chem/KPP/kpp/kpp-2.1/test/strato.spc

   1 #include atoms
   2
   3 #DEFVAR
   4     O           = O ;           {oxygen atomic ground state (3P)}
   5     O1D         = O ;           {oxygen atomic first singlet state}
   6     O3          = 3O ;          {ozone}
   7     NO          = N + O ;       {nitric oxide}
   8     NO2         = N + 2O ;      {nitrogen dioxide}
   9     NO3         = N + 3O ;      {nitrogen trioxide}
  10     N2O5        = 2N + 5O ;     {dinitrogen pentoxide}
  11     HNO3        = H + N + 3O ;  { nitric acid }
  12     HNO4        = H + N + 4O ;  {HO2NO2 pernitric acid}
  13     H           = H ;           {hydrogen atomic ground state (2S)}
  14     OH          = O + H ;       {hydroxyl radical}
  15     HO2         = H + 2O ;      {perhydroxyl radical}
  16     H2O2        = 2H + 2O ;     {hydrogen peroxide}
  17     CH3         = C + 3H ;      {methyl radical}
  18     CH3O        = C + 3H + O ;  {methoxy radical}
  19     CH3O2       = C + 3H + 2O ; {methylperoxy radical}
  20     CH3OOH      = C + 4H + 2O ; {CH4O2      methylperoxy alcohol}
  21     HCO         = H + C + O ;   {CHO  formyl radical}
  22     CH2O        = C + 2H + O ;  {formalydehyde}
  23     Cl          = Cl ;          {chlorine atomic ground state (2P3/2)}
  24     Cl2         = 2Cl ;         {molecular chlorine}
  25     ClO         = Cl + O ;      {chlorine monoxide radical}
  26     ClOO        = Cl + 2O ;     {asymmetrical chlorine dioxide radical}
  27     OClO        = Cl + 2O ;     {symmetrical chlorine dioxide}
  28     Cl2O2       = 2Cl + 2O ;    {chlorine monoxide dimer}
  29     HCl         = H + Cl ;      {hydrogen chloride}
  30     HOCl        = H + O + Cl ;  {hydrochlorous acid}
  31     ClONO2      = Cl + 3O + N ; {ClNO3, chlorine nitrate}
  32     Br          = Br ;          {bromine atomic ground state (2P3/2)}
  33     BrCl        = Br + Cl ;     {bromine chloride}
  34     BrO         = Br + O ;      {bromine monoxide radical}
  35     HBr         = H + Br ;      {hydrogen bromide}
  36     HOBr        = H + O + Br ;  {hydrobromous acid}
  37     BrONO2      = Br + N + 3O ; {BrNO3, bromine nitrate}
  38
  39
  40 #DEFFIX
  41     H2O         = H + 2O ;      {water}
  42     H2          = 2H ;          {molecular hydrogen}
  43     O2          = 2O ;          {molecular oxygen}
  44     N2          = 2N ;          {molecular nitrogen}
  45     CH4         = C + 4H ;      {methane}
  46     CO          = C + O ;       {carbon monoxide}