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1: "----------------------------------------------------------------------------------------------------------------"
2: "CH4 + 2O2 --> aCO2 + bCO + cO2 + dH2O + eH2"
3: "----------------------------------------------------------------------------------------------------------------"
4:
5: "BC"
6: 1 = Na+Nb
7:
8: "BO"
9: 4 = 2*Na + Nb + 2*Nc + Nd
10:
11: "BH"
12: 4 = 2*Nd + 2*Ne
13:
14:
15: P_0 = Po#
16: X_CO2 = Na/N_p
17: X_CO = Nb/N_p
18: X_O2 = Nc/N_p
19: X_H2O = Nd/N_p
20: X_H2 = Ne/N_p
21:
22: N_p = Na + Nb + Nc + Nd + Ne
23:
24: Ru = R#
25:
26: row = LookupRow('gibbs';1; Tad)
27:
28: Tref = 298 [K]
29:
30: mw_CO2 = 44 [kg/kmol]
31: mw_CO = 28 [kg/kmol]
32: mw_H2O = 18 [kg/kmol]
33: mw_H2 = 2 [kg/kmol]
34: mw_O2 = 32 [kg/kmol]
35: mw_CH4 = 16 [kg/kmol]
36:
37: "-----------------------------------------------------------------------------------------------------------------"
38: "CO2 <--> CO + 1/2O2"
39: "----------------------------------------------------------------------------------------------------------------"
40:
41: kp_CO2 = (X_CO * X_O2^(1/2)) / X_CO2 * 1/P_0^(1/2 )
42:
43: kp_CO2 = exp(-Delta_G_CO2/(Ru * Tad))
44:
45: Delta_G_CO2 = gibbs_CO + gibbs_O2/2 - gibbs_CO2
46:
47:
48:
49: "-----------------------------------------------------------------------------------------------------------------"
50: "H2O<--> H2 + 1/2O2"
51: "----------------------------------------------------------------------------------------------------------------"
52:
53: kp_H2O = (X_H2 * X_O2^(1/2)) / X_H2O * 1/P_0^(1/2)
54:
55: kp_H2O = exp(-Delta_G_H2O/(Ru * Tad))
56:
57: Delta_G_H2O = gibbs_H2 + gibbs_O2/2 - gibbs_H2O
58:
59:
60:
61: gibbs_CO2 = lookup('gibbs'; row; 'CO2')
File:C:\Users\Gui\Documents\Mestrado\P1 - completa - CH4.EES 01/10/2018 14:17:51 Page 2
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----------------------------------------------------------------------------------------------------------------
BC
1 = Na + Nb
BO
4 = 2 · Na + Nb + 2 · Nc + Nd
BH
4 = 2 · Nd + 2 · Ne
P 0 = 101,3 [kPa]
Na
X CO2 =
Np
File:C:\Users\Gui\Documents\Mestrado\P1 - completa - CH4.EES 01/10/2018 14:17:51 Page 3
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Nb
X CO =
Np
Nc
X O2 =
Np
Nd
X H2O =
Np
Ne
X H2 =
Np
N p = Na + Nb + Nc + Nd + Ne
Ru = 8,314 [kJ/kmol-K]
mw CO2 = 44 [kg/kmol]
mw CO = 28 [kg/kmol]
mw H2O = 18 [kg/kmol]
mw H2 = 2 [kg/kmol]
mw O2 = 32 [kg/kmol]
mw CH4 = 16 [kg/kmol]
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----------------------------------------------------------------------------------------------------------------
1 / 2
X CO · X O2 1
kp CO2 = ·
X CO2 P0
1 / 2
– d G;CO2
kp CO2 = exp
Ru · Tad
gibbs O2
d G;CO2 = gibbs CO + – gibbs CO2
2
-----------------------------------------------------------------------------------------------------------------
H2O<--> H2 + 1/2O2
----------------------------------------------------------------------------------------------------------------
1 / 2
X H2 · X O2 1
kp H2O = ·
X H2O P0
1 / 2
– d G;H2O
kp H2O = exp
Ru · Tad
File:C:\Users\Gui\Documents\Mestrado\P1 - completa - CH4.EES 01/10/2018 14:17:51 Page 4
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gibbs O2
d G;H2O = gibbs H2 + – gibbs H2O
2
-----------------------------------------------------------------------------------------------------------------
1a Lei
----------------------------------------------------------------------------------------------------------------
h 0;H2 = Enthalpyformation H2
h 0;O2 = Enthalpyformation O2
h 0;CO = Enthalpyformation CO
-----------------------------------------------------------------------------------------------------------------
----------------------------------------------------------------------------------------------------------------
mw O2
AF st = 2 ·
mw CH4
AF st
0,6 =
AF
SOLUTION
File:C:\Users\Gui\Documents\Mestrado\P1 - completa - CH4.EES 01/10/2018 14:17:51 Page 5
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