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Fixes to units for some training reactions and depositories
1 parent cf39e80 commit bd0c7e4

2 files changed

Lines changed: 12 additions & 12 deletions

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input/kinetics/families/H_Abstraction/NIST/reactions.py

Lines changed: 1 addition & 1 deletion
Original file line numberDiff line numberDiff line change
@@ -38348,7 +38348,7 @@
3834838348
label = "C6H12 + HO2 <=> H2O2 + C6H11",
3834938349
degeneracy = 12,
3835038350
kinetics = Arrhenius(
38351-
A = (0.0103, 'm^3/(mol*s)', '+|-', 0.00047),
38351+
A = (2.04e+07, 'm^3/(mol*s)', '*|/', 2.95),
3835238352
n = 0,
3835338353
Ea = (74.3, 'kJ/mol', '+|-', 4.9),
3835438354
T0 = (1, 'K'),

input/kinetics/families/H_Abstraction/training/reactions.py

Lines changed: 11 additions & 11 deletions
Original file line numberDiff line numberDiff line change
@@ -1951,7 +1951,7 @@
19511951
label = "CH4b + SH <=> CH3_p1 + H2S",
19521952
degeneracy = 1,
19531953
kinetics = Arrhenius(
1954-
A = (7.78e-22, 'cm^3/(mol*s)'),
1954+
A = (4.69e+02, 'cm^3/(mol*s)'),
19551955
n = 3.02,
19561956
Ea = (66.3, 'kJ/mol'),
19571957
T0 = (1, 'K'),
@@ -1971,7 +1971,7 @@
19711971
label = "C2H6 + SH <=> C2H5b + H2S",
19721972
degeneracy = 1,
19731973
kinetics = Arrhenius(
1974-
A = (4.37e-22, 'cm^3/(mol*s)'),
1974+
A = (2.63e+02, 'cm^3/(mol*s)'),
19751975
n = 3.41,
19761976
Ea = (42.2, 'kJ/mol'),
19771977
T0 = (1, 'K'),
@@ -1991,7 +1991,7 @@
19911991
label = "C3H8 + SH <=> CH2CH2CH3 + H2S",
19921992
degeneracy = 1,
19931993
kinetics = Arrhenius(
1994-
A = (8.51e-22, 'cm^3/(mol*s)'),
1994+
A = (5.12e+02, 'cm^3/(mol*s)'),
19951995
n = 3.39,
19961996
Ea = (43.2, 'kJ/mol'),
19971997
T0 = (1, 'K'),
@@ -2011,7 +2011,7 @@
20112011
label = "C3H8 + SH <=> CH3CHCH3 + H2S",
20122012
degeneracy = 1,
20132013
kinetics = Arrhenius(
2014-
A = (5.25e-18, 'cm^3/(mol*s)'),
2014+
A = (3.16e+06, 'cm^3/(mol*s)'),
20152015
n = 1.79,
20162016
Ea = (34.6, 'kJ/mol'),
20172017
T0 = (1, 'K'),
@@ -2031,7 +2031,7 @@
20312031
label = "C4H10 + SH <=> CH3CHCH2CH3 + H2S",
20322032
degeneracy = 1,
20332033
kinetics = Arrhenius(
2034-
A = (3.26e-20, 'cm^3/(mol*s)'),
2034+
A = (1.94e+04, 'cm^3/(mol*s)'),
20352035
n = 2.53,
20362036
Ea = (31.3, 'kJ/mol'),
20372037
T0 = (1, 'K'),
@@ -2051,7 +2051,7 @@
20512051
label = "C2H4 + SH <=> CHCH2 + H2S",
20522052
degeneracy = 1,
20532053
kinetics = Arrhenius(
2054-
A = (2.96e-25, 'cm^3/(mol*s)'),
2054+
A = (1.78e-01, 'cm^3/(mol*s)'),
20552055
n = 3.31,
20562056
Ea = (81.3, 'kJ/mol'),
20572057
T0 = (1, 'K'),
@@ -2071,7 +2071,7 @@
20712071
label = "C3H6 + SH <=> CH2CHCH2 + H2S",
20722072
degeneracy = 1,
20732073
kinetics = Arrhenius(
2074-
A = (2.00e-24, 'cm^3/(mol*s)'),
2074+
A = (1.20e+00, 'cm^3/(mol*s)'),
20752075
n = 3.79,
20762076
Ea = (9.9, 'kJ/mol'),
20772077
T0 = (1, 'K'),
@@ -2091,7 +2091,7 @@
20912091
label = "C4H8-4 + SH <=> CH2CHCHCH3 + H2S",
20922092
degeneracy = 1,
20932093
kinetics = Arrhenius(
2094-
A = (2.19e-23, 'cm^3/(mol*s)'),
2094+
A = (1.32e+01, 'cm^3/(mol*s)'),
20952095
n = 3.40,
20962096
Ea = (0.4, 'kJ/mol'),
20972097
T0 = (1, 'K'),
@@ -2111,7 +2111,7 @@
21112111
label = "C4H8-6 + SH <=> CH2CCH2CH3 + H2S",
21122112
degeneracy = 1,
21132113
kinetics = Arrhenius(
2114-
A = (2.69e-22, 'cm^3/(mol*s)'),
2114+
A = (1.62e+02, 'cm^3/(mol*s)'),
21152115
n = 3.32,
21162116
Ea = (36.5, 'kJ/mol'),
21172117
T0 = (1, 'K'),
@@ -2131,7 +2131,7 @@
21312131
label = "C3H4-1 + SH <=> CH2CCH + H2S",
21322132
degeneracy = 1,
21332133
kinetics = Arrhenius(
2134-
A = (2.51e-22, 'cm^3/(mol*s)'),
2134+
A = (1.51e+02, 'cm^3/(mol*s)'),
21352135
n = 3.37,
21362136
Ea = (30.2, 'kJ/mol'),
21372137
T0 = (1, 'K'),
@@ -2151,7 +2151,7 @@
21512151
label = "C4H6 + SH <=> CHCCHCH3 + H2S",
21522152
degeneracy = 1,
21532153
kinetics = Arrhenius(
2154-
A = (1.10e-22, 'cm^3/(mol*s)'),
2154+
A = (6.62e+01, 'cm^3/(mol*s)'),
21552155
n = 3.32,
21562156
Ea = (8.01, 'kJ/mol'),
21572157
T0 = (1, 'K'),

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