EX 1: ADIABATIC FLAME TEMPERATURE FOR THE COMBUSTION OF PROPANE

REACTION
C3H8 + 5O2 -> 3CO2 + 4H2O

T air [K] 298.15 T ref [K] 298.15 R.H. 0.6

P sat (25°C)
T C3H8 [K] 298.15 P ref [Pa] 101325 3169
[Pa]
R [J/molK] 8.314
ΔHc C3H8
-2043000
[J/mol]
ΔHc CO
-283000
[J/mol]

CASE 1: STOICHIOMETRIC FEED OF THE REACTANTS

n H2O
y H2O 0.018765 0.455348 T OUT [K] 2339.6654
[mol/s]
n O2
α st_O2 5 5 fobj -6.04E-01
[mol/s]
a st_air 23.81

ΔH i out
Speies a b c n i in n i out
[W]
N2 3.28 5.93E-04 -4.00E+03 18.81 18.81 1.30E+06
CO2 5.457 1.05E-03 -1.16E+05 0 3 3.40E+05
H2O 3.47 1.45E-03 1.21E+04 0.455348 4.45534797 4.08E+05
O2 3.639 5.06E-04 -2.27E+04 5 0 0.00E+00
CO 3.376 5.57E-04 -3.10E+03 0 0 0.00E+00

CASE 2: EXCESS AIR 30%

e 0.3
n H2O
y H2O 0.018765 0.591952 T OUT [K] 1983.1891
[mol/s]
n O2
α st_O2 6.5 6.5 fobj 1.09E-02
[mol/s]
a st_air 30.953

ΔH i out
Speies a b c n i in n i out
[W]
N2 3.28 5.93E-04 -4.00E+03 24.453 24.453 1.35E+06
CO2 5.457 1.05E-03 -1.16E+05 0 3 2.71E+05
H2O 3.47 1.45E-03 1.21E+04 0.591952 4.59195236 3.31E+05
O2 3.639 5.06E-04 -2.27E+04 6.5 1.5 8.78E+04
CO 3.376 5.57E-04 -3.10E+03 0 0 0.00E+00
 CASE 3: CASE 2 + SELECTIVITY CO

e 0.3
y H2O 0.018765 n H2O 0.591952 T OUT [K] 1922.9747
[mol/s]

α st_O2 6.5 n O2 6.5 fobj -1.99E-02

[mol/s]
a st_air 30.953

Speies a b c n i in n i out ΔH i out

[W]
N2 3.28 5.93E-04 -4.00E+03 24.453 24.453 1.30E+06
CO2 5.457 1.05E-03 -1.16E+05 0 2.7 2.34E+05
H2O 3.47 1.45E-03 1.21E+04 0.591952 4.59195236 3.16E+05
O2 3.639 5.06E-04 -2.27E+04 6.5 1.65 9.28E+04
CO 3.376 5.57E-04 -3.10E+03 0 0.3 1.62E+04