Ammonia Synthesis Equilibrium

P= 250 atm
T= 500 C
F0= 100 mol/s
Kp= 1.45E-05 atm^-2
N2 conv= 0.28853404 TRIAL

Fi, mol/s
Component y0 yi Pi, atm Kp calc ∆Kp / Kp
Feed Rxn Product
Ar 0.01 1.00000 0 1.00000 0.01153 2.882594
CH4 0.05 5.00000 0 5.00000 0.057652 14.41297
N2 0.23 23.00000 6.636283 16.36372 0.18868 47.16996 1.45E-05 0%
H2 0.69 69.00000 19.90885 49.09115 0.566039 141.5099
NH3 0.02 2.00000 13.27257 15.27257 0.176098 44.02461
1 86.72743
 Ammonia Synthesis Equilibrium
P= 250 atm R= 82.057 mL.atm/mol/K
T= 500 C
F0= 100 mol/s
K= 1.45E-05 atm^-2
N2 conv= 0.32714215 TRIAL

Fi, mol/s Second Virial

Component y0 yi Pi, atm B B1j B2j B3j B4j B5j
Feed Rxn Product a b c
Ar 0.01 1.00000 0 1.00000 0.011771 2.942857 154.2 119.3 105.1 17.52871 17.52871 17.24248 21.49632 19.51652 -0.89078
CH4 0.05 5.00000 0 5.00000 0.058857 14.71428 206.4 159.5 133 16.96093 17.24248 16.96093 21.14531 19.19784 -1.17467
N2 0.23 23.00000 7.52427 15.47573 0.182171 45.54286 185.4 141.8 88.7 26.36201 21.49632 21.14531 26.36201 23.93408 3.525873
H2 0.69 69.00000 22.57281 46.42719 0.546514 136.6286 315 289.7 9.47 21.72976 19.51652 19.19784 23.93408 21.72976 1.209748
NH3 0.02 2.00000 15.04854 17.04854 0.200686 50.17141 44.3 23.6 766.6 -19.3103 -0.89078 -1.17467 3.525873 1.209748 -19.3103
1 84.95146

Component yjB1j yjB2j yjB3j yjB4j yjB5j B avg fi Kfi Kp calc K calc ∆K / K

Ar 0.2063379 0.202969 0.253042 0.229737 -0.01049 0.183923 1.013195

CH4 1.01484301 0.998272 1.244552 1.12993 -0.06914 0.901071 1.010683
N2 3.91601654 3.852072 4.802406 4.360106 0.642313 3.659444 1.049471 0.66911 2.17.E-05 1.45.E-05 0.00%
H2 10.6660588 10.49189 13.08032 11.87563 0.661145 9.74882 1.031027
NH3 -0.1787668 -0.23574 0.707592 0.242779 -3.87529 -0.53211 0.877282
15.6244895 15.30946 20.08791 17.83818 -2.65146 13.96115
 PRIMARY REFORMER
P= 35 atm Reaksi: CH4 + H2O === CO + 3H2
T= 800 C CO + H2O === CO2 + H2
F0= 200 mol/s Kp1 = exp(30,42-27106/T)
Kp1= 174.451788 Kp2 = exp(-3,798+4160/T)
Kp2= 1.08159686
alpha= 0.30405555 TRIAL carbon terkonversi mjd CO
beta= 0.31436328 TRIAL carbon terkonversi mjd CO2

Umpan, m/s
Component yF F out, m/s yi Pi, atm Kp1 Kp2 ∆Kp1 ∆Kp2
Fi total atom C atom H atom O atom N
N2 0.00029 0.058 0 0 0 0.116 0.058 0.00022163 0.007757
CH4 0.24978 49.956 49.956 199.824 0 0 19.108059 0.07301628 2.55557
H2O 0.74933 149.866 0 299.732 149.866 0 103.396 0.39509985 13.82849
174.4518 1.0815969 0.000% 0.000%
CO 0 0.000 0 0 0.000 0 15.225886 0.0581816 2.036356
CO2 0.0006 0.120 0.1200 0 0.24 0 15.742056 0.0601540 2.10539
H2 0 0.000 0 0 0 0 108.16588 0.41332664 14.46643
TOTAL 1 200 50.076 499.556 150.106 0.116 261.69588 1

SECONDARY REFORMER
P= 35 atm Reaksi:
T= 996 C CH4 + 3/2.O2 --- CO + H2O + Q complete
F0= 200 mol/s CH4 + H2O === CO + 3H2 equilibrium
Kp1= 8624.8121 CO + H2O === CO2 + H2 equilibrium
Kp2= 0.59439235
alpha= 0.65578305 TRIAL carbon terkonversi mjd CO
beta= 0.32808383 TRIAL carbon terkonversi mjd CO2

Umpan, mol/s
Component yF F out, m/s yi Pi Kp1 Kp2 ∆Kp1 ∆Kp2
Fi total atom C atom H atom O atom N atom Ar
Ar 0.00209 0.418 0 0 0 0 0.418 0.418 0.001954 0.068388
O2 0.04396 8.792 0 0 17.584 0 0 0 0 0
N2 0.1636 32.72 0 0 0 65.44 0 32.72 0.152951 5.353269
8624.8108 0.5943923 0.000% 0.000%
 CH4 0.05924 11.848 11.848 47.392 0 0 0 0.48972753 0.002289 0.080124
8624.8108 0.5943923 0.000% 0.000%
H2O 0.31504 63.008 0 126.016 63.008 0 0 68.7504118 0.321376 11.24815
CO 0.045158 9.0316 9.0316 0 9.0316 0 0 19.9065567 0.093054 3.256881
CO2 0.047379 9.4758 9.4758 0 18.9516 0 0 9.95911575 0.046554 1.629396
H2 0.323537 64.7074 0 129.4148 0 0 0 81.6815332 0.381823 13.36379
TOTAL 1.000004 200.0008 30.3554 302.8228 108.5752 65.44 0.418 213.925345 1 35
 SECONDARY REFORMER
P= 35 atm Reaksi:
Tf= 764.3 C CH4 + 3/2.O2 --- CO + H2O + Q complete
F0= 200 mol/s CH4 + H2O === CO + 3H2 equilibrium
Kp1= 3445.23039 CO + H2O === CO2 + H2 equilibrium
Kp2= 0.68428409 Tref 25 C
T, C = 943.716038 TRIAL
alpha= 0.6089796 TRIAL carbon terkonversi mjd CO
beta= 0.35444214 TRIAL carbon terkonversi mjd CO2

dHf 25 C, Cp gas, Umpan, mol/s F out,

Component yF yi Pi Kp1 Kp2
gas J/mol/K Fi total atom C atom H atom O atom N atom Ar m/s
Ar 0.0020931 0 30.73107 0.41862 0 0 0 0 0.41862 0.41862 0.0019683 0.06889
O2 0.04395757 0 43.43719 8.791514 0 0 17.583029 0 0 0 0 0
N2 0.16359545 0 42.99395 32.71909 0 0 0 65.4381803 0 32.71909 0.15384 5.3843992
CH4 0.05923698 -74600 52.74516 11.8474 11.847395 47.38958 0 0 0 1.110326 0.0052206 0.1827202
3445.23 0.684284
H2O 0.31504303 -241800 49.6425 63.00861 0 126.0172 63.008607 0 0 68.57131 0.3224115 11.284401
CO 0.0451582 -110500 42.99395 9.03164 9.0316398 0 9.0316398 0 0 18.48546 0.0869157 3.0420492
CO2 0.04737885 -395300 54.8136 9.47577 9.4757699 0 18.95154 0 0 10.75902 0.0505872 1.7705526
H2 0.32353681 0 42.55072 64.70736 0 129.4147 0 0 0 80.6188 0.3790568 13.266988
TOTAL 1 200 30.354805 302.8215 108.57482 65.4381803 0.41862 212.6826 1 35