2 1 C/C 1
14.07925 -11.95808 6.509332 CO n3 0
13.50327 -10.56764 6.017728 H2 n4 0
23.87746 -16.05752 9.983747 H2O n5 4
85.20234 -33.63655 29.70972
95.51585 -26.11159 30.40686
98.86113 -17.77734 29.15962
 120

100
Methane Conversion
80

60
S/C 4, C/C 0.67
S/C 1, C/C 1
40
S/C 4, C/C 1

20

0
600 650 700 750 800 850 900 950 1000
Temperature / K

60
50
40
Carbondioxide conversion

30
20
10
S/C 4, C/C 0.67
0
S/C 1, C/C 1
-10 S/C 4, C/C 1
-20
-30
-40
600 650 700 750 800 850 900 950 1000
Temperature / K

120

100
steam Conversion

80

60
S/C 4, C/C 0.67
S/C 1, C/C 1
40
S/C 4, C/C 1

20

0
600 650 700 750 800 850 900 950 1000
Temperature / K