! ! FFCM-1 ! H2/CO/C1 reaction model - Chemkin form - Draft v1.0c ! Release date: 05/31/3016. ! ! G. P. Smith, Y. Tao, and H. Wang, Foundational Fuel Chemistry Model Version 1.0 (FFCM-1), ! http://web.stanford.edu/group/haiwanglab/FFCM-1/index.html, 2016. ! ! Contact: ! Gregory P. Smith: gregory.smith@sri.com ! Hai Wang: haiwang@stanford.edu ! ELEMENTS O H C N AR HE END SPECIES AR HE N2 H2 H O O2 OH H2O HO2 H2O2 CO CO2 C CH CH2 CH2(S) CH3 CH4 HCO CH2O CH2OH CH3O CH3OH C2H C2H2 C2H3 C2H4 C2H5 C2H6 HCCO CH2CO CH2CHO CH3CHO CH3CO H2CC OH* CH* END REACTIONS H+O2<=>O+OH 9.841E+13 0.000 15310.00 O+H2<=>H+OH 3.848E+12 0.000 7950.00 DUPLICATE O+H2<=>H+OH 6.687E+14 0.000 19180.00 DUPLICATE OH+H2<=>H+H2O 2.256E+08 1.510 3437.00 2OH<=>O+H2O 3.161E+04 2.420 -1928.00 H2+M<=>2H+M 4.580E+19 -1.400 104390.00 AR/ 0.00/ HE/ 0.00/ N2/ 1.01/ H2/ 2.55/ H2O/12.02/ CO/ 1.95/ CO2/ 3.83/ CH4/ 2.00/ CH2O/ 2.50/ CH3OH/ 3.00/ C2H6/ 3.00/ H2+AR<=>2H+AR 5.176E+18 -1.100 104390.00 H2+HE<=>2H+HE 5.840E+18 -1.100 104390.00 2O+M<=>O2+M 6.160E+15 -0.500 0.00 AR/ 0.00/ HE/ 0.00/ H2/ 2.50/ H2O/12.00/ CO/ 1.90/ CO2/ 3.80/ CH4/ 2.00/ CH2O/ 2.50/ CH3OH/ 3.00/ C2H6/ 3.00/ 2O+AR<=>O2+AR 1.890E+13 0.000 -1788.00 2O+HE<=>O2+HE 1.890E+13 0.000 -1788.00 O+H+M<=>OH+M 4.710E+18 -1.000 0.00 AR/ 0.75/ HE/ 0.75/ N2/ 1.32/ H2/ 2.50/ H2O/15.80/ CO/ 2.52/ CO2/ 5.01/ CH4/ 2.00/ CH2O/ 2.50/ CH3OH/ 3.00/ C2H6/ 3.00/ H2O+M<=>H+OH+M 6.060E+27 -3.322 120800.00 AR/1.23/ HE/1.33/ N2/2.46/ H2/3.77/ O2/1.50/ H2O/0.00/ CO/2.40/ CO2/4.67/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ 2H2O<=>H+OH+H2O 7.528E+25 -2.440 120200.00 H+O2(+M)<=>HO2(+M) 4.565E+12 0.440 0.00 LOW / 6.370E+20 -1.720 525.00/ TROE/ 0.5000 30.00 90000.00 90000.00 / AR/ 0.60/ HE/ 0.71/ N2/ 0.96/ H2/ 1.87/ O2/ 0.75/ H2O/15.81/ CO/ 1.90/ CO2/ 3.45/ CH4/ 2.00/ CH2O/ 2.50/ CH3OH/ 3.00/ C2H6/ 3.00/ HO2+H<=>H2+O2 2.945E+06 2.087 -1455.00 HO2+H<=>2OH 5.888E+13 0.000 300.00 HO2+H<=>O+H2O 1.632E+12 0.000 0.00 HO2+O<=>OH+O2 1.609E+13 0.000 -445.00 HO2+OH<=>H2O+O2 7.347E+12 0.000 -1093.00 DUPLICATE HO2+OH<=>H2O+O2 4.534E+14 0.000 10930.00 DUPLICATE 2HO2<=>H2O2+O2 1.958E+11 0.000 -1409.00 DUPLICATE 2HO2<=>H2O2+O2 1.111E+14 0.000 11040.00 DUPLICATE H2O2(+M)<=>2OH(+M) 2.187E+12 0.900 48750.00 LOW / 2.490E+24 -2.300 48750.00/ TROE/ 0.5800 30.00 90000.00 90000.00 / AR/0.85/ HE/0.65/ N2/1.33/ H2/3.27/ O2/1.20/ H2O/6.63/ H2O2/6.61/ CO/2.80/ CO2/1.60/ CH4/2.00/ CH2O/2.33/ CH3OH/3.00/ C2H6/3.00/ H2O2+H<=>OH+H2O 2.045E+13 0.000 3970.00 H2O2+H<=>HO2+H2 5.856E+13 0.000 7950.00 H2O2+O<=>OH+HO2 8.513E+06 2.000 3970.00 H2O2+OH<=>H2O+HO2 1.565E+12 0.000 318.00 DUPLICATE H2O2+OH<=>H2O+HO2 7.340E+13 0.000 7270.00 DUPLICATE CO+O(+M)<=>CO2(+M) 1.880E+11 0.000 2430.00 LOW / 1.400E+21 -2.100 5500.00/ AR/ 0.87/ H2/ 2.50/ H2O/12.00/ CO/ 1.90/ CO2/ 3.80/ CH4/ 2.00/ CH2O/ 2.50/ CH3OH/ 3.00/ C2H6/ 3.00/ CO+O2<=>O+CO2 1.533E+12 0.000 47700.00 CO+OH<=>H+CO2 6.187E+04 2.053 -356.00 DUPLICATE CO+OH<=>H+CO2 5.017E+12 -0.664 332.00 DUPLICATE CO+HO2<=>OH+CO2 1.570E+05 2.180 17944.00 HCO+M<=>H+CO+M 4.800E+17 -1.200 17734.00 AR/ 1.40/ HE/ 1.31/ N2/ 1.31/ H2/ 1.31/ O2/ 1.32/ H2O/15.31/ CO/ 2.04/ CO2/ 2.00/ CH4/ 2.60/ CH2O/ 3.29/ CH3OH/ 3.00/ C2H6/ 3.00/ HCO+H<=>H2+CO 8.482E+13 0.000 0.00 HCO+O<=>OH+CO 3.010E+13 0.000 0.00 HCO+O<=>H+CO2 3.001E+13 0.000 0.00 HCO+OH<=>H2O+CO 1.199E+14 0.000 0.00 HCO+O2<=>HO2+CO 7.562E+10 0.521 -521.00 C+OH<=>H+CO 5.000E+13 0.000 0.00 C+O2<=>O+CO 6.620E+13 0.000 636.00 CH+H<=>C+H2 1.089E+14 0.000 0.00 CH+O<=>H+CO 5.700E+13 0.000 0.00 CH+OH<=>H+HCO 3.000E+13 0.000 0.00 CH+H2<=>H+CH2 1.612E+14 0.000 3320.00 CH+H2(+M)<=>CH3(+M) 5.130E+13 0.150 0.00 LOW / 2.430E+22 -1.600 0.00/ TROE/ 0.5140 152.00 22850.00 10350.00 / AR/0.71/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH+H2O<=>H+CH2O 3.430E+12 0.000 -884.00 CH+O2<=>O+HCO 1.840E+08 1.430 1200.00 CH+O2<=>CO2+H 2.781E+08 1.430 1200.00 CH+O2<=>CO+OH 1.840E+08 1.430 1200.00 CH+O2=>O+H+CO 2.789E+08 1.430 1200.00 CH+CO(+M)<=>HCCO(+M) 1.020E+15 -0.400 0.00 LOW / 3.260E+24 -2.500 0.00/ TROE/ 0.4000 30.00 90000.00 90000.00 / AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH+CO2<=>HCO+CO 6.380E+07 1.510 -715.00 CH2+H(+M)<=>CH3(+M) 2.130E+13 0.320 0.00 LOW / 1.390E+34 -5.040 7400.00/ TROE/ 0.4050 258.00 2811.00 9908.00 / AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH2+O=>2H+CO 8.000E+13 0.000 0.00 CH2+OH<=>H+CH2O 2.899E+13 0.120 -162.00 CH2+OH<=>CH+H2O 8.630E+05 2.020 6776.00 CH2+HO2<=>OH+CH2O 2.000E+13 0.000 0.00 CH2+H2<=>H+CH3 1.265E+06 2.000 7230.00 CH2+O2=>OH+H+CO 2.643E+12 0.000 1000.00 CH2+O2=>2H+CO2 1.844E+12 0.000 1000.00 CH2+O2<=>O+CH2O 1.600E+12 0.000 1000.00 CH2+O2<=>H2+CO2 1.836E+12 0.000 1000.00 CH2+O2<=>H2O+CO 5.200E+11 0.000 1000.00 CH2+C<=>H+C2H 5.000E+13 0.000 0.00 CH2+CH<=>H+C2H2 4.000E+13 0.000 0.00 2CH2=>2H+C2H2 2.000E+14 0.000 10989.00 2CH2<=>H2+H2CC 1.600E+15 0.000 11944.00 CH2(S)+N2<=>CH2+N2 1.200E+13 0.000 471.00 CH2(S)+AR<=>CH2+AR 9.000E+12 0.000 600.00 CH2(S)+HE<=>CH2+HE 6.620E+12 0.000 755.00 CH2(S)+H<=>CH+H2 3.000E+13 0.000 0.00 CH2(S)+O=>2H+CO 3.000E+13 0.000 0.00 CH2(S)+OH<=>H+CH2O 3.000E+13 0.000 0.00 CH2(S)+H2<=>CH3+H 8.291E+13 0.000 0.00 CH2(S)+O2<=>CH2+O2 3.130E+13 0.000 0.00 CH2(S)+H2O(+M)<=>CH3OH(+M) 2.940E+12 0.053 -1897.00 LOW / 1.680E+41 -7.192 5777.00/ TROE/ 0.9920 943.00 47310.00 47110.00 / H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH2(S)+H2O<=>CH2+H2O 1.510E+13 0.000 -431.00 CH2(S)+H2O<=>H2+CH2O 6.670E+21 -3.134 3300.00 CH2(S)+H2O2<=>OH+CH3O 1.290E+14 -0.138 0.00 CH2(S)+CO<=>CH2+CO 9.000E+12 0.000 0.00 CH2(S)+CO2<=>CH2+CO2 1.330E+13 0.000 0.00 CH2(S)+CO2<=>CO+CH2O 6.620E+12 0.000 0.00 HCO+H(+M)<=>CH2O(+M) 1.913E+14 -0.033 -142.00 LOW / 4.190E+34 -5.533 6128.00/ TROE/ 0.7820 271.00 2755.00 6570.00 / AR/0.79/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.84/ CH3OH/3.00/ C2H6/3.00/ CH2O(+M)<=>H2+CO(+M) 3.700E+13 0.000 71976.00 LOW / 4.400E+38 -6.100 94000.00/ TROE/ 0.9320 197.00 1540.00 10300.00 / AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH2O+H<=>HCO+H2 7.149E+07 1.900 2742.00 CH2O+O<=>OH+HCO 4.244E+11 0.570 2762.00 CH2O+OH<=>HCO+H2O 8.338E+07 1.630 -1055.00 CH2O+O2<=>HO2+HCO 3.297E+05 2.500 36460.00 CH2O+HO2<=>HCO+H2O2 7.111E+04 2.500 10210.00 CH2O+CH<=>H+CH2CO 9.640E+13 0.000 -517.00 CH2O+CH2<=>CH3+HCO 7.400E-02 4.210 1120.00 CH2O+CH2(S)<=>CH3+HCO 1.330E+13 0.000 -550.00 CH2O+C2H<=>C2H2+HCO 5.400E+03 2.810 5862.00 CH2O+C2H3<=>C2H4+HCO 5.400E+03 2.810 5862.00 CH3+H(+M)<=>CH4(+M) 1.801E+14 0.000 0.00 LOW / 7.930E+24 -2.170 0.00/ TROE/ 0.1240 1801.00 33.10 90000.00 / AR/0.36/ HE/0.42/ N2/0.59/ O2/0.59/ H2O/3.42/ CO/0.89/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH3+O<=>H+CH2O 5.722E+13 0.000 0.00 CH3+O=>H+H2+CO 2.384E+13 0.000 0.00 CH3+OH(+M)<=>CH3OH(+M) 6.210E+13 -0.018 -33.00 LOW / 7.240E+36 -6.000 3226.00/ TROE/ 0.1855 156.00 1675.00 4530.00 / H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH3+OH<=>CH2+H2O 4.464E+04 2.570 3998.00 CH3+OH<=>CH2(S)+H2O 7.810E+15 -0.910 546.00 CH3+OH<=>H2+CH2O 2.735E+09 0.734 -2177.00 CH3+HO2<=>O2+CH4 1.269E+05 2.228 -3022.00 CH3+HO2<=>OH+CH3O 8.821E+12 0.000 -590.00 CH3+O2<=>O+CH3O 8.104E+12 0.000 28297.00 CH3+O2<=>OH+CH2O 9.977E+01 2.860 9768.00 CH3+C<=>H+C2H2 5.000E+13 0.000 0.00 CH3+CH<=>H+C2H3 3.062E+13 0.000 0.00 CH3+CH2<=>H+C2H4 9.824E+13 0.000 0.00 CH3+CH2(S)<=>H+C2H4 1.400E+13 0.000 -497.00 2CH3(+M)<=>C2H6(+M) 1.844E+16 -0.970 620.00 LOW / 1.770E+50 -9.670 6220.00/ TROE/ 0.5325 151.00 1038.00 4970.00 / AR/0.69/ HE/0.70/ O2/1.00/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/1.99/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ 2CH3<=>H+C2H5 7.621E+12 0.100 10600.00 CH3+HCO<=>CH4+CO 5.300E+12 0.000 0.00 CH3+CH2O<=>HCO+CH4 3.213E+01 3.360 4310.00 CH3O(+M)<=>H+CH2O(+M) 1.130E+10 1.210 24075.00 LOW / 6.020E+16 -0.547 18024.00/ TROE/ 0.3410 28.00 1000.00 2339.00 / AR/0.85/ HE/0.67/ H2/2.00/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ CH3O+H(+M)<=>CH3OH(+M) 2.440E+11 0.760 0.00 LOW / 6.700E+40 -7.380 9177.00/ TROE/ 0.6840 37050.00 41490.00 3980.00 / H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH3O+H<=>H+CH2OH 1.290E+07 1.820 -703.00 CH3O+H<=>H2+CH2O 3.790E+13 0.000 596.00 CH3O+H<=>OH+CH3 3.880E+14 -0.264 -26.00 CH3O+H<=>CH2(S)+H2O 1.970E+11 0.414 243.00 CH3O+O<=>OH+CH2O 3.780E+12 0.000 0.00 CH3O+OH<=>H2O+CH2O 1.810E+13 0.000 0.00 CH3O+O2<=>HO2+CH2O 6.320E+10 0.000 2603.00 CH3O+CH3<=>CH4+CH2O 2.400E+13 0.000 0.00 CH3O+CO<=>CH3+CO2 6.000E+12 0.000 11000.00 CH2OH(+M)<=>H+CH2O(+M) 7.370E+10 0.811 39580.00 LOW / 3.010E+13 0.184 17230.00/ TROE/ 0.0010 50.00 600.00 2780.00 / AR/0.85/ HE/0.67/ H2/2.00/ H2O/5.97/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ CH2OH+H(+M)<=>CH3OH(+M) 6.670E+10 0.960 0.00 LOW / 1.340E+41 -7.380 9177.00/ TROE/ 0.6840 37050.00 41490.00 3980.00 / AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH2OH+H<=>H2+CH2O 2.440E+13 0.000 0.00 CH2OH+H<=>OH+CH3 2.006E+13 0.198 -241.00 CH2OH+H<=>CH2(S)+H2O 1.280E+11 0.516 215.00 CH2OH+O<=>OH+CH2O 9.030E+13 0.000 0.00 CH2OH+OH<=>H2O+CH2O 2.410E+13 0.000 0.00 CH2OH+O2<=>HO2+CH2O 7.298E+13 0.000 3736.00 CH2OH+CH3<=>CH4+CH2O 2.400E+13 0.000 0.00 CH4+H<=>CH3+H2 4.781E+05 2.500 9588.00 CH4+O<=>OH+CH3 6.786E+08 1.560 8485.00 CH4+OH<=>CH3+H2O 9.839E+05 2.182 2446.00 CH4+HO2<=>CH3+H2O2 4.778E+04 2.500 21000.00 CH4+CH<=>H+C2H4 3.000E+13 0.000 -397.00 CH4+CH2<=>2CH3 2.483E+06 2.000 8270.00 CH4+CH2(S)<=>2CH3 1.867E+13 0.000 -497.00 CH4+C2H<=>CH3+C2H2 1.300E+13 0.000 600.00 CH3OH+H<=>CH2OH+H2 1.550E+06 2.351 5912.00 CH3OH+H<=>CH3O+H2 5.490E+06 2.147 11134.00 CH3OH+O<=>OH+CH2OH 2.470E+13 0.000 5306.00 CH3OH+O<=>OH+CH3O 8.200E+12 0.000 9040.00 CH3OH+OH<=>CH2OH+H2O 1.420E+05 2.370 -965.20 CH3OH+OH<=>CH3O+H2O 1.600E+04 2.700 53.30 CH3OH+O2<=>CH2OH+HO2 3.580E+05 2.270 42760.00 CH3OH+HO2<=>CH2OH+H2O2 2.280E-05 5.060 10213.00 CH3OH+HO2<=>CH3O+H2O2 3.340E-02 4.120 16233.00 CH3OH+CH<=>CH3+CH2O 9.040E+18 -1.930 0.00 CH3OH+CH2<=>CH3+CH2OH 3.200E+01 3.200 7175.00 CH3OH+CH2<=>CH3+CH3O 1.450E+01 3.100 6940.00 CH3OH+CH2(S)<=>CH3+CH3O 7.000E+12 0.000 -550.00 CH3OH+CH2(S)<=>CH3+CH2OH 2.000E+13 0.000 -550.00 CH3OH+CH3<=>CH2OH+CH4 6.650E+02 3.030 8720.00 CH3OH+CH3<=>CH3O+CH4 2.150E+04 2.270 8710.00 CH3OH+C2H<=>C2H2+CH2OH 6.000E+12 0.000 0.00 CH3OH+C2H<=>C2H2+CH3O 1.200E+12 0.000 0.00 CH3OH+C2H3<=>C2H4+CH2OH 3.200E+01 3.200 7175.00 CH3OH+C2H3<=>C2H4+CH3O 1.450E+01 3.100 6940.00 C2H+H(+M)<=>C2H2(+M) 2.250E+13 0.320 0.00 LOW / 3.750E+33 -4.800 1900.00/ TROE/ 0.6460 132.00 1315.00 5566.00 / AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ C2H+O<=>CH+CO 5.400E+13 0.000 0.00 C2H+OH<=>H+HCCO 2.000E+13 0.000 0.00 C2H+H2<=>H+C2H2 2.110E+06 2.320 882.00 C2H+O2<=>HCO+CO 1.630E+14 -0.350 0.00 HCCO+H<=>CH2(S)+CO 1.320E+14 0.000 0.00 HCCO+O<=>H+2CO 1.730E+14 -0.112 0.00 HCCO+O<=>CH+CO2 2.950E+13 0.000 1113.00 HCCO+O2<=>OH+2CO 1.567E+12 0.000 854.00 HCCO+CH<=>CO+C2H2 5.000E+13 0.000 0.00 HCCO+CH2<=>C2H3+CO 3.000E+13 0.000 0.00 2HCCO<=>2CO+C2H2 1.000E+13 0.000 0.00 C2H2(+M)<=>H2CC(+M) 8.000E+14 -0.520 50750.00 LOW / 2.450E+15 -0.640 49700.00/ AR/0.69/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ C2H2+H(+M)<=>C2H3(+M) 5.540E+08 1.640 2096.00 LOW / 3.630E+27 -3.380 847.00/ TROE/ 0.2150 10.70 1043.00 2341.00 / AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ C2H2+O<=>H+HCCO 8.679E+08 1.400 2206.00 C2H2+O<=>CO+CH2 2.304E+08 1.400 2206.00 C2H2+OH<=>H+CH2CO 8.670E-01 3.566 -2370.00 C2H2+OH<=>C2H+H2O 2.630E+06 2.140 17060.00 C2H2+OH<=>CH3+CO 6.140E+05 1.620 -731.00 H2CC+H<=>C2H2+H 5.000E+13 0.000 0.00 H2CC+OH<=>CH2CO+H 2.000E+13 0.000 0.00 H2CC+O2<=>2HCO 1.124E+13 0.000 0.00 CH2+CO(+M)<=>CH2CO(+M) 8.100E+11 0.500 4510.00 LOW / 2.690E+33 -5.110 7095.00/ TROE/ 0.5910 275.00 1226.00 5185.00 / AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ CH2CO+H<=>HCCO+H2 4.200E+07 1.900 11850.00 CH2CO+H<=>CH3+CO 7.676E+08 1.450 2780.00 CH2CO+O<=>OH+HCCO 1.000E+13 0.000 10300.00 CH2CO+O<=>CH2+CO2 1.080E+12 0.000 1351.00 CH2CO+O<=>2HCO 3.610E+11 0.000 1351.00 CH2CO+O<=>CO+CH2O 3.610E+11 0.000 1351.00 CH2CO+OH<=>HCCO+H2O 1.120E+04 2.740 2220.00 CH2CO+OH<=>CH3+CO2 6.800E+11 0.000 -1013.00 CH2CO+OH<=>CH2OH+CO 1.010E+12 0.000 -1013.00 CH2CO+CH<=>C2H3+CO 1.450E+14 0.000 0.00 C2H3+H(+M)<=>C2H4(+M) 3.880E+13 0.200 0.00 LOW / 1.400E+30 -3.860 3320.00/ TROE/ 0.7820 207.50 2663.00 6095.00 / AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ C2H3+H<=>H2+C2H2 1.210E+12 0.000 0.00 C2H3+H<=>H2CC+H2 4.893E+13 0.000 0.00 C2H3+O<=>H+CH2CO 3.010E+13 0.000 0.00 C2H3+OH<=>H2O+C2H2 2.100E+13 0.000 0.00 C2H3+OH<=>CH3+HCO 6.000E+12 0.000 0.00 C2H3+OH<=>CH3CO+H 3.000E+12 0.000 0.00 C2H3+O2<=>HCO+CH2O 3.936E+15 -0.959 580.00 C2H3+O2<=>CH2CHO+O 1.849E+09 0.923 226.00 C2H3+O2<=>C2H2+HO2 4.400E+01 2.950 186.00 C2H3+CH3<=>CH4+C2H2 9.000E+12 0.000 -765.00 CH2CHO(+M)<=>CH2CO+H(+M) 1.430E+15 -0.150 45606.00 LOW / 2.440E+29 -3.790 43577.00/ TROE/ 0.7960 100.00 50000.00 34204.00 / H2/2.00/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H2/3.00/ C2H4/3.00/ C2H6/3.00/ CH2CHO(+M)<=>CH3+CO(+M) 2.930E+12 0.290 40326.00 LOW / 2.340E+27 -3.180 33445.00/ TROE/ 0.2110 199.00 2032.00 111702.00 / H2/2.00/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H2/3.00/ C2H4/3.00/ C2H6/3.00/ CH2CHO+H<=>CH3+HCO 2.200E+13 0.000 0.00 CH2CHO+H<=>CH2CO+H2 1.100E+13 0.000 0.00 CH2CHO+H<=>CH3CO+H 2.200E+13 0.000 0.00 CH2CHO+O=>H+CH2+CO2 1.580E+14 0.000 0.00 CH2CHO+OH<=>H2O+CH2CO 1.200E+13 0.000 0.00 CH2CHO+OH<=>HCO+CH2OH 3.010E+13 0.000 0.00 CH2CHO+O2=>OH+CO+CH2O 2.300E+10 0.000 0.00 CH3CO(+M)<=>CH3+CO(+M) 1.070E+12 0.630 16895.00 LOW / 5.650E+18 -0.970 14585.00/ TROE/ 0.3600 122.00 50000.00 16935.00 / H2/2.00/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H2/3.00/ C2H4/3.00/ C2H6/3.00/ CH3CO+H(+M)<=>CH3CHO(+M) 9.600E+13 0.000 0.00 LOW / 3.850E+44 -8.569 5500.00/ TROE/ 1.0000 2900.00 2900.00 5132.00 / H2/2.00/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H2/3.00/ C2H4/3.00/ C2H6/3.00/ CH3CO+H<=>CH3+HCO 9.600E+13 0.000 0.00 CH3CO+O<=>CH2CO+OH 5.270E+13 0.000 0.00 CH3CO+O<=>CH3+CO2 1.580E+14 0.000 0.00 CH3CO+OH<=>CH2CO+H2O 1.200E+13 0.000 0.00 CH3CO+OH<=>CH3+CO+OH 3.000E+13 0.000 0.00 CH3CO+HO2<=>CH3+CO2+OH 3.000E+13 0.000 0.00 CH3CO+O2<=>HO2+CH2CO 2.300E+10 0.000 0.00 CH3CO+CH3<=>CH4+CH2CO 6.080E+12 0.000 0.00 CH3CHO(+M)<=>CH4+CO(+M) 5.440E+21 -1.740 86364.00 LOW / 2.290E+58 -11.300 95922.00/ SRI/ 0.1380 -670.0000 0.0010 1.0000 0.0000 / H2/2.00/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H2/3.00/ C2H4/3.00/ C2H6/3.00/ CH3CHO(+M)<=>CH3+HCO(+M) 2.180E+22 -1.740 86364.00 LOW / 9.150E+58 -11.300 95922.00/ SRI/ 0.1380 -670.0000 0.0010 1.0000 0.0000 / H2/2.00/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H2/3.00/ C2H4/3.00/ C2H6/3.00/ CH3CHO+H<=>CH2CHO+H2 2.050E+09 1.160 2405.00 CH3CHO+H<=>CH3CO+H2 2.050E+09 1.160 2405.00 CH3CHO+O<=>OH+CH2CHO 2.920E+12 0.000 1808.00 CH3CHO+O<=>OH+CH3CO 2.920E+12 0.000 1808.00 CH3CHO+OH<=>CH3CO+H2O 2.690E+08 1.350 -1574.00 CH3CHO+O2<=>HO2+CH3CO 1.200E+05 2.500 37560.00 CH3CHO+HO2<=>CH3CO+H2O2 4.100E+04 2.500 10200.00 CH3CHO+CH3<=>CH3CO+CH4 2.720E+06 1.770 5920.00 C2H4(+M)<=>H2+H2CC(+M) 3.985E+15 0.000 87060.00 LOW / 3.710E+16 0.000 67816.00/ AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.01/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ C2H4+H(+M)<=>C2H5(+M) 1.232E+09 1.463 1355.00 LOW / 2.900E+39 -6.642 5769.00/ TROE/ 1.5690 -9147.00 299.00 152.40 / AR/0.70/ HE/0.70/ N2/0.86/ H2O/4.92/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ C2H4+H<=>C2H3+H2 2.201E+02 3.620 11270.00 C2H4+O<=>CH3+HCO 8.355E+06 1.880 183.00 C2H4+O<=>H+CH2CHO 3.700E+09 0.907 839.00 C2H4+O<=>CH2+CH2O 1.400E+04 2.620 459.00 C2H4+OH<=>C2H3+H2O 2.144E+04 2.745 2216.00 C2H4+OH<=>CH2O+CH3 1.780E+05 1.680 2060.00 C2H4+OH<=>H+CH3CHO 2.380E-02 3.910 1723.00 DUPLICATE C2H4+OH<=>H+CH3CHO 3.190E+05 2.190 5256.00 DUPLICATE C2H4+CH3<=>C2H3+CH4 6.020E+07 1.560 16630.00 C2H4+O2<=>HO2+C2H3 7.100E+13 0.000 60010.00 C2H5+H(+M)<=>C2H6(+M) 5.210E+17 -0.990 1580.00 LOW / 1.990E+41 -7.080 6685.00/ TROE/ 0.8420 125.00 2219.00 6882.00 / AR/0.70/ HE/0.70/ H2O/6.00/ CO/1.50/ CO2/2.00/ CH4/2.00/ CH2O/2.50/ CH3OH/3.00/ C2H6/3.00/ C2H5+H<=>H2+C2H4 1.810E+12 0.000 0.00 C2H5+O<=>CH3+CH2O 4.420E+13 0.000 0.00 C2H5+O<=>H+CH3CHO 5.890E+13 0.000 0.00 C2H5+O<=>OH+C2H4 2.940E+13 0.000 0.00 C2H5+O2<=>HO2+C2H4 1.355E+07 1.090 -1975.00 C2H5+CH3<=>CH4+C2H4 9.000E+11 0.000 0.00 C2H5+CH2O<=>C2H6+HCO 5.500E+03 2.810 5860.00 C2H5+CH3OH<=>C2H6+CH2OH 3.200E+01 3.200 7175.00 C2H6+H<=>C2H5+H2 1.133E+08 1.900 7530.00 C2H6+O<=>OH+C2H5 1.763E+05 2.800 5803.00 C2H6+OH<=>C2H5+H2O 9.463E+06 2.000 994.00 C2H6+CH<=>CH3+C2H4 1.077E+14 0.000 -262.00 C2H6+CH2(S)<=>CH3+C2H5 3.300E+13 0.000 -660.00 C2H6+CH3<=>C2H5+CH4 5.600E+10 0.000 9420.00 DUPLICATE C2H6+CH3<=>C2H5+CH4 8.299E+14 0.000 22260.00 DUPLICATE C2H6+O2<=>C2H5+HO2 7.290E+05 2.500 49160.00 C2H6+HO2<=>C2H5+H2O2 1.100E+05 2.500 16850.00 CH+O2<=>CO+OH* 1.800E+11 0.000 0.00 C2H+O<=>CO+CH* 2.500E+12 0.000 0.00 C2H+O2<=>CO2+CH* 3.200E+11 0.000 1600.00 H+O+M=>OH*+M 5.450E+12 0.000 0.00 2OH+H=>OH*+H2O 1.450E+15 0.000 0.00 CH*=>CH 1.850E+06 0.000 0.00 CH*+N2<=>CH+N2 3.030E+02 3.400 -381.00 CH*+O2<=>CH+O2 2.400E+06 2.140 -1720.00 CH*+H2O<=>CH+H2O 5.300E+13 0.000 0.00 CH*+H2<=>CH+H2 1.470E+14 0.000 1361.00 CH*+CO2<=>CH+CO2 2.410E-01 4.300 -1694.00 CH*+CO<=>CH+CO 2.440E+12 0.500 0.00 CH*+CH4<=>CH+CH4 1.730E+13 0.000 167.00 CH*+AR<=>CH+AR 1.250E+10 0.500 0.00 CH*+HE<=>CH+HE 1.950E+09 0.500 0.00 OH*=>OH 1.450E+06 0.000 0.00 OH*+N2<=>OH+N2 1.080E+11 0.500 -1238.00 OH*+O2<=>OH+O2 2.100E+12 0.500 -482.00 OH*+H2O<=>OH+H2O 5.920E+12 0.500 -861.00 OH*+H2<=>OH+H2 2.950E+12 0.500 -444.00 OH*+CO2<=>OH+CO2 2.750E+12 0.500 -968.00 OH*+CO<=>OH+CO 3.230E+12 0.500 -787.00 OH*+CH4<=>OH+CH4 3.360E+12 0.500 -635.00 OH*+AR<=>OH+AR 1.250E+10 0.500 0.00 OH*+HE<=>OH+HE 1.950E+09 0.500 0.00 END