k_inf = 4.82E+17 T^(-1.16) exp(-1145 cal/mol /RT) cm3/mol s
F_cent = (1-0.6027) exp(-T/208) + 0.6027 exp(-T/3922) + exp(-10180/T)
Third-body efficiencies:
Reference | cm3/mol s |
---|---|
GRI-Mech | 8.3E8 |
Cribb et al. (1984) | 5.4E8 |
Spindler et al. (1982) | 1.0E9 |
Hidaka et al. (1989) | 3.2E8 |
REFERENCES:
PRESSURE = 0.1 atm N2 ______________________________________________________________________ Temp delta-S delta-H kf kr Keq (K) (cal/mol K) (kcal/mol) ----(mol,cm3,s)----- (cm3/mol) ______________________________________________________________________ 300 -33.1 -93.0 1.67E+13 2.10E-52 7.96E+64 500 -35.3 -93.8 1.20E+13 1.47E-25 8.17E+37 1000 -35.8 -94.1 1.15E+12 2.56E-06 4.49E+17 1500 -35.2 -93.3 1.42E+11 1.44E+00 9.88E+10 2000 -34.6 -92.2 2.64E+10 4.81E+02 5.48E+07 2500 -34.1 -91.1 6.61E+09 9.76E+03 6.77E+05 3000 -33.7 -90.0 2.06E+09 5.30E+04 3.89E+04 ______________________________________________________________________ PRESSURE = 1 atm N2 ______________________________________________________________________ Temp delta-S delta-H kf kr Keq (K) (cal/mol K) (kcal/mol) ----(mol,cm3,s)----- (cm3/mol) ______________________________________________________________________ 300 -33.1 -93.0 4.74E+13 5.95E-52 7.96E+64 500 -35.3 -93.8 4.07E+13 4.98E-25 8.17E+37 1000 -35.8 -94.1 7.95E+12 1.77E-05 4.49E+17 1500 -35.2 -93.3 1.20E+12 1.21E+01 9.88E+10 2000 -34.6 -92.2 2.35E+11 4.29E+03 5.48E+07 2500 -34.1 -91.1 6.04E+10 8.92E+04 6.77E+05 3000 -33.7 -90.0 1.91E+10 4.91E+05 3.89E+04 ______________________________________________________________________ PRESSURE = 10 atm N2 ______________________________________________________________________ Temp delta-S delta-H kf kr Keq (K) (cal/mol K) (kcal/mol) ----(mol,cm3,s)----- (cm3/mol) ______________________________________________________________________ 300 -33.1 -93.0 8.00E+13 1.00E-51 7.96E+64 500 -35.3 -93.8 8.23E+13 1.01E-24 8.17E+37 1000 -35.8 -94.1 2.66E+13 3.25E-05 4.49E+17 1500 -35.2 -93.3 7.13E+12 7.22E+01 9.88E+10 2000 -34.6 -92.2 1.77E+12 3.23E+04 5.48E+07 2500 -34.1 -91.1 4.98E+11 7.36E+05 6.77E+05 3000 -33.7 -90.0 1.64E+11 4.22E+06 3.89E+04 ______________________________________________________________________
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