! Connaire, M. O., Curran, H J., Simmie, J. M., Pitz, W. J. and Westbrook, C.K., ! "A Comprehensive Modeling Study of Hydrogen Oxidation", ! International Journal of Chemical Kinetics, 36:603-622, 2004: UCRL-JC-152569. ! UCRL-WEB-208393 ! Review and release date: December 3, 2004. ! 11/19/04 version 1b: WJP: eliminated efficiences for co, co and hydrocarbon ! species. These caused errors from the Chemkin interpretor. ! 4/16/04 version 1a ! elements h c o n ar end species h h2 o o2 oh h2o n2 ho2 h2o2 ar end reactions cal/mole h+o2 = o+oh 1.915E+14 0.00 1.644E+04 rev / 5.481E+11 0.39 -2.930E+02 / o+h2 = h+oh 5.080E+04 2.67 6.292E+03 rev / 2.667E+04 2.65 4.880E+03 / oh+h2 = h+h2o 2.160E+08 1.51 3.430E+03 rev / 2.298E+09 1.40 1.832E+04 / o+h2o = oh+oh 2.970E+06 2.02 1.340E+04 rev / 1.465E+05 2.11 -2.904E+03 / h2+m = h+h+m 4.577E+19 -1.40 1.044E+05 rev / 1.146E+20 -1.68 8.200E+02 / h2/2.5/ h2o/12.0/ o2+m = o+o+m 4.515E+17 -0.64 1.189E+05 rev / 6.165E+15 -0.50 0.000E+00 / h2/2.5/ h2o/12.0/ ar/0.83/ oh+m = o+h+m 9.880E+17 -0.74 1.021E+05 rev / 4.714E+18 -1.00 0.000E+00 / h2/2.5/ h2o/12.0/ ar/0.75/ h2o+m = h+oh+m 1.912E+23 -1.83 1.185E+05 rev / 4.500E+22 -2.00 0.000E+00 / h2/0.73/ h2o/12.0/ ar/0.38/ h+o2(+m) = ho2(+m) 1.475E+12 0.60 0.000E+00 ! rev / 3.090E+12 0.53 4.887E+04 / low / 3.4820E+16 -4.1100E-01 -1.1150E+03 / troe/0.5 1.0000E-30 1.0000E+30 1.0000E+100 / h2/1.3/ h2o/14.0/ ar/0.67/ ho2+h = h2+o2 1.660E+13 0.00 8.230E+02 rev / 3.164E+12 0.35 5.551E+04 / ho2+h = oh+oh 7.079E+13 0.00 2.950E+02 rev / 2.027E+10 0.72 3.684E+04 / ho2+o = oh+o2 3.250E+13 0.00 0.000E+00 rev / 3.252E+12 0.33 5.328E+04 / ho2+oh = h2o+o2 2.890E+13 0.00 -4.970E+02 rev / 5.861E+13 0.24 6.908E+04 / h2o2+o2 = ho2+ho2 4.634E+16 -0.35 5.067E+04 rev / 4.200E+14 0.00 1.198E+04 / DUPLICATE h2o2+o2 = ho2+ho2 1.434E+13 -0.35 3.706E+04 rev / 1.300E+11 0.00 -1.629E+03 / DUPLICATE h2o2(+m) = oh+oh(+m) 2.951E+14 0.00 4.843E+04 ! rev / 3.656E+08 1.14 -2.584E+03 / low / 1.202E+17 0.00 45500. / troe /0.5 1.0e-30 1.0e+30 1.0e+100/ h2/2.5/ h2o/12.0/ ar/0.64/ h2o2+h = h2o+oh 2.410E+13 0.00 3.970E+03 rev / 1.269E+08 1.31 7.141E+04 / h2o2+h = h2+ho2 6.025E+13 0.00 7.950E+03 rev / 1.041E+11 0.70 2.395E+04 / h2o2+o = oh+ho2 9.550E+06 2.00 3.970E+03 rev / 8.660E+03 2.68 1.856E+04 / h2o2+oh = h2o+ho2 1.000E+12 0.00 0.000E+00 rev / 1.838E+10 0.59 3.089E+04 / DUPLICATE h2o2+oh = h2o+ho2 5.800E+14 0.00 9.557E+03 rev / 1.066E+13 0.59 4.045E+04 / DUPLICATE end