Determination of an autothermic process

1)

+ +

2)

2 +

R
T

8.3145
298.15
Reaction 1)
T (K)

1)

298
i
reactants
products

C(s)
H2O(g)
CO(g)
H2(g)
h,r 289.15K=

-1
-1
1
1

cp at T
hf 298.15K (kJ/mol) (J/(mol*K))
0
-242
-110.62
0
131.38

8.67
33.58
29.14
28.85

T (K)
1)T=

900 K

298

i
reactants
products

C(s)
H2O(g)
CO(g)
H2(g)
h,r 289.15K=

-1
-1
1
1

cp at T
hf 298.15K (kJ/mol) (J/(mol*K))
0
8.67
-242
33.58
-110.62
29.14
0
28.85
131.38
T (K)

1)T=

1200 K

298

i
reactants
products

C(s)
H2O(g)
CO(g)
H2(g)
h,r 289.15K=

-1
-1
1
1

cp at T
hf 298.15K (kJ/mol) (J/(mol*K))
0
-242
-110.62
0
131.38

8.67
33.58
29.14
28.85

T (K)
1)T=

1500 K

i
reactants

C(s)
H2O(g)

298
cp at T
hf 298.15K (kJ/mol) (J/(mol*K))
-1
0
8.67
-1
-242
33.58

products

CO(g)
H2(g)

1
1

-110.62
0
131.38

h,r 289.15K=

29.14
28.85

0.244

n
298.15
900
1200
1000

0.231997175
0.241312561
0.242977535
0.242682773

0.242
0.24
0.238
0.236
0.234
0.232
0.23
0

200

400

600

J/(mol*K)
K
Reaction 1)
T(K)
1000
cp at T (J/(mol*K)) intercept
16.55
5.32
40.86
30.49
30.78
28.44
29.65
28.51

T (K)
900

cp at T (J/(mol*K))
15.42749288
39.82296296
30.54638177
29.53603989

T (K)
1200

cp at T (J/(mol*K))
18.79501425
42.93407407
31.24723647
29.87792023

T (K)
1500

slope
0.0112
0.0104
0.0023
0.0011

T(K)
900
cp average
(J/(mol*K)) h,r T (kJ/mol)
12.0487464
36.7014815
137.57
29.8431909
29.1930199

T(K)
1200
cp average
(J/(mol*K)) h,r T (kJ/mol)
13.7325071
38.257037
138.21
30.1936182
29.3639601

T(K)
1500

cp average
cp at T (J/(mol*K)) (J/(mol*K)) h,r T (kJ/mol)
22.16253561 15.4162678
46.04518519 39.8125926
137.21

T (K)

T (K)

T (K)

900
cp at T
(J/(mol*K))
15.4274929
39.822963
30.5463818
29.5360399

1200
cp at T
(J/(mol*K))
18.7950142
42.9340741
31.2472365
29.8779202

1500
cp at T
(J/(mol*K))
22.1625356
46.0451852
31.9480912
30.2198006

31.94809117 30.5440456
30.21980057 29.5349003

137.21

Series1

800

1000

1200

1400

T (K)
2)
i
reactants
products

CO(g)
O2(g)
CO2(g)
h,r 289.15K=

298
hf 298.15K cp at T
(kJ/mol)
(J/(mol*K))
-2
-110.62
29.14
-1
0
29.39
2
-393.77
37.14
-566.3
T (K)

2)T=

900 K

i
reactants
products

CO(g)
O2(g)
CO2(g)
h,r 289.15K=

T (K)
298

900

hf 298.15K cp at T
(kJ/mol)
(J/(mol*K))
-2
-110.62
29.14
-1
0
29.39
2
-393.77
37.14

cp at T
(J/(mol*K))
30.5463818
31.8511681
46.8646154

1200 K

i
reactants
products

CO(g)
O2(g)
CO2(g)
h,r 289.15K=

T (K)
298

1200

hf 298.15K cp at T
(kJ/mol)
(J/(mol*K))
-2
-110.62
29.14
-1
0
29.39
2
-393.77
37.14

cp at T
(J/(mol*K))
31.2472365
33.0776638
51.7107692

1200 K

i
reactants

CO(g)
O2(g)

cp average
(J/(mol*K))
30.1936182
31.2338319
44.4253846

-566.3
T (K)

2)T=

cp average
(J/(mol*K))
29.8431909
30.620584
42.0023077

-566.3
T (K)

2)T=

Reaction 2)
T(K)
1000
cp at T
(J/(mol*K)) intercept
30.78
28.44
32.26
28.17
48.48
32.33

T (K)
298

1500

hf 298.15K cp at T
(kJ/mol)
(J/(mol*K))
-2
-110.62
29.14
-1
0
29.39

cp at T
(J/(mol*K))
31.9480912
34.3041595

cp average
(J/(mol*K))
30.5440456
31.8470798

products

CO2(g)
h,r 289.15K=

-393.77
-566.3

37.14 56.5569231 46.8484615

slope
0.0023
0.0041
0.0162

T(K)
900

h,r T (kJ/mol)
-570.09

T(K)
1200

h,r T (kJ/mol)
-568.80

T(K)
1500

h,r T (kJ/mol)
-565.38

T (K)

T (K)

T (K)

900
cp at T
(J/(mol*K))
30.5463818
31.8511681
46.8646154

1200
cp at T
(J/(mol*K))
31.2472365
33.0776638
51.7107692

1500
cp at T
(J/(mol*K))
31.9480912
34.3041595
56.5569231

-565.38

i
C2H5OH(l)
CO2(g)
Glc

hr,308

hf 298.15K cp at T
hf 308.15K
(kJ/mol)
(J/(mol*K)) (kJ/mol)
2
-235.47
73.65
-234.7335
2
-393.77
37.14
-393.3986
-1
-1032.525
226.08 -1030.2642
-225.955
-4.5

-226 kj/mol

i
H2O(g)
CO2(g)
Glc
O2

-6
-6
1
6
hr,T

T
278.15
288.15
298.15
308.15
yield

hf 298.15K cp at T
hf 5C
hf 15C
hf 35C
(kJ/mol)
(J/(mol*K)) (kJ/mol)
(kJ/mol)
(kJ/mol)
-242
33.58
-242.6716
-242.3358
-241.6642
-393.77
37.14
-394.5128
-394.1414
-393.3986
-1032.525
226.08 -1037.0466 -1034.7858 -1030.2642
0
29.39
-0.5878
-0.2939
0.2939
2782.095
2782.533
2782.314
2781.876
15456.0833
15458.5167
15457.3 15454.8667

hr,T kj/mol
2782.533
2782.314
2782.095
2781.876
3.55555556 molglc
4.97777778 mol etoh
228.977778 gEtOH/m2

6361.94844
6307200
0.10086803
0.01783285

kj/m2*a
energy invest
kj/m2*a
energy input
%
%enbioet/ensun

2782.6
2782.5
2782.4
2782.3
Series1

2782.2

Linear (Series1)

2782.1
2782
y = -0.0219x + 2788.6
R = 1

2781.9
2781.8
270

280

290

300

310