Specific Heat Constants (ideal gas state) C1 C2 C3 C4
CH4 (Tmax = 1500 K) 1.93E+01 5.21E-02 1.20E-05 1.13E-08
C6H14 (Tmax = 1500 K) -4.41E+00 5.82E-01 -3.12E-04 6.49E-08
S2 0.00E+00 0.00E+00 0.00E+00 0.00E+00
O2 (Tmax = 1500 K) 2.81E+01 -3.68E-06 1.75E-05 -1.07E-08
CO (Tmax = 1500 K) 3.09E+01 -1.29E-02 2.79E-05 -1.27E-08
CO2 (Tmax = 5000 K) 1.98E+01 7.34E-02 -5.60E-05 1.72E-08
H2O (Tmax = 2273.15) 3.22E+01 1.92E-03 1.06E-05 -3.60E-09
H2S (Tmax = 1500 K) 3.19E+01 1.44E-03 2.43E-05 -1.18E-08
H2 (Tmax = 1500 K) 2.71E+01 9.27E-03 -1.38E-05 7.65E-09
N2 (Tmax = 1500 K) 3.12E+01 -1.36E-02 2.68E-05 -1.17E-08
NH3 (Tmax = 1500K) 2.73E+01 2.38E-02 1.71E-05 -1.19E-08
Materials M.wt g/mol (∆Hf0 J/mol at 298K
CH4 16.01 -7.45E+04
C6H14 86.17 -1.67E+05
H2 2.01 0
H2O 18.01
-2.42E+05
CO2 44.01 -3.94E+05
CO 28.01 -1.11E+05
NH3 17.03 -4.59E+04
N2 28.01 0
O2 31.99 0
H2S 34.08
-2.06E+04
Arg 39.94 0
32.01 0
Sample calculation of energy balance
To calculate the heat capacity:
Q = m x CPx (Tout –Tin)
Q = duty (J/hr)
m = molar flow (kmol/hr)
CP = Specific heat capacity (kJkmol-1K-1)
ΔH = enthalpy (kJ/kmol)
ΔH˚f = standard enthalpy of formation (kJ/kmol)
OR
Q = (m x ΔH)out - (m x ΔH)in
T
ΔH (kJ / kmol) = ΔH˚f + ∫ CPdt
298 K
ΔH = ΔH˚f + [AT + (BT2/2) + (CT3/3) + (DT4/4)
ATR
Using: (m x ΔH) out - (m x ΔH) in = m (ΔH out - ΔH in)
m
ΔH (stream) = ΔH˚f + AT + BT2 + CT3 + DT4
2 3 4
M CH4=1961.22 Kmoles/hr
ΔH˚f = -7.45X105 J/MOL
ΔHin (1223K) = -7.45X105 + (19.251 x 1223) + (5.21x10-2 x 12232) /2+ (1.20 x10 -5 x12233)/3
+ 1.4 ×10-8×12234)/4
-[(19.251 x 298) + (5.21x10-2 x 2982) /2+ (1.20 x10 -5 x2983)/3 + (7.65 ×10-9×2984)/4 ]
ΔHin (1223K) = 1961.22 x-29181.89 = -5.72Ex 107 KJ/mol
ΔHout (1223K) = -7.45X105 + (19.251 x 1223) + (5.21x10-2 x 12232) /2+ (1.20 x10 -5 x12233)/3
+ 1.4 ×10-8×12234)/4
-[(19.251 x 298) + (5.21x10-2 x 2982) /2+ (1.20 x10 -5 x2983)/3 + (7.65 ×10-9×2984)/4 ]
MCH4out=39.22 kmoles/hr
ΔHout (1223K) = 39.22 x-29181.89 = -1.144x106 KJ/mol
Duty Q
Q = (m x ΔH)out - (m x ΔH)in== -1.144x 106 - 5.72Ex 107
KJ/mol=56056000/3600=15571KW
Do the same for the rest