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case-khalifa/constant/GRI30/grimech30.foam

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species
53
(
H2
H
O
O2
OH
H2O
HO2
H2O2
C
CH
CH2
CH2(S)
CH3
CH4
CO
CO2
HCO
CH2O
CH2OH
CH3O
CH3OH
C2H
C2H2
C2H3
C2H4
C2H5
C2H6
HCCO
CH2CO
HCCOH
N
NH
NH2
NH3
NNH
NO
NO2
N2O
HNO
CN
HCN
H2CN
HCNN
HCNO
HOCN
HNCO
NCO
N2
AR
C3H7
C3H8
CH2CHO
CH3CHO
)
;
reactions
{
un-named-reaction-0
{
type reversiblethirdBodyArrheniusReaction;
reaction "2O = O2";
A 1.2e+11;
beta -1;
Ta 0;
coeffs
53
(
(H2 2.4)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 15.4)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.75)
(CO2 3.6)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.83)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-1
{
type reversiblethirdBodyArrheniusReaction;
reaction "O + H = OH";
A 5e+11;
beta -1;
Ta 0;
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-2
{
type reversibleArrheniusReaction;
reaction "O + H2 = H + OH";
A 38.7;
beta 2.7;
Ta 3149.98;
}
un-named-reaction-3
{
type reversibleArrheniusReaction;
reaction "O + HO2 = OH + O2";
A 2e+10;
beta 0;
Ta 0;
}
un-named-reaction-4
{
type reversibleArrheniusReaction;
reaction "O + H2O2 = OH + HO2";
A 9630;
beta 2;
Ta 2012.76;
}
un-named-reaction-5
{
type reversibleArrheniusReaction;
reaction "O + CH = H + CO";
A 5.7e+10;
beta 0;
Ta 0;
}
un-named-reaction-6
{
type reversibleArrheniusReaction;
reaction "O + CH2 = H + HCO";
A 8e+10;
beta 0;
Ta 0;
}
un-named-reaction-7
{
type reversibleArrheniusReaction;
reaction "O + CH2(S) = H2 + CO";
A 1.5e+10;
beta 0;
Ta 0;
}
un-named-reaction-8
{
type reversibleArrheniusReaction;
reaction "O + CH2(S) = H + HCO";
A 1.5e+10;
beta 0;
Ta 0;
}
un-named-reaction-9
{
type reversibleArrheniusReaction;
reaction "O + CH3 = H + CH2O";
A 5.06e+10;
beta 0;
Ta 0;
}
un-named-reaction-10
{
type reversibleArrheniusReaction;
reaction "O + CH4 = OH + CH3";
A 1.02e+06;
beta 1.5;
Ta 4327.44;
}
un-named-reaction-11
{
type reversibleArrheniusLindemannFallOffReaction;
reaction "O + CO = CO2";
k0
{
A 6.02e+08;
beta 0;
Ta 1509.57;
}
kInf
{
A 1.8e+07;
beta 0;
Ta 1200.11;
}
F
{
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 6)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 3.5)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.5)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-12
{
type reversibleArrheniusReaction;
reaction "O + HCO = OH + CO";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-13
{
type reversibleArrheniusReaction;
reaction "O + HCO = H + CO2";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-14
{
type reversibleArrheniusReaction;
reaction "O + CH2O = OH + HCO";
A 3.9e+10;
beta 0;
Ta 1781.3;
}
un-named-reaction-15
{
type reversibleArrheniusReaction;
reaction "O + CH2OH = OH + CH2O";
A 1e+10;
beta 0;
Ta 0;
}
un-named-reaction-16
{
type reversibleArrheniusReaction;
reaction "O + CH3O = OH + CH2O";
A 1e+10;
beta 0;
Ta 0;
}
un-named-reaction-17
{
type reversibleArrheniusReaction;
reaction "O + CH3OH = OH + CH2OH";
A 388;
beta 2.5;
Ta 1559.89;
}
un-named-reaction-18
{
type reversibleArrheniusReaction;
reaction "O + CH3OH = OH + CH3O";
A 130;
beta 2.5;
Ta 2515.96;
}
un-named-reaction-19
{
type reversibleArrheniusReaction;
reaction "O + C2H = CH + CO";
A 5e+10;
beta 0;
Ta 0;
}
un-named-reaction-20
{
type reversibleArrheniusReaction;
reaction "O + C2H2 = H + HCCO";
A 13500;
beta 2;
Ta 956.063;
}
un-named-reaction-21
{
type reversibleArrheniusReaction;
reaction "O + C2H2 = OH + C2H";
A 4.6e+16;
beta -1.41;
Ta 14567.4;
}
un-named-reaction-22
{
type reversibleArrheniusReaction;
reaction "O + C2H2 = CO + CH2";
A 6940;
beta 2;
Ta 956.063;
}
un-named-reaction-23
{
type reversibleArrheniusReaction;
reaction "O + C2H3 = H + CH2CO";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-24
{
type reversibleArrheniusReaction;
reaction "O + C2H4 = CH3 + HCO";
A 12500;
beta 1.83;
Ta 110.702;
}
un-named-reaction-25
{
type reversibleArrheniusReaction;
reaction "O + C2H5 = CH3 + CH2O";
A 2.24e+10;
beta 0;
Ta 0;
}
un-named-reaction-26
{
type reversibleArrheniusReaction;
reaction "O + C2H6 = OH + C2H5";
A 89800;
beta 1.92;
Ta 2863.16;
}
un-named-reaction-27
{
type reversibleArrheniusReaction;
reaction "O + HCCO = H + 2CO";
A 1e+11;
beta 0;
Ta 0;
}
un-named-reaction-28
{
type reversibleArrheniusReaction;
reaction "O + CH2CO = OH + HCCO";
A 1e+10;
beta 0;
Ta 4025.53;
}
un-named-reaction-29
{
type reversibleArrheniusReaction;
reaction "O + CH2CO = CH2 + CO2";
A 1.75e+09;
beta 0;
Ta 679.308;
}
un-named-reaction-30
{
type reversibleArrheniusReaction;
reaction "O2 + CO = O + CO2";
A 2.5e+09;
beta 0;
Ta 24052.5;
}
un-named-reaction-31
{
type reversibleArrheniusReaction;
reaction "O2 + CH2O = HO2 + HCO";
A 1e+11;
beta 0;
Ta 20127.6;
}
un-named-reaction-32
{
type reversiblethirdBodyArrheniusReaction;
reaction "H + O2 = HO2";
A 2.8e+12;
beta -0.86;
Ta 0;
coeffs
53
(
(H2 1)
(H 1)
(O 1)
(O2 0)
(OH 1)
(H2O 0)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 1)
(CO 0.75)
(CO2 1.5)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 1.5)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 0)
(AR 0)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-33
{
type reversibleArrheniusReaction;
reaction "H + 2O2 = HO2 + O2";
A 2.08e+13;
beta -1.24;
Ta 0;
}
un-named-reaction-34
{
type reversibleArrheniusReaction;
reaction "H + O2 + H2O = HO2 + H2O";
A 1.126e+13;
beta -0.76;
Ta 0;
}
un-named-reaction-35
{
type reversibleArrheniusReaction;
reaction "H + O2 + N2 = HO2 + N2";
A 2.6e+13;
beta -1.24;
Ta 0;
}
un-named-reaction-36
{
type reversibleArrheniusReaction;
reaction "H + O2 + AR = HO2 + AR";
A 7e+11;
beta -0.8;
Ta 0;
}
un-named-reaction-37
{
type reversibleArrheniusReaction;
reaction "H + O2 = O + OH";
A 2.65e+13;
beta -0.6707;
Ta 8574.88;
}
un-named-reaction-38
{
type reversiblethirdBodyArrheniusReaction;
reaction "2H = H2";
A 1e+12;
beta -1;
Ta 0;
coeffs
53
(
(H2 0)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 0)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1)
(CO2 0)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.63)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-39
{
type reversibleArrheniusReaction;
reaction "2H + H2 = 2H2";
A 9e+10;
beta -0.6;
Ta 0;
}
un-named-reaction-40
{
type reversibleArrheniusReaction;
reaction "2H + H2O = H2 + H2O";
A 6e+13;
beta -1.25;
Ta 0;
}
un-named-reaction-41
{
type reversibleArrheniusReaction;
reaction "2H + CO2 = H2 + CO2";
A 5.5e+14;
beta -2;
Ta 0;
}
un-named-reaction-42
{
type reversiblethirdBodyArrheniusReaction;
reaction "H + OH = H2O";
A 2.2e+16;
beta -2;
Ta 0;
coeffs
53
(
(H2 0.73)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 3.65)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1)
(CO2 1)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.38)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-43
{
type reversibleArrheniusReaction;
reaction "H + HO2 = O + H2O";
A 3.97e+09;
beta 0;
Ta 337.641;
}
un-named-reaction-44
{
type reversibleArrheniusReaction;
reaction "H + HO2 = O2 + H2";
A 4.48e+10;
beta 0;
Ta 537.408;
}
un-named-reaction-45
{
type reversibleArrheniusReaction;
reaction "H + HO2 = 2OH";
A 8.4e+10;
beta 0;
Ta 319.526;
}
un-named-reaction-46
{
type reversibleArrheniusReaction;
reaction "H + H2O2 = HO2 + H2";
A 12100;
beta 2;
Ta 2616.59;
}
un-named-reaction-47
{
type reversibleArrheniusReaction;
reaction "H + H2O2 = OH + H2O";
A 1e+10;
beta 0;
Ta 1811.49;
}
un-named-reaction-48
{
type reversibleArrheniusReaction;
reaction "H + CH = C + H2";
A 1.65e+11;
beta 0;
Ta 0;
}
un-named-reaction-49
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + CH2 = CH3";
k0
{
A 1.04e+20;
beta -2.76;
Ta 805.106;
}
kInf
{
A 6e+11;
beta 0;
Ta 0;
}
F
{
alpha 0.562;
Tsss 91;
Ts 5836;
Tss 8552;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-50
{
type reversibleArrheniusReaction;
reaction "H + CH2(S) = CH + H2";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-51
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + CH3 = CH4";
k0
{
A 2.62e+27;
beta -4.76;
Ta 1227.79;
}
kInf
{
A 1.39e+13;
beta -0.534;
Ta 269.711;
}
F
{
alpha 0.783;
Tsss 74;
Ts 2941;
Tss 6964;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 3)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-52
{
type reversibleArrheniusReaction;
reaction "H + CH4 = CH3 + H2";
A 660000;
beta 1.62;
Ta 5454.59;
}
un-named-reaction-53
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + HCO = CH2O";
k0
{
A 2.47e+18;
beta -2.57;
Ta 213.856;
}
kInf
{
A 1.09e+09;
beta 0.48;
Ta -130.83;
}
F
{
alpha 0.7824;
Tsss 271;
Ts 2755;
Tss 6570;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-54
{
type reversibleArrheniusReaction;
reaction "H + HCO = H2 + CO";
A 7.34e+10;
beta 0;
Ta 0;
}
un-named-reaction-55
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + CH2O = CH2OH";
k0
{
A 1.27e+26;
beta -4.82;
Ta 3285.84;
}
kInf
{
A 5.4e+08;
beta 0.454;
Ta 1811.49;
}
F
{
alpha 0.7187;
Tsss 103;
Ts 1291;
Tss 4160;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 1)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-56
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + CH2O = CH3O";
k0
{
A 2.2e+24;
beta -4.8;
Ta 2797.74;
}
kInf
{
A 5.4e+08;
beta 0.454;
Ta 1308.3;
}
F
{
alpha 0.758;
Tsss 94;
Ts 1555;
Tss 4200;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 1)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-57
{
type reversibleArrheniusReaction;
reaction "H + CH2O = HCO + H2";
A 57400;
beta 1.9;
Ta 1379.75;
}
un-named-reaction-58
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + CH2OH = CH3OH";
k0
{
A 4.36e+25;
beta -4.65;
Ta 2556.21;
}
kInf
{
A 1.055e+09;
beta 0.5;
Ta 43.2744;
}
F
{
alpha 0.6;
Tsss 100;
Ts 90000;
Tss 10000;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 1)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-59
{
type reversibleArrheniusReaction;
reaction "H + CH2OH = H2 + CH2O";
A 2e+10;
beta 0;
Ta 0;
}
un-named-reaction-60
{
type reversibleArrheniusReaction;
reaction "H + CH2OH = OH + CH3";
A 1.65e+08;
beta 0.65;
Ta -142.906;
}
un-named-reaction-61
{
type reversibleArrheniusReaction;
reaction "H + CH2OH = CH2(S) + H2O";
A 3.28e+10;
beta -0.09;
Ta 306.947;
}
un-named-reaction-62
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + CH3O = CH3OH";
k0
{
A 4.66e+35;
beta -7.44;
Ta 7084.93;
}
kInf
{
A 2.43e+09;
beta 0.515;
Ta 25.1596;
}
F
{
alpha 0.7;
Tsss 100;
Ts 90000;
Tss 10000;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 1)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-63
{
type reversibleArrheniusReaction;
reaction "H + CH3O = H + CH2OH";
A 41500;
beta 1.63;
Ta 968.14;
}
un-named-reaction-64
{
type reversibleArrheniusReaction;
reaction "H + CH3O = H2 + CH2O";
A 2e+10;
beta 0;
Ta 0;
}
un-named-reaction-65
{
type reversibleArrheniusReaction;
reaction "H + CH3O = OH + CH3";
A 1.5e+09;
beta 0.5;
Ta -55.351;
}
un-named-reaction-66
{
type reversibleArrheniusReaction;
reaction "H + CH3O = CH2(S) + H2O";
A 2.62e+11;
beta -0.23;
Ta 538.415;
}
un-named-reaction-67
{
type reversibleArrheniusReaction;
reaction "H + CH3OH = CH2OH + H2";
A 17000;
beta 2.1;
Ta 2450.54;
}
un-named-reaction-68
{
type reversibleArrheniusReaction;
reaction "H + CH3OH = CH3O + H2";
A 4200;
beta 2.1;
Ta 2450.54;
}
un-named-reaction-69
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + C2H = C2H2";
k0
{
A 3.75e+27;
beta -4.8;
Ta 956.063;
}
kInf
{
A 1e+14;
beta -1;
Ta 0;
}
F
{
alpha 0.6464;
Tsss 132;
Ts 1315;
Tss 5566;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-70
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + C2H2 = C2H3";
k0
{
A 3.8e+34;
beta -7.27;
Ta 3633.04;
}
kInf
{
A 5.6e+09;
beta 0;
Ta 1207.66;
}
F
{
alpha 0.7507;
Tsss 98.5;
Ts 1302;
Tss 4167;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-71
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + C2H3 = C2H4";
k0
{
A 1.4e+24;
beta -3.86;
Ta 1670.59;
}
kInf
{
A 6.08e+09;
beta 0.27;
Ta 140.894;
}
F
{
alpha 0.782;
Tsss 207.5;
Ts 2663;
Tss 6095;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-72
{
type reversibleArrheniusReaction;
reaction "H + C2H3 = H2 + C2H2";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-73
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + C2H4 = C2H5";
k0
{
A 6e+35;
beta -7.62;
Ta 3507.24;
}
kInf
{
A 5.4e+08;
beta 0.454;
Ta 915.808;
}
F
{
alpha 0.9753;
Tsss 210;
Ts 984;
Tss 4374;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-74
{
type reversibleArrheniusReaction;
reaction "H + C2H4 = C2H3 + H2";
A 1325;
beta 2.53;
Ta 6159.06;
}
un-named-reaction-75
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + C2H5 = C2H6";
k0
{
A 1.99e+35;
beta -7.08;
Ta 3363.83;
}
kInf
{
A 5.21e+14;
beta -0.99;
Ta 795.042;
}
F
{
alpha 0.8422;
Tsss 125;
Ts 2219;
Tss 6882;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-76
{
type reversibleArrheniusReaction;
reaction "H + C2H5 = H2 + C2H4";
A 2e+09;
beta 0;
Ta 0;
}
un-named-reaction-77
{
type reversibleArrheniusReaction;
reaction "H + C2H6 = C2H5 + H2";
A 115000;
beta 1.9;
Ta 3789.03;
}
un-named-reaction-78
{
type reversibleArrheniusReaction;
reaction "H + HCCO = CH2(S) + CO";
A 1e+11;
beta 0;
Ta 0;
}
un-named-reaction-79
{
type reversibleArrheniusReaction;
reaction "H + CH2CO = HCCO + H2";
A 5e+10;
beta 0;
Ta 4025.53;
}
un-named-reaction-80
{
type reversibleArrheniusReaction;
reaction "H + CH2CO = CH3 + CO";
A 1.13e+10;
beta 0;
Ta 1724.94;
}
un-named-reaction-81
{
type reversibleArrheniusReaction;
reaction "H + HCCOH = H + CH2CO";
A 1e+10;
beta 0;
Ta 0;
}
un-named-reaction-82
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H2 + CO = CH2O";
k0
{
A 5.07e+21;
beta -3.42;
Ta 42444.2;
}
kInf
{
A 43000;
beta 1.5;
Ta 40054;
}
F
{
alpha 0.932;
Tsss 197;
Ts 1540;
Tss 10300;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-83
{
type reversibleArrheniusReaction;
reaction "OH + H2 = H + H2O";
A 216000;
beta 1.51;
Ta 1725.95;
}
un-named-reaction-84
{
type reversibleArrheniusTroeFallOffReaction;
reaction "2OH = H2O2";
k0
{
A 2.3e+12;
beta -0.9;
Ta -855.425;
}
kInf
{
A 7.4e+10;
beta -0.37;
Ta 0;
}
F
{
alpha 0.7346;
Tsss 94;
Ts 1756;
Tss 5182;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-85
{
type reversibleArrheniusReaction;
reaction "2OH = O + H2O";
A 35.7;
beta 2.4;
Ta -1061.73;
}
un-named-reaction-86
{
type reversibleArrheniusReaction;
reaction "OH + HO2 = O2 + H2O";
A 1.45e+10;
beta 0;
Ta -251.596;
}
un-named-reaction-87
{
type reversibleArrheniusReaction;
reaction "OH + H2O2 = HO2 + H2O";
A 2e+09;
beta 0;
Ta 214.863;
}
un-named-reaction-88
{
type reversibleArrheniusReaction;
reaction "OH + H2O2 = HO2 + H2O";
A 1.7e+15;
beta 0;
Ta 14798.9;
}
un-named-reaction-89
{
type reversibleArrheniusReaction;
reaction "OH + C = H + CO";
A 5e+10;
beta 0;
Ta 0;
}
un-named-reaction-90
{
type reversibleArrheniusReaction;
reaction "OH + CH = H + HCO";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-91
{
type reversibleArrheniusReaction;
reaction "OH + CH2 = H + CH2O";
A 2e+10;
beta 0;
Ta 0;
}
un-named-reaction-92
{
type reversibleArrheniusReaction;
reaction "OH + CH2 = CH + H2O";
A 11300;
beta 2;
Ta 1509.57;
}
un-named-reaction-93
{
type reversibleArrheniusReaction;
reaction "OH + CH2(S) = H + CH2O";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-94
{
type reversibleArrheniusTroeFallOffReaction;
reaction "OH + CH3 = CH3OH";
k0
{
A 4e+30;
beta -5.92;
Ta 1580.02;
}
kInf
{
A 2.79e+15;
beta -1.43;
Ta 669.244;
}
F
{
alpha 0.412;
Tsss 195;
Ts 5900;
Tss 6394;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 1)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-95
{
type reversibleArrheniusReaction;
reaction "OH + CH3 = CH2 + H2O";
A 56000;
beta 1.6;
Ta 2727.3;
}
un-named-reaction-96
{
type reversibleArrheniusReaction;
reaction "OH + CH3 = CH2(S) + H2O";
A 6.44e+14;
beta -1.34;
Ta 713.022;
}
un-named-reaction-97
{
type reversibleArrheniusReaction;
reaction "OH + CH4 = CH3 + H2O";
A 100000;
beta 1.6;
Ta 1569.96;
}
un-named-reaction-98
{
type reversibleArrheniusReaction;
reaction "OH + CO = H + CO2";
A 47600;
beta 1.228;
Ta 35.2234;
}
un-named-reaction-99
{
type reversibleArrheniusReaction;
reaction "OH + HCO = H2O + CO";
A 5e+10;
beta 0;
Ta 0;
}
un-named-reaction-100
{
type reversibleArrheniusReaction;
reaction "OH + CH2O = HCO + H2O";
A 3.43e+06;
beta 1.18;
Ta -224.926;
}
un-named-reaction-101
{
type reversibleArrheniusReaction;
reaction "OH + CH2OH = H2O + CH2O";
A 5e+09;
beta 0;
Ta 0;
}
un-named-reaction-102
{
type reversibleArrheniusReaction;
reaction "OH + CH3O = H2O + CH2O";
A 5e+09;
beta 0;
Ta 0;
}
un-named-reaction-103
{
type reversibleArrheniusReaction;
reaction "OH + CH3OH = CH2OH + H2O";
A 1440;
beta 2;
Ta -422.681;
}
un-named-reaction-104
{
type reversibleArrheniusReaction;
reaction "OH + CH3OH = CH3O + H2O";
A 6300;
beta 2;
Ta 754.787;
}
un-named-reaction-105
{
type reversibleArrheniusReaction;
reaction "OH + C2H = H + HCCO";
A 2e+10;
beta 0;
Ta 0;
}
un-named-reaction-106
{
type reversibleArrheniusReaction;
reaction "OH + C2H2 = H + CH2CO";
A 2.18e-07;
beta 4.5;
Ta -503.191;
}
un-named-reaction-107
{
type reversibleArrheniusReaction;
reaction "OH + C2H2 = H + HCCOH";
A 504;
beta 2.3;
Ta 6793.08;
}
un-named-reaction-108
{
type reversibleArrheniusReaction;
reaction "OH + C2H2 = C2H + H2O";
A 33700;
beta 2;
Ta 7044.68;
}
un-named-reaction-109
{
type reversibleArrheniusReaction;
reaction "OH + C2H2 = CH3 + CO";
A 4.83e-07;
beta 4;
Ta -1006.38;
}
un-named-reaction-110
{
type reversibleArrheniusReaction;
reaction "OH + C2H3 = H2O + C2H2";
A 5e+09;
beta 0;
Ta 0;
}
un-named-reaction-111
{
type reversibleArrheniusReaction;
reaction "OH + C2H4 = C2H3 + H2O";
A 3600;
beta 2;
Ta 1257.98;
}
un-named-reaction-112
{
type reversibleArrheniusReaction;
reaction "OH + C2H6 = C2H5 + H2O";
A 3540;
beta 2.12;
Ta 437.776;
}
un-named-reaction-113
{
type reversibleArrheniusReaction;
reaction "OH + CH2CO = HCCO + H2O";
A 7.5e+09;
beta 0;
Ta 1006.38;
}
un-named-reaction-114
{
type reversibleArrheniusReaction;
reaction "2HO2 = O2 + H2O2";
A 1.3e+08;
beta 0;
Ta -820.202;
}
un-named-reaction-115
{
type reversibleArrheniusReaction;
reaction "2HO2 = O2 + H2O2";
A 4.2e+11;
beta 0;
Ta 6038.29;
}
un-named-reaction-116
{
type reversibleArrheniusReaction;
reaction "HO2 + CH2 = OH + CH2O";
A 2e+10;
beta 0;
Ta 0;
}
un-named-reaction-117
{
type reversibleArrheniusReaction;
reaction "HO2 + CH3 = O2 + CH4";
A 1e+09;
beta 0;
Ta 0;
}
un-named-reaction-118
{
type reversibleArrheniusReaction;
reaction "HO2 + CH3 = OH + CH3O";
A 3.78e+10;
beta 0;
Ta 0;
}
un-named-reaction-119
{
type reversibleArrheniusReaction;
reaction "HO2 + CO = OH + CO2";
A 1.5e+11;
beta 0;
Ta 11875.3;
}
un-named-reaction-120
{
type reversibleArrheniusReaction;
reaction "HO2 + CH2O = HCO + H2O2";
A 5600;
beta 2;
Ta 6038.29;
}
un-named-reaction-121
{
type reversibleArrheniusReaction;
reaction "C + O2 = O + CO";
A 5.8e+10;
beta 0;
Ta 289.838;
}
un-named-reaction-122
{
type reversibleArrheniusReaction;
reaction "C + CH2 = H + C2H";
A 5e+10;
beta 0;
Ta 0;
}
un-named-reaction-123
{
type reversibleArrheniusReaction;
reaction "C + CH3 = H + C2H2";
A 5e+10;
beta 0;
Ta 0;
}
un-named-reaction-124
{
type reversibleArrheniusReaction;
reaction "CH + O2 = O + HCO";
A 6.71e+10;
beta 0;
Ta 0;
}
un-named-reaction-125
{
type reversibleArrheniusReaction;
reaction "CH + H2 = H + CH2";
A 1.08e+11;
beta 0;
Ta 1564.92;
}
un-named-reaction-126
{
type reversibleArrheniusReaction;
reaction "CH + H2O = H + CH2O";
A 5.71e+09;
beta 0;
Ta -379.909;
}
un-named-reaction-127
{
type reversibleArrheniusReaction;
reaction "CH + CH2 = H + C2H2";
A 4e+10;
beta 0;
Ta 0;
}
un-named-reaction-128
{
type reversibleArrheniusReaction;
reaction "CH + CH3 = H + C2H3";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-129
{
type reversibleArrheniusReaction;
reaction "CH + CH4 = H + C2H4";
A 6e+10;
beta 0;
Ta 0;
}
un-named-reaction-130
{
type reversibleArrheniusTroeFallOffReaction;
reaction "CH + CO = HCCO";
k0
{
A 2.69e+22;
beta -3.74;
Ta 974.178;
}
kInf
{
A 5e+10;
beta 0;
Ta 0;
}
F
{
alpha 0.5757;
Tsss 237;
Ts 1652;
Tss 5069;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-131
{
type reversibleArrheniusReaction;
reaction "CH + CO2 = HCO + CO";
A 1.9e+11;
beta 0;
Ta 7946.4;
}
un-named-reaction-132
{
type reversibleArrheniusReaction;
reaction "CH + CH2O = H + CH2CO";
A 9.46e+10;
beta 0;
Ta -259.143;
}
un-named-reaction-133
{
type reversibleArrheniusReaction;
reaction "CH + HCCO = CO + C2H2";
A 5e+10;
beta 0;
Ta 0;
}
un-named-reaction-134
{
type irreversibleArrheniusReaction;
reaction "CH2 + O2 = OH + H + CO";
A 5e+09;
beta 0;
Ta 754.787;
}
un-named-reaction-135
{
type reversibleArrheniusReaction;
reaction "CH2 + H2 = H + CH3";
A 500;
beta 2;
Ta 3638.07;
}
un-named-reaction-136
{
type reversibleArrheniusReaction;
reaction "2CH2 = H2 + C2H2";
A 1.6e+12;
beta 0;
Ta 6010.12;
}
un-named-reaction-137
{
type reversibleArrheniusReaction;
reaction "CH2 + CH3 = H + C2H4";
A 4e+10;
beta 0;
Ta 0;
}
un-named-reaction-138
{
type reversibleArrheniusReaction;
reaction "CH2 + CH4 = 2CH3";
A 2460;
beta 2;
Ta 4161.39;
}
un-named-reaction-139
{
type reversibleArrheniusTroeFallOffReaction;
reaction "CH2 + CO = CH2CO";
k0
{
A 2.69e+27;
beta -5.11;
Ta 3570.14;
}
kInf
{
A 8.1e+08;
beta 0.5;
Ta 2269.39;
}
F
{
alpha 0.5907;
Tsss 275;
Ts 1226;
Tss 5185;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-140
{
type reversibleArrheniusReaction;
reaction "CH2 + HCCO = C2H3 + CO";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-141
{
type reversibleArrheniusReaction;
reaction "CH2(S) + N2 = CH2 + N2";
A 1.5e+10;
beta 0;
Ta 301.915;
}
un-named-reaction-142
{
type reversibleArrheniusReaction;
reaction "CH2(S) + AR = CH2 + AR";
A 9e+09;
beta 0;
Ta 301.915;
}
un-named-reaction-143
{
type reversibleArrheniusReaction;
reaction "CH2(S) + O2 = H + OH + CO";
A 2.8e+10;
beta 0;
Ta 0;
}
un-named-reaction-144
{
type reversibleArrheniusReaction;
reaction "CH2(S) + O2 = CO + H2O";
A 1.2e+10;
beta 0;
Ta 0;
}
un-named-reaction-145
{
type reversibleArrheniusReaction;
reaction "CH2(S) + H2 = CH3 + H";
A 7e+10;
beta 0;
Ta 0;
}
un-named-reaction-146
{
type reversibleArrheniusTroeFallOffReaction;
reaction "CH2(S) + H2O = CH3OH";
k0
{
A 1.88e+32;
beta -6.36;
Ta 2536.08;
}
kInf
{
A 4.82e+14;
beta -1.16;
Ta 576.154;
}
F
{
alpha 0.6027;
Tsss 208;
Ts 3922;
Tss 10180;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 1)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-147
{
type reversibleArrheniusReaction;
reaction "CH2(S) + H2O = CH2 + H2O";
A 3e+10;
beta 0;
Ta 0;
}
un-named-reaction-148
{
type reversibleArrheniusReaction;
reaction "CH2(S) + CH3 = H + C2H4";
A 1.2e+10;
beta 0;
Ta -286.819;
}
un-named-reaction-149
{
type reversibleArrheniusReaction;
reaction "CH2(S) + CH4 = 2CH3";
A 1.6e+10;
beta 0;
Ta -286.819;
}
un-named-reaction-150
{
type reversibleArrheniusReaction;
reaction "CH2(S) + CO = CH2 + CO";
A 9e+09;
beta 0;
Ta 0;
}
un-named-reaction-151
{
type reversibleArrheniusReaction;
reaction "CH2(S) + CO2 = CH2 + CO2";
A 7e+09;
beta 0;
Ta 0;
}
un-named-reaction-152
{
type reversibleArrheniusReaction;
reaction "CH2(S) + CO2 = CO + CH2O";
A 1.4e+10;
beta 0;
Ta 0;
}
un-named-reaction-153
{
type reversibleArrheniusReaction;
reaction "CH2(S) + C2H6 = CH3 + C2H5";
A 4e+10;
beta 0;
Ta -276.755;
}
un-named-reaction-154
{
type reversibleArrheniusReaction;
reaction "CH3 + O2 = O + CH3O";
A 3.56e+10;
beta 0;
Ta 15337.3;
}
un-named-reaction-155
{
type reversibleArrheniusReaction;
reaction "CH3 + O2 = OH + CH2O";
A 2.31e+09;
beta 0;
Ta 10222.3;
}
un-named-reaction-156
{
type reversibleArrheniusReaction;
reaction "CH3 + H2O2 = HO2 + CH4";
A 24.5;
beta 2.47;
Ta 2606.53;
}
un-named-reaction-157
{
type reversibleArrheniusTroeFallOffReaction;
reaction "2CH3 = C2H6";
k0
{
A 3.4e+35;
beta -7.03;
Ta 1389.81;
}
kInf
{
A 6.77e+13;
beta -1.18;
Ta 329.087;
}
F
{
alpha 0.619;
Tsss 73.2;
Ts 1180;
Tss 9999;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-158
{
type reversibleArrheniusReaction;
reaction "2CH3 = H + C2H5";
A 6.84e+09;
beta 0.1;
Ta 5333.83;
}
un-named-reaction-159
{
type reversibleArrheniusReaction;
reaction "CH3 + HCO = CH4 + CO";
A 2.648e+10;
beta 0;
Ta 0;
}
un-named-reaction-160
{
type reversibleArrheniusReaction;
reaction "CH3 + CH2O = HCO + CH4";
A 3.32;
beta 2.81;
Ta 2948.7;
}
un-named-reaction-161
{
type reversibleArrheniusReaction;
reaction "CH3 + CH3OH = CH2OH + CH4";
A 30000;
beta 1.5;
Ta 5001.72;
}
un-named-reaction-162
{
type reversibleArrheniusReaction;
reaction "CH3 + CH3OH = CH3O + CH4";
A 10000;
beta 1.5;
Ta 5001.72;
}
un-named-reaction-163
{
type reversibleArrheniusReaction;
reaction "CH3 + C2H4 = C2H3 + CH4";
A 227;
beta 2;
Ta 4629.36;
}
un-named-reaction-164
{
type reversibleArrheniusReaction;
reaction "CH3 + C2H6 = C2H5 + CH4";
A 6140;
beta 1.74;
Ta 5258.35;
}
un-named-reaction-165
{
type reversibleArrheniusReaction;
reaction "HCO + H2O = H + CO + H2O";
A 1.5e+15;
beta -1;
Ta 8554.25;
}
un-named-reaction-166
{
type reversiblethirdBodyArrheniusReaction;
reaction "HCO = H + CO";
A 1.87e+14;
beta -1;
Ta 8554.25;
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 0)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 1)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-167
{
type reversibleArrheniusReaction;
reaction "HCO + O2 = HO2 + CO";
A 1.345e+10;
beta 0;
Ta 201.276;
}
un-named-reaction-168
{
type reversibleArrheniusReaction;
reaction "CH2OH + O2 = HO2 + CH2O";
A 1.8e+10;
beta 0;
Ta 452.872;
}
un-named-reaction-169
{
type reversibleArrheniusReaction;
reaction "CH3O + O2 = HO2 + CH2O";
A 4.28e-16;
beta 7.6;
Ta -1776.27;
}
un-named-reaction-170
{
type reversibleArrheniusReaction;
reaction "C2H + O2 = HCO + CO";
A 1e+10;
beta 0;
Ta -379.909;
}
un-named-reaction-171
{
type reversibleArrheniusReaction;
reaction "C2H + H2 = H + C2H2";
A 5.68e+07;
beta 0.9;
Ta 1002.86;
}
un-named-reaction-172
{
type reversibleArrheniusReaction;
reaction "C2H3 + O2 = HCO + CH2O";
A 4.58e+13;
beta -1.39;
Ta 510.739;
}
un-named-reaction-173
{
type reversibleArrheniusTroeFallOffReaction;
reaction "C2H4 = H2 + C2H2";
k0
{
A 1.58e+48;
beta -9.3;
Ta 49212.1;
}
kInf
{
A 8e+12;
beta 0.44;
Ta 43661.9;
}
F
{
alpha 0.7345;
Tsss 180;
Ts 1035;
Tss 5417;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-174
{
type reversibleArrheniusReaction;
reaction "C2H5 + O2 = HO2 + C2H4";
A 8.4e+08;
beta 0;
Ta 1949.87;
}
un-named-reaction-175
{
type reversibleArrheniusReaction;
reaction "HCCO + O2 = OH + 2CO";
A 3.2e+09;
beta 0;
Ta 429.725;
}
un-named-reaction-176
{
type reversibleArrheniusReaction;
reaction "2HCCO = 2CO + C2H2";
A 1e+10;
beta 0;
Ta 0;
}
un-named-reaction-177
{
type reversibleArrheniusReaction;
reaction "N + NO = N2 + O";
A 2.7e+10;
beta 0;
Ta 178.633;
}
un-named-reaction-178
{
type reversibleArrheniusReaction;
reaction "N + O2 = NO + O";
A 9e+06;
beta 1;
Ta 3270.74;
}
un-named-reaction-179
{
type reversibleArrheniusReaction;
reaction "N + OH = NO + H";
A 3.36e+10;
beta 0;
Ta 193.729;
}
un-named-reaction-180
{
type reversibleArrheniusReaction;
reaction "N2O + O = N2 + O2";
A 1.4e+09;
beta 0;
Ta 5439.5;
}
un-named-reaction-181
{
type reversibleArrheniusReaction;
reaction "N2O + O = 2NO";
A 2.9e+10;
beta 0;
Ta 11648.9;
}
un-named-reaction-182
{
type reversibleArrheniusReaction;
reaction "N2O + H = N2 + OH";
A 3.87e+11;
beta 0;
Ta 9500.25;
}
un-named-reaction-183
{
type reversibleArrheniusReaction;
reaction "N2O + OH = N2 + HO2";
A 2e+09;
beta 0;
Ta 10597.2;
}
un-named-reaction-184
{
type reversibleArrheniusLindemannFallOffReaction;
reaction "N2O = N2 + O";
k0
{
A 6.37e+11;
beta 0;
Ta 28500.8;
}
kInf
{
A 7.91e+10;
beta 0;
Ta 28188.8;
}
F
{
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.625)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-185
{
type reversibleArrheniusReaction;
reaction "HO2 + NO = NO2 + OH";
A 2.11e+09;
beta 0;
Ta -241.532;
}
un-named-reaction-186
{
type reversiblethirdBodyArrheniusReaction;
reaction "NO + O = NO2";
A 1.06e+14;
beta -1.41;
Ta 0;
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-187
{
type reversibleArrheniusReaction;
reaction "NO2 + O = NO + O2";
A 3.9e+09;
beta 0;
Ta -120.766;
}
un-named-reaction-188
{
type reversibleArrheniusReaction;
reaction "NO2 + H = NO + OH";
A 1.32e+11;
beta 0;
Ta 181.149;
}
un-named-reaction-189
{
type reversibleArrheniusReaction;
reaction "NH + O = NO + H";
A 4e+10;
beta 0;
Ta 0;
}
un-named-reaction-190
{
type reversibleArrheniusReaction;
reaction "NH + H = N + H2";
A 3.2e+10;
beta 0;
Ta 166.053;
}
un-named-reaction-191
{
type reversibleArrheniusReaction;
reaction "NH + OH = HNO + H";
A 2e+10;
beta 0;
Ta 0;
}
un-named-reaction-192
{
type reversibleArrheniusReaction;
reaction "NH + OH = N + H2O";
A 2e+06;
beta 1.2;
Ta 0;
}
un-named-reaction-193
{
type reversibleArrheniusReaction;
reaction "NH + O2 = HNO + O";
A 461;
beta 2;
Ta 3270.74;
}
un-named-reaction-194
{
type reversibleArrheniusReaction;
reaction "NH + O2 = NO + OH";
A 1280;
beta 1.5;
Ta 50.3191;
}
un-named-reaction-195
{
type reversibleArrheniusReaction;
reaction "NH + N = N2 + H";
A 1.5e+10;
beta 0;
Ta 0;
}
un-named-reaction-196
{
type reversibleArrheniusReaction;
reaction "NH + H2O = HNO + H2";
A 2e+10;
beta 0;
Ta 6969.2;
}
un-named-reaction-197
{
type reversibleArrheniusReaction;
reaction "NH + NO = N2 + OH";
A 2.16e+10;
beta -0.23;
Ta 0;
}
un-named-reaction-198
{
type reversibleArrheniusReaction;
reaction "NH + NO = N2O + H";
A 3.65e+11;
beta -0.45;
Ta 0;
}
un-named-reaction-199
{
type reversibleArrheniusReaction;
reaction "NH2 + O = OH + NH";
A 3e+09;
beta 0;
Ta 0;
}
un-named-reaction-200
{
type reversibleArrheniusReaction;
reaction "NH2 + O = H + HNO";
A 3.9e+10;
beta 0;
Ta 0;
}
un-named-reaction-201
{
type reversibleArrheniusReaction;
reaction "NH2 + H = NH + H2";
A 4e+10;
beta 0;
Ta 1836.65;
}
un-named-reaction-202
{
type reversibleArrheniusReaction;
reaction "NH2 + OH = NH + H2O";
A 90000;
beta 1.5;
Ta -231.468;
}
un-named-reaction-203
{
type reversibleArrheniusReaction;
reaction "NNH = N2 + H";
A 3.3e+08;
beta 0;
Ta 0;
}
un-named-reaction-204
{
type reversiblethirdBodyArrheniusReaction;
reaction "NNH = N2 + H";
A 1.3e+11;
beta -0.11;
Ta 2505.89;
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-205
{
type reversibleArrheniusReaction;
reaction "NNH + O2 = HO2 + N2";
A 5e+09;
beta 0;
Ta 0;
}
un-named-reaction-206
{
type reversibleArrheniusReaction;
reaction "NNH + O = OH + N2";
A 2.5e+10;
beta 0;
Ta 0;
}
un-named-reaction-207
{
type reversibleArrheniusReaction;
reaction "NNH + O = NH + NO";
A 7e+10;
beta 0;
Ta 0;
}
un-named-reaction-208
{
type reversibleArrheniusReaction;
reaction "NNH + H = H2 + N2";
A 5e+10;
beta 0;
Ta 0;
}
un-named-reaction-209
{
type reversibleArrheniusReaction;
reaction "NNH + OH = H2O + N2";
A 2e+10;
beta 0;
Ta 0;
}
un-named-reaction-210
{
type reversibleArrheniusReaction;
reaction "NNH + CH3 = CH4 + N2";
A 2.5e+10;
beta 0;
Ta 0;
}
un-named-reaction-211
{
type reversiblethirdBodyArrheniusReaction;
reaction "H + NO = HNO";
A 4.48e+13;
beta -1.32;
Ta 372.362;
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-212
{
type reversibleArrheniusReaction;
reaction "HNO + O = NO + OH";
A 2.5e+10;
beta 0;
Ta 0;
}
un-named-reaction-213
{
type reversibleArrheniusReaction;
reaction "HNO + H = H2 + NO";
A 9e+08;
beta 0.72;
Ta 332.106;
}
un-named-reaction-214
{
type reversibleArrheniusReaction;
reaction "HNO + OH = NO + H2O";
A 13000;
beta 1.9;
Ta -478.032;
}
un-named-reaction-215
{
type reversibleArrheniusReaction;
reaction "HNO + O2 = HO2 + NO";
A 1e+10;
beta 0;
Ta 6541.49;
}
un-named-reaction-216
{
type reversibleArrheniusReaction;
reaction "CN + O = CO + N";
A 7.7e+10;
beta 0;
Ta 0;
}
un-named-reaction-217
{
type reversibleArrheniusReaction;
reaction "CN + OH = NCO + H";
A 4e+10;
beta 0;
Ta 0;
}
un-named-reaction-218
{
type reversibleArrheniusReaction;
reaction "CN + H2O = HCN + OH";
A 8e+09;
beta 0;
Ta 3753.81;
}
un-named-reaction-219
{
type reversibleArrheniusReaction;
reaction "CN + O2 = NCO + O";
A 6.14e+09;
beta 0;
Ta -221.404;
}
un-named-reaction-220
{
type reversibleArrheniusReaction;
reaction "CN + H2 = HCN + H";
A 295;
beta 2.45;
Ta 1127.15;
}
un-named-reaction-221
{
type reversibleArrheniusReaction;
reaction "NCO + O = NO + CO";
A 2.35e+10;
beta 0;
Ta 0;
}
un-named-reaction-222
{
type reversibleArrheniusReaction;
reaction "NCO + H = NH + CO";
A 5.4e+10;
beta 0;
Ta 0;
}
un-named-reaction-223
{
type reversibleArrheniusReaction;
reaction "NCO + OH = NO + H + CO";
A 2.5e+09;
beta 0;
Ta 0;
}
un-named-reaction-224
{
type reversibleArrheniusReaction;
reaction "NCO + N = N2 + CO";
A 2e+10;
beta 0;
Ta 0;
}
un-named-reaction-225
{
type reversibleArrheniusReaction;
reaction "NCO + O2 = NO + CO2";
A 2e+09;
beta 0;
Ta 10063.8;
}
un-named-reaction-226
{
type reversiblethirdBodyArrheniusReaction;
reaction "NCO = N + CO";
A 3.1e+11;
beta 0;
Ta 27197.5;
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-227
{
type reversibleArrheniusReaction;
reaction "NCO + NO = N2O + CO";
A 1.9e+14;
beta -1.52;
Ta 372.362;
}
un-named-reaction-228
{
type reversibleArrheniusReaction;
reaction "NCO + NO = N2 + CO2";
A 3.8e+15;
beta -2;
Ta 402.553;
}
un-named-reaction-229
{
type reversiblethirdBodyArrheniusReaction;
reaction "HCN = H + CN";
A 1.04e+26;
beta -3.3;
Ta 63704;
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-230
{
type reversibleArrheniusReaction;
reaction "HCN + O = NCO + H";
A 20.3;
beta 2.64;
Ta 2505.89;
}
un-named-reaction-231
{
type reversibleArrheniusReaction;
reaction "HCN + O = NH + CO";
A 5.07;
beta 2.64;
Ta 2505.89;
}
un-named-reaction-232
{
type reversibleArrheniusReaction;
reaction "HCN + O = CN + OH";
A 3.91e+06;
beta 1.58;
Ta 13384.9;
}
un-named-reaction-233
{
type reversibleArrheniusReaction;
reaction "HCN + OH = HOCN + H";
A 1100;
beta 2.03;
Ta 6727.67;
}
un-named-reaction-234
{
type reversibleArrheniusReaction;
reaction "HCN + OH = HNCO + H";
A 4.4;
beta 2.26;
Ta 3220.42;
}
un-named-reaction-235
{
type reversibleArrheniusReaction;
reaction "HCN + OH = NH2 + CO";
A 0.16;
beta 2.56;
Ta 4528.72;
}
un-named-reaction-236
{
type reversibleArrheniusLindemannFallOffReaction;
reaction "H + HCN = H2CN";
k0
{
A 1.4e+20;
beta -3.4;
Ta 956.063;
}
kInf
{
A 3.3e+10;
beta 0;
Ta 0;
}
F
{
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-237
{
type reversibleArrheniusReaction;
reaction "H2CN + N = N2 + CH2";
A 6e+10;
beta 0;
Ta 201.276;
}
un-named-reaction-238
{
type reversibleArrheniusReaction;
reaction "C + N2 = CN + N";
A 6.3e+10;
beta 0;
Ta 23156.9;
}
un-named-reaction-239
{
type reversibleArrheniusReaction;
reaction "CH + N2 = HCN + N";
A 3.12e+06;
beta 0.88;
Ta 10129.2;
}
un-named-reaction-240
{
type reversibleArrheniusTroeFallOffReaction;
reaction "CH + N2 = HCNN";
k0
{
A 1.3e+19;
beta -3.16;
Ta 372.362;
}
kInf
{
A 3.1e+09;
beta 0.15;
Ta 0;
}
F
{
alpha 0.667;
Tsss 235;
Ts 2117;
Tss 4536;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 1)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-241
{
type reversibleArrheniusReaction;
reaction "CH2 + N2 = HCN + NH";
A 1e+10;
beta 0;
Ta 37236.2;
}
un-named-reaction-242
{
type reversibleArrheniusReaction;
reaction "CH2(S) + N2 = NH + HCN";
A 1e+08;
beta 0;
Ta 32707.4;
}
un-named-reaction-243
{
type reversibleArrheniusReaction;
reaction "C + NO = CN + O";
A 1.9e+10;
beta 0;
Ta 0;
}
un-named-reaction-244
{
type reversibleArrheniusReaction;
reaction "C + NO = CO + N";
A 2.9e+10;
beta 0;
Ta 0;
}
un-named-reaction-245
{
type reversibleArrheniusReaction;
reaction "CH + NO = HCN + O";
A 4.1e+10;
beta 0;
Ta 0;
}
un-named-reaction-246
{
type reversibleArrheniusReaction;
reaction "CH + NO = H + NCO";
A 1.62e+10;
beta 0;
Ta 0;
}
un-named-reaction-247
{
type reversibleArrheniusReaction;
reaction "CH + NO = N + HCO";
A 2.46e+10;
beta 0;
Ta 0;
}
un-named-reaction-248
{
type reversibleArrheniusReaction;
reaction "CH2 + NO = H + HNCO";
A 3.1e+14;
beta -1.38;
Ta 639.053;
}
un-named-reaction-249
{
type reversibleArrheniusReaction;
reaction "CH2 + NO = OH + HCN";
A 2.9e+11;
beta -0.69;
Ta 382.425;
}
un-named-reaction-250
{
type reversibleArrheniusReaction;
reaction "CH2 + NO = H + HCNO";
A 3.8e+10;
beta -0.36;
Ta 291.851;
}
un-named-reaction-251
{
type reversibleArrheniusReaction;
reaction "CH2(S) + NO = H + HNCO";
A 3.1e+14;
beta -1.38;
Ta 639.053;
}
un-named-reaction-252
{
type reversibleArrheniusReaction;
reaction "CH2(S) + NO = OH + HCN";
A 2.9e+11;
beta -0.69;
Ta 382.425;
}
un-named-reaction-253
{
type reversibleArrheniusReaction;
reaction "CH2(S) + NO = H + HCNO";
A 3.8e+10;
beta -0.36;
Ta 291.851;
}
un-named-reaction-254
{
type reversibleArrheniusReaction;
reaction "CH3 + NO = HCN + H2O";
A 9.6e+10;
beta 0;
Ta 14491.9;
}
un-named-reaction-255
{
type reversibleArrheniusReaction;
reaction "CH3 + NO = H2CN + OH";
A 1e+09;
beta 0;
Ta 10944.4;
}
un-named-reaction-256
{
type reversibleArrheniusReaction;
reaction "HCNN + O = CO + H + N2";
A 2.2e+10;
beta 0;
Ta 0;
}
un-named-reaction-257
{
type reversibleArrheniusReaction;
reaction "HCNN + O = HCN + NO";
A 2e+09;
beta 0;
Ta 0;
}
un-named-reaction-258
{
type reversibleArrheniusReaction;
reaction "HCNN + O2 = O + HCO + N2";
A 1.2e+10;
beta 0;
Ta 0;
}
un-named-reaction-259
{
type reversibleArrheniusReaction;
reaction "HCNN + OH = H + HCO + N2";
A 1.2e+10;
beta 0;
Ta 0;
}
un-named-reaction-260
{
type reversibleArrheniusReaction;
reaction "HCNN + H = CH2 + N2";
A 1e+11;
beta 0;
Ta 0;
}
un-named-reaction-261
{
type reversibleArrheniusReaction;
reaction "HNCO + O = NH + CO2";
A 98000;
beta 1.41;
Ta 4277.13;
}
un-named-reaction-262
{
type reversibleArrheniusReaction;
reaction "HNCO + O = HNO + CO";
A 150000;
beta 1.57;
Ta 22140.4;
}
un-named-reaction-263
{
type reversibleArrheniusReaction;
reaction "HNCO + O = NCO + OH";
A 2200;
beta 2.11;
Ta 5736.38;
}
un-named-reaction-264
{
type reversibleArrheniusReaction;
reaction "HNCO + H = NH2 + CO";
A 22500;
beta 1.7;
Ta 1912.13;
}
un-named-reaction-265
{
type reversibleArrheniusReaction;
reaction "HNCO + H = H2 + NCO";
A 105;
beta 2.5;
Ta 6692.44;
}
un-named-reaction-266
{
type reversibleArrheniusReaction;
reaction "HNCO + OH = NCO + H2O";
A 33000;
beta 1.5;
Ta 1811.49;
}
un-named-reaction-267
{
type reversibleArrheniusReaction;
reaction "HNCO + OH = NH2 + CO2";
A 3300;
beta 1.5;
Ta 1811.49;
}
un-named-reaction-268
{
type reversiblethirdBodyArrheniusReaction;
reaction "HNCO = NH + CO";
A 1.18e+13;
beta 0;
Ta 42630.4;
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
un-named-reaction-269
{
type reversibleArrheniusReaction;
reaction "HCNO + H = H + HNCO";
A 2.1e+12;
beta -0.69;
Ta 1434.1;
}
un-named-reaction-270
{
type reversibleArrheniusReaction;
reaction "HCNO + H = OH + HCN";
A 2.7e+08;
beta 0.18;
Ta 1066.77;
}
un-named-reaction-271
{
type reversibleArrheniusReaction;
reaction "HCNO + H = NH2 + CO";
A 1.7e+11;
beta -0.75;
Ta 1454.22;
}
un-named-reaction-272
{
type reversibleArrheniusReaction;
reaction "HOCN + H = H + HNCO";
A 20000;
beta 2;
Ta 1006.38;
}
un-named-reaction-273
{
type reversibleArrheniusReaction;
reaction "HCCO + NO = HCNO + CO";
A 9e+09;
beta 0;
Ta 0;
}
un-named-reaction-274
{
type reversibleArrheniusReaction;
reaction "CH3 + N = H2CN + H";
A 6.1e+11;
beta -0.31;
Ta 145.925;
}
un-named-reaction-275
{
type reversibleArrheniusReaction;
reaction "CH3 + N = HCN + H2";
A 3.7e+09;
beta 0.15;
Ta -45.2872;
}
un-named-reaction-276
{
type reversibleArrheniusReaction;
reaction "NH3 + H = NH2 + H2";
A 540;
beta 2.4;
Ta 4989.14;
}
un-named-reaction-277
{
type reversibleArrheniusReaction;
reaction "NH3 + OH = NH2 + H2O";
A 50000;
beta 1.6;
Ta 480.548;
}
un-named-reaction-278
{
type reversibleArrheniusReaction;
reaction "NH3 + O = NH2 + OH";
A 9400;
beta 1.94;
Ta 3250.62;
}
un-named-reaction-279
{
type reversibleArrheniusReaction;
reaction "NH + CO2 = HNO + CO";
A 1e+10;
beta 0;
Ta 7220.79;
}
un-named-reaction-280
{
type reversibleArrheniusReaction;
reaction "CN + NO2 = NCO + NO";
A 6.16e+12;
beta -0.752;
Ta 173.601;
}
un-named-reaction-281
{
type reversibleArrheniusReaction;
reaction "NCO + NO2 = N2O + CO2";
A 3.25e+09;
beta 0;
Ta -354.75;
}
un-named-reaction-282
{
type reversibleArrheniusReaction;
reaction "N + CO2 = NO + CO";
A 3e+09;
beta 0;
Ta 5686.06;
}
un-named-reaction-283
{
type irreversibleArrheniusReaction;
reaction "O + CH3 = H + H2 + CO";
A 3.37e+10;
beta 0;
Ta 0;
}
un-named-reaction-284
{
type reversibleArrheniusReaction;
reaction "O + C2H4 = H + CH2CHO";
A 6700;
beta 1.83;
Ta 110.702;
}
un-named-reaction-285
{
type reversibleArrheniusReaction;
reaction "O + C2H5 = H + CH3CHO";
A 1.096e+11;
beta 0;
Ta 0;
}
un-named-reaction-286
{
type reversibleArrheniusReaction;
reaction "OH + HO2 = O2 + H2O";
A 5e+12;
beta 0;
Ta 8720.3;
}
un-named-reaction-287
{
type irreversibleArrheniusReaction;
reaction "OH + CH3 = H2 + CH2O";
A 8e+06;
beta 0.5;
Ta -883.101;
}
un-named-reaction-288
{
type reversibleArrheniusTroeFallOffReaction;
reaction "CH + H2 = CH3";
k0
{
A 4.82e+19;
beta -2.8;
Ta 296.883;
}
kInf
{
A 1.97e+09;
beta 0.43;
Ta -186.181;
}
F
{
alpha 0.578;
Tsss 122;
Ts 2535;
Tss 9365;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-289
{
type irreversibleArrheniusReaction;
reaction "CH2 + O2 = 2H + CO2";
A 5.8e+09;
beta 0;
Ta 754.787;
}
un-named-reaction-290
{
type reversibleArrheniusReaction;
reaction "CH2 + O2 = O + CH2O";
A 2.4e+09;
beta 0;
Ta 754.787;
}
un-named-reaction-291
{
type irreversibleArrheniusReaction;
reaction "CH2 + CH2 = 2H + C2H2";
A 2e+11;
beta 0;
Ta 5529.57;
}
un-named-reaction-292
{
type irreversibleArrheniusReaction;
reaction "CH2(S) + H2O = H2 + CH2O";
A 6.82e+07;
beta 0.25;
Ta -470.484;
}
un-named-reaction-293
{
type reversibleArrheniusReaction;
reaction "C2H3 + O2 = O + CH2CHO";
A 3.03e+08;
beta 0.29;
Ta 5.5351;
}
un-named-reaction-294
{
type reversibleArrheniusReaction;
reaction "C2H3 + O2 = HO2 + C2H2";
A 1337;
beta 1.61;
Ta -193.225;
}
un-named-reaction-295
{
type reversibleArrheniusReaction;
reaction "O + CH3CHO = OH + CH2CHO";
A 2.92e+09;
beta 0;
Ta 909.77;
}
un-named-reaction-296
{
type irreversibleArrheniusReaction;
reaction "O + CH3CHO = OH + CH3 + CO";
A 2.92e+09;
beta 0;
Ta 909.77;
}
un-named-reaction-297
{
type irreversibleArrheniusReaction;
reaction "O2 + CH3CHO = HO2 + CH3 + CO";
A 3.01e+10;
beta 0;
Ta 19699.9;
}
un-named-reaction-298
{
type reversibleArrheniusReaction;
reaction "H + CH3CHO = CH2CHO + H2";
A 2.05e+06;
beta 1.16;
Ta 1210.17;
}
un-named-reaction-299
{
type irreversibleArrheniusReaction;
reaction "H + CH3CHO = CH3 + H2 + CO";
A 2.05e+06;
beta 1.16;
Ta 1210.17;
}
un-named-reaction-300
{
type irreversibleArrheniusReaction;
reaction "OH + CH3CHO = CH3 + H2O + CO";
A 2.343e+07;
beta 0.73;
Ta -560.052;
}
un-named-reaction-301
{
type irreversibleArrheniusReaction;
reaction "HO2 + CH3CHO = CH3 + H2O2 + CO";
A 3.01e+09;
beta 0;
Ta 5999.55;
}
un-named-reaction-302
{
type irreversibleArrheniusReaction;
reaction "CH3 + CH3CHO = CH3 + CH4 + CO";
A 2720;
beta 1.77;
Ta 2978.89;
}
un-named-reaction-303
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + CH2CO = CH2CHO";
k0
{
A 1.012e+36;
beta -7.63;
Ta 1939.3;
}
kInf
{
A 4.865e+08;
beta 0.422;
Ta -883.101;
}
F
{
alpha 0.465;
Tsss 201;
Ts 1773;
Tss 5333;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-304
{
type irreversibleArrheniusReaction;
reaction "O + CH2CHO = H + CH2 + CO2";
A 1.5e+11;
beta 0;
Ta 0;
}
un-named-reaction-305
{
type irreversibleArrheniusReaction;
reaction "O2 + CH2CHO = OH + CO + CH2O";
A 1.81e+07;
beta 0;
Ta 0;
}
un-named-reaction-306
{
type irreversibleArrheniusReaction;
reaction "O2 + CH2CHO = OH + 2HCO";
A 2.35e+07;
beta 0;
Ta 0;
}
un-named-reaction-307
{
type reversibleArrheniusReaction;
reaction "H + CH2CHO = CH3 + HCO";
A 2.2e+10;
beta 0;
Ta 0;
}
un-named-reaction-308
{
type reversibleArrheniusReaction;
reaction "H + CH2CHO = CH2CO + H2";
A 1.1e+10;
beta 0;
Ta 0;
}
un-named-reaction-309
{
type reversibleArrheniusReaction;
reaction "OH + CH2CHO = H2O + CH2CO";
A 1.2e+10;
beta 0;
Ta 0;
}
un-named-reaction-310
{
type reversibleArrheniusReaction;
reaction "OH + CH2CHO = HCO + CH2OH";
A 3.01e+10;
beta 0;
Ta 0;
}
un-named-reaction-311
{
type reversibleArrheniusTroeFallOffReaction;
reaction "CH3 + C2H5 = C3H8";
k0
{
A 2.71e+68;
beta -16.82;
Ta 6574.19;
}
kInf
{
A 9.43e+09;
beta 0;
Ta 0;
}
F
{
alpha 0.1527;
Tsss 291;
Ts 2742;
Tss 7748;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-312
{
type reversibleArrheniusReaction;
reaction "O + C3H8 = OH + C3H7";
A 193;
beta 2.68;
Ta 1869.86;
}
un-named-reaction-313
{
type reversibleArrheniusReaction;
reaction "H + C3H8 = C3H7 + H2";
A 1320;
beta 2.54;
Ta 3399.56;
}
un-named-reaction-314
{
type reversibleArrheniusReaction;
reaction "OH + C3H8 = C3H7 + H2O";
A 31600;
beta 1.8;
Ta 469.981;
}
un-named-reaction-315
{
type reversibleArrheniusReaction;
reaction "C3H7 + H2O2 = HO2 + C3H8";
A 0.378;
beta 2.72;
Ta 754.787;
}
un-named-reaction-316
{
type reversibleArrheniusReaction;
reaction "CH3 + C3H8 = C3H7 + CH4";
A 0.000903;
beta 3.65;
Ta 3599.83;
}
un-named-reaction-317
{
type reversibleArrheniusTroeFallOffReaction;
reaction "CH3 + C2H4 = C3H7";
k0
{
A 3e+57;
beta -14.6;
Ta 9142.98;
}
kInf
{
A 2550;
beta 1.6;
Ta 2868.19;
}
F
{
alpha 0.1894;
Tsss 277;
Ts 8748;
Tss 7891;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-318
{
type reversibleArrheniusReaction;
reaction "O + C3H7 = C2H5 + CH2O";
A 9.64e+10;
beta 0;
Ta 0;
}
un-named-reaction-319
{
type reversibleArrheniusTroeFallOffReaction;
reaction "H + C3H7 = C3H8";
k0
{
A 4.42e+55;
beta -13.545;
Ta 5714.74;
}
kInf
{
A 3.613e+10;
beta 0;
Ta 0;
}
F
{
alpha 0.315;
Tsss 369;
Ts 3285;
Tss 6667;
}
thirdBodyEfficiencies
{
coeffs
53
(
(H2 2)
(H 1)
(O 1)
(O2 1)
(OH 1)
(H2O 6)
(HO2 1)
(H2O2 1)
(C 1)
(CH 1)
(CH2 1)
(CH2(S) 1)
(CH3 1)
(CH4 2)
(CO 1.5)
(CO2 2)
(HCO 1)
(CH2O 1)
(CH2OH 1)
(CH3O 1)
(CH3OH 1)
(C2H 1)
(C2H2 1)
(C2H3 1)
(C2H4 1)
(C2H5 1)
(C2H6 3)
(HCCO 1)
(CH2CO 1)
(HCCOH 1)
(N 1)
(NH 1)
(NH2 1)
(NH3 1)
(NNH 1)
(NO 1)
(NO2 1)
(N2O 1)
(HNO 1)
(CN 1)
(HCN 1)
(H2CN 1)
(HCNN 1)
(HCNO 1)
(HOCN 1)
(HNCO 1)
(NCO 1)
(N2 1)
(AR 0.7)
(C3H7 1)
(C3H8 1)
(CH2CHO 1)
(CH3CHO 1)
)
;
}
}
un-named-reaction-320
{
type reversibleArrheniusReaction;
reaction "H + C3H7 = CH3 + C2H5";
A 4060;
beta 2.19;
Ta 447.84;
}
un-named-reaction-321
{
type reversibleArrheniusReaction;
reaction "OH + C3H7 = C2H5 + CH2OH";
A 2.41e+10;
beta 0;
Ta 0;
}
un-named-reaction-322
{
type reversibleArrheniusReaction;
reaction "HO2 + C3H7 = O2 + C3H8";
A 2.55e+07;
beta 0.255;
Ta -474.509;
}
un-named-reaction-323
{
type irreversibleArrheniusReaction;
reaction "HO2 + C3H7 = OH + C2H5 + CH2O";
A 2.41e+10;
beta 0;
Ta 0;
}
un-named-reaction-324
{
type reversibleArrheniusReaction;
reaction "CH3 + C3H7 = 2C2H5";
A 1.927e+10;
beta -0.32;
Ta 0;
}
}
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