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

   1 #include atoms
   2
   3   #DEFVAR
   4      O3         = 3O ;
   5      H2O2               = 2H + 2O ;
   6      NO         = N + O ;
   7      NO2                = N + 2O ;
   8      NO3                = N + 3O ;
   9      N2O5               = 2N + 5O ;
  10      HONO               = H + 2O + N ;
  11      HNO3               = H + N + 3O ;
  12      HNO4               = H + N + 4O ;
  13      SO2                = S + 2O ;
  14      H2SO4              = 2H + S + 4O ;
  15      CO                 = C + O ;
  16      HCHO               = 2H + C + O ;
  17      CCHO               = 2C + H + O ;
  18      RCHO               = 3C + ignore ;
  19      ACET               =                       ignore ;
  20      MEK                =                       ignore ;
  21      HCOOH              = 2H + C + 2O ;
  22      MEOH               =                       ignore ;
  23      ETOH               =                       ignore ;
  24      CCO_OH             =                       ignore ;
  25      RCO_OH             =                       ignore ;
  26      GLY                =                       ignore ;
  27      MGLY               = 3C + 4H + 2O ;
  28      BACL               =                       ignore ;
  29      CRES               =                       ignore ;
  30      BALD               =                       ignore ;
  31      ISOPROD            =                       ignore ;
  32      METHACRO   =                       ignore ;
  33      MVK                =                       ignore ;
  34      PROD2              =                       ignore ;
  35      DCB1               =                       ignore ;
  36      DCB2               =                       ignore ;
  37      DCB3               =                       ignore ;
  38      ETHENE             = 2C + 4H ;
  39      ISOPRENE   =                       ignore ;
  40      C2H6               = 2C + 6H ;
  41      C3H8               = 3C + 8H ;
  42      C2H2               = 2C + 2H ;
  43      C3H6               = 3C + 6H ;
  44      ALK3               =                       ignore ;
  45      ALK4               =                       ignore ;
  46      ALK5               =                       ignore ;
  47      ARO1               =                       ignore ;
  48      ARO2               =                       ignore ;
  49      OLE1               =                       ignore ;
  50      OLE2               =                       ignore ;
  51      TERP               =                       ignore ;
  52      RNO3               =                       ignore ;
  53      NPHE               =                       ignore ;
  54      PHEN               =                       ignore ;
  55      PAN                = 2C + 3H + 5O + N ;
  56      PAN2               = N + ignore ;
  57      PBZN               = N + ignore ;
  58      MA_PAN             = N + ignore ;
  59      BC                 = C ;
  60      OC                 = C ;
  61      SSF                =                       ignore ;
  62      SSC                =                       ignore ;
  63      PM10               =                       ignore ;
  64      PM25               =                       ignore ;
  65      DMS                =                       ignore ;
  66      DST1               =                       ignore ;
  67      DST2               =                       ignore ;
  68      DST3               =                       ignore ;
  69      CO2                = C + 2O ;
  70      CCO_OOH            = 2C + 3O + H ;
  71      RCO_O2             =                       ignore ;
  72      RCO_OOH            =                       ignore ;
  73      XN         =                       ignore ;
  74      XC         =                       ignore ;
  75      O3P                = O ;
  76      O1D                = O ;
  77      OH         = H + O ;
  78      HO2                = H+ 2O ;
  79      C_O2               =                       ignore ;
  80      COOH               = C + 2O + H ;
  81      ROOH               =                       ignore ;
  82      RO2_R              =                       ignore ;
  83      R2O2               =                       ignore ;
  84      RO2_N              =                       ignore ;
  85      HOCOO              = H + 3O + C ;
  86      CCO_O2             =                       ignore ;
  87      BZCO_O2            =                       ignore ;
  88      BZNO2_O            =                       ignore ;
  89      BZ_O               =                       ignore ;
  90      MA_RCO3            =                       ignore ;
  91      TBU_O              =                       ignore ;
  92
  93
  94 #DEFFIX
  95      AIR                = ignore ;
  96      N2         = 2N ;
  97      O2         = 2O ;
  98      H2O                = 2H + O ;
  99      H2         = 2H ;
 100      CH4                = C + 4H ;
 101