1 ------------------------------------------------------------------------- 25 ! neqs (number of chemical species) N2 0.7054D0 O 0.4796D0 H 0.1228D0 OH 0.4887D0 H2 0.2051D0 H2O2 0.7472D0 H2O 0.5483D0 O2 0.7379D0 HO2 0.7420D0 CO 0.7472D0 CH2O 0.8537D0 CH3 0.6713D0 CO2 0.9477D0 CH4 0.6745D0 C2H4 0.8882D0 C2H6 0.9766D0 CH2CO 1.0093D0 C2H2 0.8803D0 C3H6 1.2488D0 C4H81 1.4113D0 C4H6 1.4038D0 C6H6 1.5577D0 C5H10 1.5473D0 C6H12 1.7073D0 NC12H26 2.5397D0 ------------------------------------------------------------------------- 13 ! nreac (number of chemical reactions) *** Reaction # 1 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 2 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 3 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 4 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 5 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 6 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 7 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 8 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 9 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 10 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 11 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 12 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0 0d0 ! Pre-exponential factor (cgs) 0.0d0 ! Activation Energy (cal/mol) 0.d0 0 *** Reaction # 13 : CH4+ 0.50O2=>CO+2H2 4 ! nspec (number of species involved in the reaction) 'CH4' -1.00 +0.50 0.0 'O2' -0.50 +1.30 0.0 'CO' +1.00 +0.00 0.0 'H2' +2.00 +0.00 0.0