!Marinov, N. M, "A Detailed Chemical Kinetic Model for High Temperature Ethanol Oxidation" !Int. J. Chem. Kinet. 31:183-220 (1999); !Lawrence Livermore National Laboratory, Livermore, CA, !UCRL-JC-131657 !UCRL-WEB-204236 !Review and release date: May 19, 2004. !Date: Mon, 26 Apr 1999 15:25:31 -0700 (PDT) !From: "Nick M. Marinov" ! elements h o c n end species h2 h ch4 ch3 ch2 ch ch2o hco co2 co o2 o oh ho2 h2o2 h2o c2h hcco c2h2 c2h3 c2h4 c2h5 c2h6 ch2oh ch3o hccoh h2ccch c3h2 ch2(s) ch2co c2o hcoh ch3oh ch2hco c3h6 ac3h5 pc3h5 sc3h5 ch2chcho pc3h4 ac3h4 ch3co ch2chco ch3chco ch3hco chocho ic3h7 nc3h7 c2h5oh c2h4oh ch3choh ch3ch2o ch2chch2o hcooh c3h8 hoc2h4o2 n2 end thermo end reactions oh+h2=h+h2o 2.14E+08 1.52 3449.0 !Marinov 1995a o+oh=o2+h 2.02E+14 -0.4 0.0 !Marinov 1995a o+h2=oh+h 5.06E+04 2.67 6290.0 !Marinov 1995a h+o2(+m)=ho2(+m) 4.52E+13 0.0 0.0 !Marinov 1995a low / 1.05E+19 -1.257 0.0 / !Marinov 1995a h2o/0.0/ h2/0.0/ n2/0.0/ ch4/10.0/ co2/3.8/ co/1.9/ h+o2(+n2)=ho2(+n2) 4.52E+13 0.0 0.0 !Marinov 1995a low / 2.03E+20 -1.59 0.0 / !Marinov 1995a h+o2(+h2)=ho2(+h2) 4.52E+13 0.0 0.0 !Marinov 1995a low / 1.52E+19 -1.133 0.0 / !Marinov 1995a h+o2(+h2o)=ho2(+h2o) 4.52E+13 0.0 0.0 !Marinov 1995a low / 2.10E+23 -2.437 0.0 / !Marinov 1995a oh+ho2=h2o+o2 2.13E+28 -4.827 3500.0 !Hippler 1995 dup oh+ho2=h2o+o2 9.10E+14 0.0 10964.0 !Hippler 1995 dup h+ho2=oh+oh 1.50E+14 0.0 1000.0 !Marinov 1995a h+ho2=h2+o2 6.63E+13 0.0 2126.0 !Tsang 1986x h+ho2=o+h2o 3.01E+13 0.0 1721.0 !Marinov 1995a o+ho2=o2+oh 3.25E+13 0.0 0.0 !Marinov 1995a oh+oh=o+h2o 3.57E+04 2.4 -2112.0 !Marinov 1995a h+h+m=h2+m 1.00E+18 -1.0 0.0 !Marinov 1995a h2o/0.0/ h2/0.0/ h+h+h2=h2+h2 9.20E+16 -0.6 0.0 !Marinov 1995a h+h+h2o=h2+h2o 6.00E+19 -1.25 0.0 !Marinov 1995a h+oh+m=h2o+m 2.21E+22 -2.0 0.0 !Marinov 1995a h2o/6.4/ h+o+m=oh+m 4.71E+18 -1.0 0.0 !Marinov 1995a h2o/6.4/ o+o+m=o2+m 1.89E+13 0.0 -1788.0 !Marinov 1995a ho2+ho2=h2o2+o2 4.20E+14 0.0 11982.0 !Marinov 1995a dup ho2+ho2=h2o2+o2 1.30E+11 0.0 -1629.0 !Marinov 1995a dup oh+oh(+m)=h2o2(+m) 1.24E+14 -0.37 0.0 !Marinov 1995a low / 3.04E+30 -4.63 2049.0 / !Marinov 1995a troe / 0.470 100.0 2000.0 1.0E+15/ h2o2+h=ho2+h2 1.98E+06 2.0 2435.0 !Marinov 1995a h2o2+h=oh+h2o 3.07E+13 0.0 4217.0 !Marinov 1995a h2o2+o=oh+ho2 9.55E+06 2.0 3970.0 !Marinov 1995a h2o2+oh=h2o+ho2 2.40E+00 4.042 -2162.0 !Marinov 1995a ch3+ch3(+m)=c2h6(+m) 9.22E+16 -1.174 636.0 !Walter 1990 low / 1.14E+36 -5.246 1705.0/ !Walter 1990 troe/ 0.405 1120.0 69.6 1.0E+15/ h2o/5.0/ h2/2.0/ co2/3.0/ co/2.0/ ch3+h(+m)=ch4(+m) 2.14E+15 -0.4 0.0 !Tsang 1986 low/ 3.31E+30 -4.0 2108.0 / !Marinov 1996 troe / 0.0 1.0E-15 1.0E-15 40.0/ h2o/5.0/ h2/2.0/ co2/3.0/ co/2.0/ ch4+h=ch3+h2 2.20E+04 3.0 8750.0 !Miller 1992 ch4+oh=ch3+h2o 4.19E+06 2.0 2547.0 !Marinov 1995 ch4+o=ch3+oh 6.92E+08 1.56 8485.0 !Marinov 1995 ch4+ho2=ch3+h2o2 1.12E+13 0.0 24640.0 !Marinov 1995 ch3+ho2=ch3o+oh 7.00E+12 0.0 0.0 !Troe 1993 ch3+ho2=ch4+o2 3.00E+12 0.0 0.0 !Marinov 1995 ch3+o=ch2o+h 8.00E+13 0.0 0.0 !Marinov 1995 ch3+o2=ch3o+o 1.45E+13 0.0 29209.0 !Klatt 1991 ch3+o2=ch2o+oh 2.51E+11 0.0 14640.0 !Marinov 1995 ch3o+h=ch3+oh 1.00E+13 0.0 0.0 !Marinov 1998 ch2oh+h=ch3+oh 1.00E+13 0.0 0.0 !Marinov 1998 ch3+oh=ch2(s)+h2o 2.00E+13 0.0 550.0 !Pilling 1997 ch3+oh=hcoh+h2 1.00E+10 0.0 -415.0 !Pilling 1997 ch3+oh=ch2+h2o 3.00E+06 2.0 2500.0 !Marinov 1996 ch3+h=ch2+h2 9.00E+13 0.0 15100.0 !Miller 1992 ch3+m=ch+h2+m 6.90E+14 0.0 82469.0 !Markus 1992 ch3+m=ch2+h+m 1.90E+16 0.0 91411.0 !Markus 1992 ch3+oh(+m)=ch3oh(+m) 8.70E+13 0.1 0.0 !Fagerstrom 1993 low/ 8.84E+41 -7.4 626.0 / !Marinov 1996 troe / 0.025 1.0E-15 8000.0 3000.0/ h2o /10.0/ h2/2.0/ co2/3.0/ co/2.0/ ch3oh(+m)=ch2(s)+h2o(+m) 2.837e10 1.0 83871. !Marinov 1998 low / 1.78e49 -8.81 93369./ troe /0.9 740. 980. 5100./ h2o/10.0/ h2/2.0/ co2/3.0/ co/2.0/ ch3oh(+m)=hcoh+h2(+m) 4.2e9 1.12 85604. !Marinov 1998 low / 5.02e47 -8.402 94823./ troe/ 0.9 615. 915. 4615./ h2o /10.0/ h2/2.0/ co2/3.0/ co/2.0/ ch3oh(+m)=ch2o+h2(+m) 2.03e9 1.0 91443. !Marinov 1998 low /9.784e47 -8.4 101761./ troe/ 0.9 825. 1125. 5700./ h2o/10.0/ h2/2.0/ co2/3.0/ co/2.0/ ch3oh+oh=ch2oh+h2o 2.61E+05 2.182 -1344.0 !Tsang 1987 ch3oh+oh=ch3o+h2o 2.62E+06 2.056 916.0 !Tsang 1987 ch3oh+o=ch2oh+oh 3.88E+05 2.5 3080.0 !Tsang 1987 ch3oh+h=ch2oh+h2 1.70E+07 2.1 4868.0 !Tsang 1987 ch3oh+h=ch3o+h2 4.24E+06 2.1 4868.0 !Tsang 1987 ch3oh+ch3=ch2oh+ch4 3.19E+01 3.17 7171.0 !Tsang 1987 ch3oh+ch3=ch3o+ch4 1.45E+01 3.10 6935.0 !Tsang 1987 ch3oh+ho2=ch2oh+h2o2 9.64E+10 0.0 12578.0 !Tsang 1987 ch2o+h(+m)=ch3o(+m) 5.40E+11 0.454 2600.0 !GRI-Mech2.11 low/ 1.50E+30 -4.80 5560./ troe/ 0.758 94. 1555. 4200./ h2o/5.0/ ch2o+h(+m)=ch2oh(+m) 5.40E+11 0.454 3600.0 !GRI-Mech2.11 low / 9.10E+31 -4.82 6530./ troe/ 0.7187 103. 1291. 4160./ h2o/5.0/ ch3o+ch3=ch2o+ch4 1.20E+13 0.0 0.0 !Tsang 1986 ch3o+h=ch2o+h2 2.00E+13 0.0 0.0 !Miller 1992 ch2oh+h=ch2o+h2 2.00E+13 0.0 0.0 !Miller 1992 ch3o+oh=ch2o+h2o 1.00E+13 0.0 0.0 !Miller 1992 ch2oh+oh=ch2o+h2o 1.00E+13 0.0 0.0 !Miller 1992 ch3o+o=ch2o+oh 1.00E+13 0.0 0.0 !Miller 1992 ch2oh+o=ch2o+oh 1.00E+13 0.0 0.0 !Miller 1992 ch3o+o2=ch2o+ho2 6.30E+10 0.0 2600.0 !Miller 1992 ch3o+co=ch3+co2 4.68E+02 3.16 5380.0 !Wantuck 1987 ch2oh+o2=ch2o+ho2 1.57E+15 -1.0 0.0 !Baulch 1992 dup ch2oh+o2=ch2o+ho2 7.23E+13 0.0 3577.0 !Baulch 1992 dup hcoh+oh=hco+h2o 2.00E+13 0.0 0.0 !Marinov 1996 hcoh+h=ch2o+h 2.00E+14 0.0 0.0 !Marinov 1996 hcoh+o=co+oh+h 8.00E+13 0.0 0.0 !Marinov 1996 hcoh+o2=co+oh+oh 1.00E+13 0.0 0.0 !Marinov 1998 hcoh+o2=co2+h2o 1.00E+13 0.0 0.0 !Marinov 1998 hcoh=ch2o 2.10E+19 -3.07 31700.0 !Marinov 1998 ch2+h=ch+h2 1.00E+18 -1.56 0.0 !Miller 1992 ch2+oh=ch+h2o 1.13E+07 2.0 3000.0 !Miller 1992 ch2+oh=ch2o+h 2.50E+13 0.0 0.0 !Miller 1992 ch2+co2=ch2o+co 1.10E+11 0.0 1000.0 !Miller 1992 ch2+o=co+h+h 5.00E+13 0.0 0.0 !Miller 1992 ch2+o=co+h2 3.00E+13 0.0 0.0 !Miller 1992 ch2+o2=ch2o+o 3.29E+21 -3.3 2868.0 !Marinov 1996 ch2+o2=co2+h+h 3.29E+21 -3.3 2868.0 !Marinov 1996 ch2+o2=co2+h2 1.01E+21 -3.3 1508.0 !Marinov 1996 ch2+o2=co+h2o 7.28E+19 -2.54 1809.0 !Marinov 1996 ch2+o2=hco+oh 1.29E+20 -3.3 284.0 !Marinov 1996 ch2+ch3=c2h4+h 4.00E+13 0.0 0.0 ! Miller 1992 ch2+ch2=c2h2+h+h 4.00E+13 0.0 0.0 ! Miller 1992 ch2+hcco=c2h3+co 3.00E+13 0.0 0.0 ! Miller 1992 ch2+c2h2=h2ccch+h 1.20E+13 0.0 6600.0 ! Miller 1992 ch2(s)+m=ch2+m 1.00E+13 0.0 0.0 ! Miller 1992 h /12.0/ c2h2 /4.0/ h2o/3.0/ ch2(s)+ch4=ch3+ch3 4.00E+13 0.0 0.0 ! Miller 1992 ch2(s)+c2h6=ch3+c2h5 1.20E+14 0.0 0.0 ! Miller 1992 ch2(s)+o2=co+oh+h 7.00E+13 0.0 0.0 ! Miller 1992 ch2(s)+h2=ch3+h 7.00E+13 0.0 0.0 ! Miller 1992 ch2(s)+c2h2=h2ccch+h 1.50E+14 0.0 0.0 ! Canosa-Mas85 ch2(s)+c2h4=ac3h5+h 1.30E+14 0.0 0.0 ! Canosa-Mas85 ch2(s)+o=co+h+h 3.00E+13 0.0 0.0 ! Miller 1992 ch2(s)+oh=ch2o+h 3.00E+13 0.0 0.0 ! Miller 1992 ch2(s)+h=ch+h2 3.00E+13 0.0 0.0 ! Miller 1992 ch2(s)+co2=ch2o+co 3.00E+12 0.0 0.0 ! Miller 1992 ch2(s)+ch3=c2h4+h 2.00E+13 0.0 0.0 ! Miller 1992 ch2(s)+ch2co=c2h4+co 1.60E+14 0.0 0.0 ! Miller 1992 ch+o2=hco+o 3.30E+13 0.0 0.0 ! Miller 1992 ch+o=co+h 5.70E+13 0.0 0.0 ! Miller 1992 ch+oh=hco+h 3.00E+13 0.0 0.0 ! Miller 1992 ch+co2=hco+co 3.40E+12 0.0 690.0 ! Miller 1992 ch+h2o=ch2o+h 1.17E+15 -0.75 0.0 ! Miller 1992 ch+ch2o=ch2co+h 9.46E+13 0.0 -515.0 ! Miller 1992 ch+c2h2=c3h2+h 1.00E+14 0.0 0.0 ! Miller 1992 ch+ch2=c2h2+h 4.00E+13 0.0 0.0 ! Miller 1992 ch+ch3=c2h3+h 3.00E+13 0.0 0.0 ! Miller 1992 ch+ch4=c2h4+h 6.00E+13 0.0 0.0 ! Miller 1992 hcooh+m=co+h2o+m 2.09E+14 0.0 40400.0 !Saito 1984 hcooh+m=co2+h2+m 1.35E+15 0.0 60600.0 !Saito 1984 hcooh+oh=co2+h2o+h 2.62E+6 2.056 916.0 !Marinov 1998 hcooh+oh=co+h2o+oh 1.85E+7 1.5 -962.0 !Marinov 1998 hcooh+h=co2+h2+h 4.24E+6 2.1 4868.0 !Marinov 1998 hcooh+h=co+h2+oh 6.06E+13 -0.35 2988.0 !Marinov 1998 hcooh+ch3=ch4+co+oh 3.90E-7 5.8 2200.0 !Marinov 1998 hcooh+ho2=co+h2o2+oh 2.40E+19 -2.2 14030.0 !Marinov 1998 hcooh+o=co+oh+oh 1.77E+18 -1.9 2975.0 !Marinov 1998 ch2o+oh=hco+h2o 3.43E+09 1.18 -447.0 ! Tsang 1986 ch2o+h=hco+h2 2.19E+08 1.77 3000.0 ! Miller 1992 ch2o+m=hco+h+m 3.31E+16 0.0 81000.0 ! Miller 1992 ch2o+o=hco+oh 1.80E+13 0.0 3080.0 ! Miller 1992 hco+o2=co+ho2 7.58E+12 0.0 410.0 ! Timonen 1988 hco+m=h+co+m 1.86E+17 -1.0 17000.0 ! Timonen 1987 h2o/5.0/ h2/1.87/ co2/3.0/ co/1.87/ ch4/2.81/ hco+oh=h2o+co 1.00E+14 0.0 0.0 ! Miller 1992 hco+h=co+h2 1.19E+13 0.25 0.0 ! Miller 1992 hco+o=co+oh 3.00E+13 0.0 0.0 ! Miller 1992 hco+o=co2+h 3.00E+13 0.0 0.0 ! Miller 1992 co+oh=co2+h 9.42E+03 2.25 -2351.0 !Marinov 1996 co+o+m=co2+m 6.17E+14 0.0 3000.0 ! Miller 1992 co+o2=co2+o 2.53E+12 0.0 47688.0 ! Miller 1992 co+ho2=co2+oh 5.80E+13 0.0 22934.0 ! Miller 1992 c2h5oh(+m)=ch3+ch2oh(+m) 5.94E+23 -1.68 91163.0 !Marinov 1998 low /2.88E+85 -18.9 109914./ troe/0.5 200. 890. 4600./ h2o/5./ h2/2.0/ co2/3.0/ co/2.0/ c2h5oh(+m)=c2h5+oh(+m) 1.25E+23 -1.54 96005.0 !Marinov 1998 low /3.252E+85 -18.81 114930./ troe/0.5 300. 900. 5000./ h2o/5./ h2/2.0/ co2/3.0/ co/2.0/ c2h5oh(+m)=c2h4+h2o(+m) 2.79E+13 0.09 66136.0 !Marinov 1998 low/2.57E+83 -18.85 86452./ troe/0.70 350. 800. 3800./ h2o/5./ c2h5oh(+m)=ch3hco+h2(+m) 7.24E+11 0.095 91007.0 !Marinov 1998 low /4.46e87 -19.42 115586./ troe/0.9 900. 1100. 3500./ h2o/5./ c2h5oh+oh=c2h4oh+h2o 1.74E+11 0.27 600.0 !Marinov 1998 c2h5oh+oh=ch3choh+h2o 4.64E+11 0.15 0.0 !Marinov 1998 c2h5oh+oh=ch3ch2o+h2o 7.46E+11 0.30 1634.0 !Marinov 1998 c2h5oh+h=c2h4oh+h2 1.23E+7 1.8 5098.0 !Marinov 1998 c2h5oh+h=ch3choh+h2 2.58E+7 1.65 2827.0 !Marinov 1998 c2h5oh+h=ch3ch2o+h2 1.50E+7 1.60 3038.0 !Marinov 1998 c2h5oh+o=c2h4oh+oh 9.41E+7 1.70 5459.0 !Marinov 1998 c2h5oh+o=ch3choh+oh 1.88E+7 1.85 1824.0 !Marinov 1998 c2h5oh+o=ch3ch2o+oh 1.58E+7 2.00 4448.0 !Marinov 1998 c2h5oh+ch3=c2h4oh+ch4 2.19E+2 3.18 9622.0 !Marinov 1998 c2h5oh+ch3=ch3choh+ch4 7.28E+2 2.99 7948.0 !Marinov 1998 c2h5oh+ch3=ch3ch2o+ch4 1.45E+2 2.99 7649.0 !Marinov 1998 c2h5oh+ho2=ch3choh+h2o2 8.20E+3 2.55 10750.0 !Marinov 1998 c2h5oh+ho2=c2h4oh+h2o2 1.23E+4 2.55 15750.0 !Marinov 1998 c2h5oh+ho2=ch3ch2o+h2o2 2.50E+12 0.0 24000.0 !Marinov 1998 ch3ch2o+m=ch3hco+h+m 1.16E+35 -5.89 25274.0 !Marinov 1998 ch3ch2o+m=ch3+ch2o+m 1.35E+38 -6.96 23800.0 !Marinov 1998 ch3ch2o+o2=ch3hco+ho2 4.00E+10 0.0 1100.0 !Hartmann 1990 ch3ch2o+co=c2h5+co2 4.68E+2 3.16 5380.0 !Marinov 1998 ch3ch2o+h=ch3+ch2oh 3.00E+13 0.0 0.0 !Marinov 1998 ch3ch2o+h=c2h4+h2o 3.00E+13 0.0 0.0 !Marinov 1998 ch3ch2o+oh=ch3hco+h2o 1.00E+13 0.0 0.0 !Marinov 1998 ch3choh+o2=ch3hco+ho2 4.82E+14 0.0 5017.0 !Marinov 1998 dup ch3choh+o2=ch3hco+ho2 8.43E+15 -1.2 0.0 !Marinov 1998 dup ch3choh+ch3=c3h6+h2o 1.00E+13 0.0 0.0 !Marinov 1998 ch3choh+o=ch3hco+oh 1.00E+14 0.0 0.0 !Marinov 1998 ch3choh+h=c2h4+h2o 3.00E+13 0.0 0.0 !Marinov 1998 ch3choh+h=ch3+ch2oh 3.00E+13 0.0 0.0 !Marinov 1998 ch3choh+ho2=ch3hco+oh+oh 4.00E+13 0.0 0.0 !Marinov 1998 ch3choh+oh=ch3hco+h2o 5.00E+12 0.0 0.0 !Marinov 1998 ch3choh+m=ch3hco+h+m 1.00E+14 0.0 25000.0 !Marinov 1998 ch3hco+oh=ch3co+h2o 9.24E+6 1.5 -962.0 !Taylor 1996 ch3hco+oh=ch2hco+h2o 1.72E+5 2.4 815.0 !Taylor 1996 ch3hco+oh=ch3+hcooh 3.00E+15 -1.076 0.0 !Marinov 1998 ch3hco+o=ch3co+oh 1.77E+18 -1.9 2975.0 !Marinov 1998 ch3hco+o=ch2hco+oh 3.72E+13 -0.2 3556.0 !Marinov 1998 ch3hco+h=ch3co+h2 4.66E+13 -0.35 2988.0 !Marinov 1998 ch3hco+h=ch2hco+h2 1.85E+12 0.40 5359.0 !Marinov 1998 ch3hco+ch3=ch3co+ch4 3.90E-7 5.8 2200.0 !Marinov 1998 ch3hco+ch3=ch2hco+ch4 2.45E+1 3.15 5727.0 !Marinov 1998 ch3hco+ho2=ch3co+h2o2 2.40E+19 -2.2 14030.0 !Marinov 1998 ch3hco+ho2=ch2hco+h2o2 2.32E+11 0.40 14864.0 !Marinov 1998 ch3hco+o2=ch3co+ho2 1.00E+14 0.00 42200.0 ! xxxxx c2h6+ch3=c2h5+ch4 5.50E-01 4.0 8300.0 ! Miller 1992 c2h6+h=c2h5+h2 5.40E+02 3.5 5210.0 ! Miller 1992 c2h6+o=c2h5+oh 3.00E+07 2.0 5115.0 ! Miller 1992 c2h6+oh=c2h5+h2o 7.23E+06 2.0 864.0 ! Baulch 1992 c2h5+h=c2h4+h2 1.25E+14 0.0 8000.0 ! Marinov 1995 c2h5+h=ch3+ch3 3.00E+13 0.0 0.0 ! Warnatz 1984 c2h5+h=c2h6 3.00E+13 0.0 0.0 ! Marinov 1998 c2h5+oh=c2h4+h2o 4.00E+13 0.0 0.0 ! Marinov 1995 c2h5+o=ch3+ch2o 1.00E+14 0.0 0.0 ! Herron 1988 c2h5+ho2=c2h6+o2 3.00E+12 0.0 0.0 ! Marinov 1998 c2h5+ho2=ch3ch2o+oh 3.00E+13 0.0 0.0 ! Tsang 1986 c2h5+o2=c2h4+ho2 2.89E+28 -5.4 7585.0 ! Marinov 1998 c2h5+o2=ch3hco+oh 4.90E+11 -0.48 8357.0 ! Marinov 1998 c2h4+oh=c2h4oh 1.29E+12 0.0 -817.0 ! Atkinson 1986 c2h4oh+o2=hoc2h4o2 1.00E+12 0.0 -1100.0 ! Marinov 1998 hoc2h4o2=ch2o+ch2o+oh 6.00E+10 0.0 24500.0 ! Marinov 1998 c2h4+oh=c2h3+h2o 2.02E+13 0.0 5936.0 ! Miller 1992 c2h4+o=ch3+hco 1.02E+07 1.88 179.0 ! Baulch 1994 c2h4+o=ch2hco+h 3.39E+06 1.88 179.0 ! Baulch 1994 c2h4+ch3=c2h3+ch4 6.62E+00 3.7 9500.0 ! Marinov 1995 c2h4+h=c2h3+h2 3.36E-07 6.0 1692.0 ! Dagaut 1990 c2h4+h (+m)=c2h5(+m) 1.08E+12 0.454 1822.0 ! Feng 1993 low / 1.112E+34 -5.0 4448.0 / ! Marinov 1996 troe / 1.0 1.0E-15 95.0 200.0 / h2o /5.0/ h2/2.0/ co2/3.0/ co/2.0/ c2h4(+m)=c2h2+h2(+m) 1.8e14 0.0 87000. ! Marinov 1997 low / 1.5e15 0.0 55443. / c2h3+h(+m)=c2h4(+m) 6.1e12 0.27 280. !GRI-Mech2.11 low/9.8e29 -3.86 3320./ troe/ 0.782 208. 2663. 6095./ h2o/5.0/ c2h3+h=c2h2+h2 9.00E+13 0.0 0.0 ! Tsang 1986 c2h3+o=ch2co+h 3.00E+13 0.0 0.0 ! Miller 1992 c2h3+o2=ch2o+hco 1.70E+29 -5.312 6500.0 ! Marinov 1997 c2h3+o2=ch2hco+o 5.50E+14 -0.611 5260.0 ! Marinov 1997 c2h3+o2=c2h2+ho2 2.12E-06 6.0 9484.0 !cfm/nmm 1996 c2h3+oh=c2h2+h2o 2.00E+13 0.0 0.0 ! Miller 1992 c2h3+c2h=c2h2+c2h2 3.00E+13 0.0 0.0 ! Miller 1992 c2h3+ch=ch2+c2h2 5.00E+13 0.0 0.0 ! Miller 1992 c2h3+ch3=ac3h5+h 4.73E+02 3.7 5677.0 ! Marinov 1996 c2h3+ch3=c3h6 4.46E+56 -13.0 13865.0 ! Marinov 1996 c2h3+ch3=c2h2+ch4 2.00E+13 0.0 0.0 ! Fahr 1991 c2h2+oh=c2h+h2o 3.37E+07 2.0 14000.0 ! Miller 1992 c2h2+oh=hccoh+h 5.04E+05 2.3 13500.0 ! Miller 1992 c2h2+oh=ch2co+h 2.18E-04 4.5 -1000.0 ! Miller 1992 dup c2h2+oh=ch2co+h 2.00E+11 0.0 0.0 ! Vandooren 1977 dup c2h2+oh=ch3+co 4.83E-04 4.0 -2000.0 ! Miller 1992 hccoh+h=ch2co+h 1.00E+13 0.0 0.0 ! Miller 1992 c2h2+o=ch2+co 6.12E+06 2.0 1900.0 ! Marinov 1996 c2h2+o=hcco+h 1.43E+07 2.0 1900.0 ! Marinov 1996 c2h2+o=c2h+oh 3.16E+15 -0.6 15000.0 ! Miller 1992 c2h2+ch3=c2h+ch4 1.81E+11 0.0 17289.0 ! Tsang 1986 c2h2+o2=hcco+oh 4.00e+07 1.5 30100.0 ! Marinov 1997 c2h2+m=c2h+h+m 4.20E+16 0.0 107000.0 ! Miller 1992 c2h2+h (+m)=c2h3(+m) 3.11E+11 0.58 2589.0 ! Knyazev 1995 low / 2.25E+40 -7.269 6577.0 / ! Marinov 1996 troe /1.0 1.0E-15 675.0 1.0E+15 / h2o /5.0/ h2/2.0/ co2/3.0/ co/2.0/ ch2hco+h=ch3+hco 5.00E+13 0.0 0.0 !Marinov 1998 ch2hco+h=ch2co+h2 2.00E+13 0.0 0.0 !Marinov 1998 ch2hco+o=ch2o+hco 1.00E+14 0.0 0.0 !Marinov 1996 ch2hco+oh=ch2co+h2o 3.00E+13 0.0 0.0 !Marinov 1996 ch2hco+o2=ch2o+co+oh 3.00E+10 0.0 0.0 !Baulch 1992 ch2hco+ch3=c2h5+co+h 4.90E+14 -0.50 0.0 !Marinov 1998 ch2hco+ho2=ch2o+hco+oh 7.00E+12 0.0 0.0 !Marinov 1998 ch2hco+ho2=ch3hco+o2 3.00E+12 0.0 0.0 !Marinov 1998 ch2hco=ch3+co 1.17E+43 -9.83 43756.0 !Marinov 1998 ch2hco=ch2co+h 1.81E+43 -9.61 45868.0 !Marinov 1998 chocho(+m)=ch2o+co(+m) 4.27E+12 0.0 50600.0 ! Marinov 1995 low / 8.91E+16 0.0 49200.0 / ! Marinov 1995 chocho=co+co+h2 4.07E+42 -8.5 69278.0 ! Marinov 1996 chocho+oh=hco+co+h2o 1.00E+13 0.0 0.0 ! Marinov 1995 chocho+o=hco+co+oh 7.24E+12 0.0 1970.0 ! Marinov 1995 chocho+h=ch2o+hco 1.00E+12 0.0 0.0 ! Marinov 1995 chocho+ho2=hco+co+h2o2 1.70E+12 0.0 10700.0 ! Marinov 1995 chocho+ch3=hco+co+ch4 1.74E+12 0.0 8440.0 ! Marinov 1995 chocho+o2=hco+co+ho2 1.00E+14 0.0 37000.0 ! Marinov 1995 ch3co(+m)=ch3+co(+m) 3.00E+12 0.0 16722.0 ! Warnatz 1984 low / 1.20E+15 0.0 12518.0 / ! Warnatz 1984 ch2co+o=co2+ch2 1.75E+12 0.0 1350.0 ! Marinov 1995 ch2co+h=ch3+co 2.71E+4 2.75 714.0 ! Marinov 1996 ch2co+h=hcco+h2 2.00E+14 0.0 8000.0 ! Marinov 1996 ch2co+o=hcco+oh 1.00E+13 0.0 8000.0 ! Miller 1992 ch2co+oh=hcco+h2o 1.00E+13 0.0 2000.0 ! Marinov 1996 ch2co+oh=ch2oh+co 3.73E+12 0.0 -1013.0 ! Brown 1989 ch2co(+m)=ch2+co(+m) 3.00E+14 0.0 70980.0 ! Miller 1992 low / 3.60E+15 0.0 59270.0 / ! Miller 1992 c2h+h2=c2h2+h 4.09E+05 2.39 864.3 ! Miller 1992 c2h+o=ch+co 5.00E+13 0.0 0.0 ! Miller 1992 c2h+oh=hcco+h 2.00E+13 0. 0.0 ! Miller 1992 c2h+o2=co+co+h 9.04E+12 0.0 -457.0 ! Opansky 1993 hcco+c2h2=h2ccch+co 1.00E+11 0.0 3000.0 ! Miller 1992 hcco+h=ch2(s)+co 1.00E+14 0.0 0.0 ! Miller 1992 hcco+o=h+co+co 8.00E+13 0.0 0.0 ! Peeters 1995 hcco+o=ch+co2 2.95E+13 0.0 1113.0 ! Peeters 1995 hcco+o2=hco+co+o 2.50E+8 1.0 0.0 ! Marinov 1997 hcco+o2=co2+hco 2.40E+11 0.0 -854.0 ! Marinov 1997 hcco+ch=c2h2+co 5.00E+13 0.0 0.0 ! Miller 1992 hcco+hcco=c2h2+co+co 1.00E+13 0.0 0.0 ! Miller 1992 hcco+oh=c2o+h2o 3.00E+13 0.0 0.0 ! Miller 1992 c2o+h=ch+co 1.00E+13 0.0 0.0 ! Miller 1992 c2o+o=co+co 5.00E+13 0.0 0.0 ! Miller 1992 c2o+oh=co+co+h 2.00E+13 0.0 0.0 ! Miller 1992 c2o+o2=co+co+o 2.00E+13 0.0 0.0 ! Miller 1992 c3h8(+m)=c2h5+ch3(+m) 7.90E+22 -1.8 88629.0 ! Tsang 1988 low / 7.237E+27 -2.88 67448.0 / ! Al-Alami 1983 troe /1.0 1.0E-15 1500.0 1.0E+15/ h2o/5.0/ co2/3.0/ co/2.0/ h2/2.0/ ic3h7+ho2=c3h8+o2 3.00E+12 0.0 0.0 !Marinov 1998 nc3h7+ho2=c3h8+o2 3.00E+12 0.0 0.0 !Marinov 1998 c3h8+ho2=nc3h7+h2o2 4.76E+04 2.55 16492.0 ! Tsang 1988 c3h8+ho2=ic3h7+h2o2 9.64E+03 2.6 13909.0 ! Tsang 1988 c3h8+oh=nc3h7+h2o 3.16E+07 1.8 934.0 ! Cohen 1991 c3h8+oh=ic3h7+h2o 7.08E+06 1.9 -159.0 ! Cohen 1991 c3h8+o=nc3h7+oh 3.73E+06 2.4 5504.0 ! Cohen 1986 c3h8+o=ic3h7+oh 5.48E+05 2.5 3139.0 ! Cohen 1986 c3h8+h=ic3h7+h2 1.30E+06 2.4 4471.0 ! Tsang 1988 c3h8+h=nc3h7+h2 1.33E+06 2.54 6756.0 ! Tsang 1988 c3h8+ch3=nc3h7+ch4 9.04E-01 3.65 7153.0 ! Tsang 1988 c3h8+ch3=ic3h7+ch4 1.51E+00 3.46 5480.0 ! Tsang 1988 c3h8+c2h3=ic3h7+c2h4 1.00E+03 3.1 8830.0 ! Tsang 1988 c3h8+c2h3=nc3h7+c2h4 6.00E+02 3.3 10500.0 ! Tsang 1988 c3h8+c2h5=ic3h7+c2h6 1.51E+00 3.46 7470.0 ! Tsang 1988 c3h8+c2h5=nc3h7+c2h6 9.03E-01 3.65 9140.0 ! Tsang 1988 c3h8+ac3h5=c3h6+nc3h7 2.35E+02 3.3 19842.0 ! Tsang 1988 c3h8+ac3h5=c3h6+ic3h7 7.83E+01 3.3 18169.0 ! Tsang 1988 nc3h7(+m)=c2h4+ch3(+m) 1.23E+13 -0.1 30202.0 ! Bencsura 1992 low / 5.485E+49 -10.0 35766.0 / ! Bencsura 1992 troe / 2.17 1.0E-15 251.0 1185.0 / h2o /5.0/ h2/2.0/ co2/3.0/ co/2.0/ c3h6+h(+m)=ic3h7(+m) 5.70E+09 1.16 874.0 ! Seakins 1993 low / 1.64E+54 -11.1 9364.0 / ! Marinov 1996 troe / 1.0 1.0E-15 260.0 3000.0 / h2o /5.0/ h2/2.0/ co2/3.0/ co/2.0/ ic3h7+o2=c3h6+ho2 1.88E+20 -2.69 7109.0 ! Marinov 1998 nc3h7+o2=c3h6+ho2 3.83E+26 -4.44 7724.0 ! Marinov 1998 ic3h7+h=c2h5+ch3 5.00E+13 0.0 0.0 ! Tsang 1988 nc3h7+h=c2h5+ch3 1.00E+14 0.0 0.0 ! Tsang 1988 c3h6=c2h2+ch4 2.50E+12 0.0 70000.0 ! Hidaka 1992 c3h6=ac3h4+h2 3.00E+13 0.0 80000.0 ! Hidaka 1992 pc3h5+h=c3h6 1.00E+14 0.0 0.0 !Marinov 1998 sc3h5+h=c3h6 1.00E+14 0.0 0.0 !Marinov 1998 c3h6+ho2=ac3h5+h2o2 9.64E+03 2.6 13910.0 ! Tsang 1991 c3h6+oh=ac3h5+h2o 3.12E+06 2.0 -298.0 ! Tsang 1991 c3h6+oh=sc3h5+h2o 1.11E+06 2.0 1451.0 ! Tsang 1991 c3h6+oh=pc3h5+h2o 2.11E+06 2.0 2778.0 ! Tsang 1991 c3h6+o=ch3chco+h+h 5.01E+07 1.76 76.0 ! Tsang 1991 c3h6+o=c2h5+hco 1.58E+07 1.76 -1216.0 ! Tsang 1991 c3h6+o=ac3h5+oh 5.24E+11 0.7 5884.0 ! Tsang 1991 c3h6+o=pc3h5+oh 1.20E+11 0.7 8959.0 ! Tsang 1991 c3h6+o=sc3h5+oh 6.03E+10 0.7 7632.0 ! Tsang 1991 c3h6+h=c2h4+ch3 7.23E+12 0.0 1302.0 ! Tsang 1991 c3h6+h=ac3h5+h2 1.73E+05 2.5 2492.0 ! Tsang 1991 c3h6+h=sc3h5+h2 4.09E+05 2.5 9794.0 ! Tsang 1991 c3h6+h=pc3h5+h2 8.04E+05 2.5 12284.0 ! Tsang 1991 ac3h5+ho2=c3h6+o2 3.00E+12 0.0 0.0 ! Tsang 1991 c3h6+ch3=ac3h5+ch4 2.22E+00 3.5 5675.0 ! Tsang 1991 c3h6+ch3=sc3h5+ch4 8.43E-01 3.5 11656.0 ! Tsang 1991 c3h6+ch3=pc3h5+ch4 1.35E+00 3.5 12848.0 ! Tsang 1991 c3h6+hco=ac3h5+ch2o 1.08E+07 1.9 17010.0 ! Tsang 1991 ch3chco+oh=ch2chco+h2o 4.00E+06 2.0 0.0 ! Marinov 1996 ch3chco+o=ch2chco+oh 7.60E+08 1.5 8500.0 ! Marinov 1996 ch3chco+h=ch2chco+h2 2.00E+05 2.5 2500.0 ! Marinov 1996 ch3chco+h=c2h5+co 2.00E+13 0.0 2000.0 ! Marinov 1996 ch3chco+o=ch3+hco+co 3.00E+07 2.0 0.0 ! Marinov 1996 ch2chcho+oh=ch2chco+h2o 1.00E+13 0.0 0.0 ! Marinov 1996 ch2chcho+o=ch2chco+oh 7.24E+12 0.0 1970.0 ! Marinov 1996 ch2chcho+o=ch2co+hco+h 5.01E+07 1.76 76.0 ! Marinov 1996 ch2chcho+h=ch2chco+h2 3.98E+13 0.0 4200.0 ! Marinov 1996 ch2chcho+h=c2h4+hco 2.00E+13 0.0 3500.0 ! Marinov 1996 ch2chcho+o2=ch2chco+ho2 3.00E+13 0.0 36000.0 ! Marinov 1996 ch2chco=c2h3+co 1.00E+14 0.0 34000.0 ! Marinov 1996 ch2chco+o=c2h3+co2 1.00E+14 0.0 0.0 ! Marinov 1996 ac3h5+o2=ch2chcho+oh 1.82E+13 -0.41 22859.0 ! Bozzelli 1993 ac3h5+o2=ac3h4+ho2 4.99E+15 -1.4 22428.0 ! Bozzelli 1993 ac3h5+o2=ch2hco+ch2o 1.06E+10 0.34 12838.0 ! Bozzelli 1993 ac3h5+o2=c2h2+ch2o+oh 2.78E+25 -4.8 15468.0 ! Bozzelli 1993 ac3h5+ho2=ch2chch2o+oh 1.00E+13 0.0 0.0 !Tsang 1991 ch2chch2o+o2=ch2chcho+ho2 4.00E+10 0.0 1100.0 ! Marinov 1998 ch2chch2o+co=ac3h5+co2 4.68E+2 3.16 5380.0 ! Marinov 1998 ch2chcho+h(+m)=ch2chch2o(+m) 5.40E+11 0.454 2600. ! Marinov 1998 low/ 1.5e30 -4.8 5560./ troe/0.78 94. 1555. 4200./ h2o/5./ ac3h5+oh=ac3h4+h2o 1.00E+13 0.0 0.0 ! Tsang 1991 ac3h5+h=ac3h4+h2 5.00E+13 0.0 0.0 ! Marinov 1996 ac3h5+h=c3h6 1.88E+26 -3.6 5468.0 ! Marinov 1996 ac3h5+o=ch2chcho+h 1.81E+14 0.0 0.0 ! Slagle 1992 ac3h5+ch3=ac3h4+ch4 3.02E+12 -0.32 -131.0 ! Tsang 1991 pc3h5+o2=ch3hco+hco 1.09E+23 -3.29 3892.0 ! Marinov 1996 pc3h5+o2=ch3chco+h+o 1.60E+15 -0.78 3135.0 ! Marinov 1996 pc3h5+o=ch3chco+h 1.00E+14 0.0 0.0 ! Marinov 1996 pc3h5+h=pc3h4+h2 2.00E+13 0.0 0.0 ! Marinov 1996 pc3h5+oh=pc3h4+h2o 1.00E+13 0.0 0.0 ! Marinov 1996 pc3h5+h=ac3h5+h 1.00E+14 0.0 0.0 ! Marinov 1996 sc3h5+h=ac3h5+h 1.00E+14 0.0 0.0 ! Marinov 1996 sc3h5+o2=ch3co+ch2o 1.09E+22 -3.29 3892.0 ! Marinov 1996 sc3h5+o=ch2co+ch3 1.00E+14 0.0 0.0 ! Marinov 1996 sc3h5+h=pc3h4+h2 4.00E+13 0.0 0.0 ! Marinov 1996 sc3h5+oh=pc3h4+h2o 2.00E+13 0.0 0.0 ! Marinov 1996 ac3h4+h=h2ccch+h2 2.00E+7 2.0 5000.0 ! Marinov 1997 ac3h4+o=c2h4+co 1.34E+07 1.88 179.0 ! Marinov 1996 ac3h4+oh=h2ccch+h2o 1.00E+7 2.0 1000.0 ! Marinov 1997 ac3h4+ch3=h2ccch+ch4 1.50E+0 3.5 5600.0 ! Marinov 1997 ac3h4=pc3h4 1.48E+13 0.0 60401.0 ! Marinov 1997 pc3h4+h=h2ccch+h2 2.00E+7 2.0 5000.0 ! Marinov 1997 pc3h4+o=c2h4+co 1.50E+13 0.0 2102.0 ! Marinov 1996 pc3h4+oh=h2ccch+h2o 1.00E+7 2.0 1000.0 ! Marinov 1997 pc3h4+ch3=h2ccch+ch4 1.50E+0 3.5 5600.0 ! Marinov 1997 pc3h4+h=ch3+c2h2 5.12E+10 1.0 2060.0 ! Marinov 1997 pc3h4+h(+m)=sc3h5(+m) 6.50E+12 0.0 2000.0 ! Wagner 1972 low / 8.45E+39 -7.27 6577.0 / ! Marinov 1996 ac3h4+h(+m)=ac3h5(+m) 1.20E+11 0.69 3007.0 ! Tsang 1992 low / 5.56E+33 -5.0 4448.0 / ! Marinov 1996 ac3h4+h(+m)=sc3h5(+m) 8.49E+12 0.0 2000.0 ! Wagner 1972 low / 1.11E+34 -5.0 4448.0 / ! Marinov 1996 h2ccch+o2=ch2co+hco 3.00E+10 0.0 2868.0 ! Miller 1992 h2ccch+o=ch2o+c2h 1.40E+14 0.0 0.0 ! Pauwels 1995 h2ccch+h=c3h2+h2 5.00e+13 0.0 1000.0 ! Pauwels 1995 h2ccch+oh=c3h2+h2o 2.00E+13 0.0 0.0 ! Miller 1992 h2ccch+ch3=c3h2+ch4 2.00E+13 0.0 0.0 ! Marinov 1997 h2ccch+h(+m)=ac3h4(+m) 1.66E+15 -0.37 0.0 ! Marinov 1996 low / 3.36E+45 -8.52 6293.0 / ! Kiefer 1995 h2o/5.0/ h2/2.0/ co2/3.0/ co/2.0/ o2/2.0/ c2h2/2.0/ h2ccch+h(+m)=pc3h4(+m) 1.66E+15 -0.37 0.0 ! Marinov 1996 low / 8.78E+45 -8.9 7974.0 / ! Kiefer 1995 h2o /5.0/ h2/2.0/ co2/3.0/ co/2.0/ o2/2.0/ c2h2/2.0/ c3h2+o2=hcco+co+h 2.00E+12 0.0 1000.0 ! Pauwels 1995 c3h2+o=c2h2+co 1.00E+14 0.0 0.0 ! Pauwels 1995 c3h2+oh=c2h2+hco 5.00E+13 0.0 0.0 ! Miller 1992 end