[2836] | 1 | !**************************************************************** |
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| 2 | ! |
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| 3 | ! Photochemical routine |
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| 4 | ! |
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| 5 | ! Authors: Franck Lefevre, Francisco Gonzalez-Galindo |
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| 6 | ! ------- |
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| 7 | ! |
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| 8 | ! Version: 14/11/2020 |
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| 9 | ! |
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| 10 | ! ASIS scheme : for details on the method see |
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| 11 | ! Cariolle et al., Geosci. Model Dev., 10, 1467-1485, 2017. |
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| 12 | ! |
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| 13 | ! ------- |
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| 14 | ! |
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| 15 | ! 2022/09/15: adding ion chemistry by Antoine Martinez |
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| 16 | ! |
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| 17 | !***************************************************************** |
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[2187] | 18 | |
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[2836] | 19 | subroutine photochemistry_venus(nz, n_lon, zlocal, ptimestep, & |
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| 20 | ok_jonline,ok_ionchem,tuneupperatm, & |
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| 21 | nb_reaction_3_max,nb_reaction_4_max, & |
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| 22 | nb_phot_max,nphotion,ig, & |
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| 23 | p, t, t_elect, tr, vmr_dens_euv, mumean, & |
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| 24 | sza_input, lon, lat, nesp, nespeuv, iter, & |
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| 25 | prod_tr, loss_tr, em_no, em_o2) |
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| 26 | |
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[2187] | 27 | use chemparam_mod |
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[2780] | 28 | use photolysis_mod |
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[2836] | 29 | use param_v4_h, only: jion |
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| 30 | use iono_h, only: phdisrate |
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| 31 | !nphot ! number of photodissociations, include in "use photolysis_mod" |
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[2187] | 32 | |
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| 33 | implicit none |
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| 34 | |
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| 35 | !=================================================================== |
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| 36 | ! input: |
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| 37 | !=================================================================== |
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| 38 | |
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[2836] | 39 | integer, intent(in) :: nz ! number of atmospheric layers |
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| 40 | integer, intent(in) :: nesp ! number of tracers in traceur.def |
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| 41 | integer, intent(in) :: nespeuv ! number of tracers for jthermcal_e107.F |
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[2187] | 42 | |
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[2836] | 43 | integer, intent(in) :: nb_reaction_3_max ! number of quadratic reactions |
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| 44 | integer, intent(in) :: nb_reaction_4_max ! number of bimolecular reactions |
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| 45 | integer, intent(in) :: nb_phot_max ! total number of photolysis+photoionizations+quenching reactions |
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| 46 | integer, intent(in) :: nphotion ! number of photoionizations |
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[2187] | 47 | |
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[2836] | 48 | logical, intent(in) :: ok_ionchem ! switch for ion chemistry |
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| 49 | logical, intent(in) :: ok_jonline ! switch for on-line calculation of photolysis rates |
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| 50 | logical, intent(in) :: tuneupperatm! upper atmosphere chemistry tuning |
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[2187] | 51 | |
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[2836] | 52 | real, dimension(nz) :: p ! pressure (hpa) |
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| 53 | real, dimension(nz) :: t ! temperature (k) |
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| 54 | real, dimension(nz) :: t_elect ! electronic temperature (k) |
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| 55 | real, dimension(nz) :: zlocal ! altitude (km) |
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| 56 | real, dimension(nz) :: mumean ! mean molecular mass (g/mol) |
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| 57 | real, dimension(nz,nespeuv) :: vmr_dens_euv ! tracer mixing ratio for jthermcal_e107 routine |
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| 58 | real :: ptimestep ! physics timestep (s) |
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| 59 | real :: sza_input ! solar zenith angle (degrees) |
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| 60 | real :: lon, lat ! longitude and latitude (degrees) |
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| 61 | |
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| 62 | integer :: ig ! grid point index |
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| 63 | |
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| 64 | integer :: n_lon ! for 1D test |
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| 65 | |
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[2187] | 66 | !=================================================================== |
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| 67 | ! input/output: |
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| 68 | !=================================================================== |
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| 69 | |
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[2780] | 70 | real, dimension(nz,nesp) :: tr ! tracer mixing ratio |
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[2580] | 71 | real, dimension(nz,nesp) :: prod_tr ! production (cm-3.s-1) |
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| 72 | real, dimension(nz,nesp) :: loss_tr ! loss (cm-3.s-1) |
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[2836] | 73 | real, dimension (nz) :: em_no ! volume emission rate of no |
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| 74 | real, dimension (nz) :: em_o2 ! volume emission rate of o2(deltag) |
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[2187] | 75 | |
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| 76 | !=================================================================== |
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| 77 | ! output: |
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| 78 | !=================================================================== |
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| 79 | |
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| 80 | integer :: iter(nz) ! iteration counter |
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| 81 | |
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| 82 | !=================================================================== |
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[2795] | 83 | ! local: |
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[2187] | 84 | !=================================================================== |
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| 85 | |
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[2836] | 86 | ! ok_ jonline: see physiq.def |
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[2780] | 87 | ! true : on-line calculation of photodissociation rates ! false : lookup table |
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| 88 | |
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[2187] | 89 | logical, save :: firstcall = .true. |
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| 90 | |
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| 91 | real, dimension(nz) :: conc ! total number density (molecule.cm-3) |
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| 92 | real, dimension(nz) :: surfice1d, surfdust1d |
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| 93 | |
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[2795] | 94 | integer :: ind_norec |
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| 95 | integer :: ind_orec |
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| 96 | |
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[2780] | 97 | ! photolysis lookup table (case jonline = .false.) |
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| 98 | ! if prior to jvenus.20211025, set nztable = 201 below |
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[2187] | 99 | |
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[2851] | 100 | integer, parameter :: nj = 23, nztable = 281, nsza = 27, nso2 = 13 |
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[2836] | 101 | real, dimension(nso2,nsza,nztable,nj), save :: jphot ! nj must be equal to nphot |
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[2187] | 102 | real, dimension(nztable), save :: table_colair |
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| 103 | real, dimension(nso2,nztable), save :: table_colso2 |
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| 104 | real, dimension(nsza), save :: table_sza |
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| 105 | real :: dist_sol |
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| 106 | |
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| 107 | ! number densities |
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| 108 | |
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[2836] | 109 | real (kind = 8), dimension(nesp) :: cold ! number densities at previous timestep (molecule.cm-3) |
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| 110 | real (kind = 8), dimension(nz,nesp) :: c ! number densities at current timestep (molecule.cm-3) |
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| 111 | real (kind = 8), dimension(nz,nespeuv) :: c_euv! number densities for jthermcal_e107 at current timestep (molecule.cm-3) |
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| 112 | real (kind = 8), dimension(nesp) :: cnew ! number densities at next timestep (molecule.cm-3) |
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| 113 | |
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[2187] | 114 | ! timesteps |
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| 115 | |
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| 116 | real :: ctimestep ! standard timestep for the chemistry (s) |
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| 117 | real :: dt_guess ! first-guess timestep (s) |
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| 118 | real :: dt_corrected ! corrected timestep (s) |
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| 119 | real :: time ! internal time (between 0 and ptimestep, in s) |
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| 120 | integer :: phychemrat |
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| 121 | |
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[2836] | 122 | !Tracer indexes for photionization coeffs |
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| 123 | |
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| 124 | integer,parameter :: induv_co2 = 1 |
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| 125 | integer,parameter :: induv_o2 = 2 |
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| 126 | integer,parameter :: induv_o = 3 |
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| 127 | integer,parameter :: induv_h2o = 4 |
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| 128 | integer,parameter :: induv_h2 = 5 |
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| 129 | integer,parameter :: induv_h2o2= 6 |
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| 130 | integer,parameter :: induv_o3 = 7 |
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| 131 | integer,parameter :: induv_n2 = 8 |
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| 132 | integer,parameter :: induv_n = 9 |
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| 133 | integer,parameter :: induv_no = 10 |
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| 134 | integer,parameter :: induv_co = 11 |
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| 135 | integer,parameter :: induv_h = 12 |
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| 136 | integer,parameter :: induv_no2 = 13 |
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| 137 | |
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[2187] | 138 | ! reaction rates |
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| 139 | |
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[2836] | 140 | !integer, parameter :: nb_phot_max = 35 |
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| 141 | !integer, parameter :: nb_phot = 22 |
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| 142 | !integer, parameter :: nb_reaction_3_max = 12 |
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| 143 | !integer, parameter :: nb_reaction_4_max = 98 |
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[2187] | 144 | |
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[2836] | 145 | real (kind = 8), dimension(nz, nb_phot_max) :: v_phot |
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| 146 | real (kind = 8), dimension(nz,nb_reaction_3_max) :: v_3 |
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| 147 | real (kind = 8), dimension(nz,nb_reaction_4_max) :: v_4 |
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[2187] | 148 | |
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| 149 | logical,parameter :: hetero_ice = .false. |
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| 150 | logical,parameter :: hetero_dust = .false. |
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| 151 | |
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| 152 | ! matrix |
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| 153 | |
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[2836] | 154 | real (kind = 8), dimension(nesp,nesp) :: mat, mat1 |
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| 155 | integer, dimension(nesp) :: indx |
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| 156 | integer :: code |
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[2187] | 157 | |
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| 158 | ! production and loss terms (for first-guess solution only) |
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| 159 | |
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[2836] | 160 | real (kind = 8), dimension(nesp) :: prod, loss, lossconc |
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[2187] | 161 | |
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| 162 | ! indexes |
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| 163 | |
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| 164 | integer :: i, iesp, iz |
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| 165 | |
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| 166 | if (firstcall) then |
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| 167 | !=================================================================== |
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[2795] | 168 | ! initialisation of photolysis |
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[2187] | 169 | !=================================================================== |
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| 170 | |
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[2836] | 171 | ! ok jonline |
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| 172 | ! true : on-line calculation of photodissociation rates ! false : lookup table |
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| 173 | if (ok_jonline) then |
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[2795] | 174 | print*, 'photochemistry: Read UV absorption cross-sections:' |
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[2780] | 175 | call init_photolysis |
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| 176 | else |
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[2795] | 177 | print*, 'photochemistry: Read photolysis lookup table:' |
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[2836] | 178 | call init_chimie(nphot, nztable, nsza, nso2, jphot, table_colair, table_colso2, table_sza) |
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[2780] | 179 | end if |
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[2187] | 180 | |
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| 181 | !=================================================================== |
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| 182 | ! initialisation of the reaction indexes |
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| 183 | !=================================================================== |
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| 184 | |
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[2836] | 185 | call indice(ok_ionchem, nb_phot_max, nb_reaction_3_max, nb_reaction_4_max) |
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[2187] | 186 | |
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| 187 | firstcall = .false. |
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| 188 | end if |
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| 189 | |
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| 190 | ! cloud and dust surfaces set to zero for the moment |
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| 191 | |
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| 192 | surfice1d(:) = 0. |
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| 193 | surfdust1d(:) = 0. |
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| 194 | |
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| 195 | !=================================================================== |
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| 196 | ! number densities (molecule.cm-3) |
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| 197 | !=================================================================== |
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| 198 | |
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| 199 | do iz = 1,nz |
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[2836] | 200 | conc(iz) = p(iz)/(1.38E-19*t(iz)) |
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| 201 | c(iz,:) = tr(iz,:)*conc(iz) |
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[2187] | 202 | end do |
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| 203 | |
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| 204 | !=================================================================== |
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| 205 | ! photodissociations |
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| 206 | !=================================================================== |
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| 207 | |
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| 208 | ! dist_sol : sun-venus distance (au) |
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| 209 | |
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| 210 | dist_sol = 0.72333 |
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| 211 | |
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[2836] | 212 | if (ok_jonline) then |
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| 213 | if (sza_input <= 95.) then ! day at 300 km |
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[2925] | 214 | call photolysis_online(nz, nb_phot_max, zlocal, p, & |
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| 215 | t, mumean, i_co2,i_co, i_o, i_o1d, & |
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[2851] | 216 | i_o2, i_o3, i_h2, i_oh, i_ho2, i_h2o2, i_h2o,& |
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[2925] | 217 | i_h, i_hcl, i_cl2, i_hocl, i_so2, i_so, & |
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| 218 | i_so3, i_s2, i_clo, i_ocs, i_cocl2, i_h2so4, & |
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| 219 | i_cl, i_no2, i_no, i_n2, i_n2d, & |
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[2780] | 220 | nesp, tr, sza_input, dist_sol, v_phot) |
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[2836] | 221 | |
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| 222 | !Calculation of photoionization rates, if needed |
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| 223 | if (ok_ionchem) then |
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| 224 | do iz = 1,nz |
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| 225 | c_euv(iz,:) = vmr_dens_euv(iz,:)*conc(iz) |
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| 226 | end do |
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| 227 | !! FAIRE ULTRA ATTENTION LE c_euv et vmr_dens_euv NE SONT PAS DANS LE MEME REGIME |
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| 228 | !! DE i_ESPECE QUE C, CNEW, COLD et TR |
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| 229 | call jthermcalc_e107(ig,nz,2,c_euv,nespeuv,t,zlocal,sza_input) |
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| 230 | do iz=1,nz |
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| 231 | call phdisrate(ig,nz,2,sza_input,iz) |
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| 232 | end do |
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| 233 | !CO2 photoionization |
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| 234 | v_phot(:,nphot+ 1) = jion(induv_co2,:,1) |
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| 235 | v_phot(:,nphot+ 2) = jion(induv_co2,:,2) |
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| 236 | v_phot(:,nphot+ 3) = jion(induv_co2,:,2) |
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| 237 | v_phot(:,nphot+ 4) = jion(induv_co2,:,3) |
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| 238 | v_phot(:,nphot+ 5) = jion(induv_co2,:,3) |
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| 239 | v_phot(:,nphot+ 6) = jion(induv_co2,:,4) |
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| 240 | v_phot(:,nphot+ 7) = jion(induv_co2,:,4) |
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| 241 | !O2 photoionization |
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| 242 | v_phot(:,nphot+ 8) = jion(induv_o2,:,1) |
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| 243 | !O photoionization |
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| 244 | v_phot(:,nphot+ 9) = jion(induv_o,:,1) |
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| 245 | !NO photoionization |
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| 246 | v_phot(:,nphot+10) = jion(induv_no,:,1) |
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| 247 | !CO photoionization |
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| 248 | v_phot(:,nphot+11) = jion(induv_co,:,1) |
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| 249 | v_phot(:,nphot+12) = jion(induv_co,:,2) |
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| 250 | v_phot(:,nphot+13) = jion(induv_co,:,2) |
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| 251 | !N2 photoionization |
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| 252 | v_phot(:,nphot+14) = jion(induv_n2,:,1) |
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| 253 | v_phot(:,nphot+15) = jion(induv_n2,:,2) |
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| 254 | v_phot(:,nphot+16) = jion(induv_n2,:,2) |
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| 255 | !N photoionization |
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| 256 | v_phot(:,nphot+17) = jion(induv_n,:,1) |
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| 257 | !H photoionization |
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| 258 | v_phot(:,nphot+18) = jion(induv_h,:,1) |
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| 259 | end if |
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[2780] | 260 | else ! night |
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| 261 | v_phot(:,:) = 0. |
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| 262 | end if |
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| 263 | else |
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[2851] | 264 | call phot(nj, nztable, nsza, nso2, sza_input, dist_sol, mumean, tr(:,i_co2), tr(:,i_so2), & |
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[2780] | 265 | jphot, table_colair, table_colso2, table_sza, nz, nb_phot_max, t, p, v_phot) |
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| 266 | end if |
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[2187] | 267 | |
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| 268 | !=================================================================== |
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| 269 | ! reaction rates |
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| 270 | !=================================================================== |
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| 271 | |
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[2836] | 272 | call krates(hetero_ice,hetero_dust,ok_ionchem, nphotion, nz, nesp, c, conc, t, t_elect, p, nb_phot_max, nb_reaction_3_max, & |
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| 273 | nb_reaction_4_max, tuneupperatm, v_3, v_4, v_phot, sza_input, ind_norec, ind_orec) |
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[2187] | 274 | |
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| 275 | !=================================================================== |
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| 276 | ! ctimestep : standard chemical timestep (s), defined as |
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| 277 | ! the fraction phychemrat of the physical timestep |
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| 278 | !=================================================================== |
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[2780] | 279 | |
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[2187] | 280 | phychemrat = 1 |
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| 281 | |
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| 282 | ctimestep = ptimestep/real(phychemrat) |
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| 283 | |
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| 284 | !=================================================================== |
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| 285 | ! loop over levels |
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| 286 | !=================================================================== |
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| 287 | |
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| 288 | do iz = 1,nz |
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| 289 | |
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| 290 | ! initializations |
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| 291 | |
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| 292 | time = 0. |
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| 293 | iter(iz) = 0 |
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| 294 | dt_guess = ctimestep |
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| 295 | cold(:) = c(iz,:) |
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| 296 | |
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| 297 | ! internal loop for the chemistry |
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| 298 | |
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| 299 | do while (time < ptimestep) |
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| 300 | |
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| 301 | iter(iz) = iter(iz) + 1 |
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| 302 | |
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| 303 | ! first-guess: fill matrix |
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| 304 | |
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[2580] | 305 | call fill_matrix(iz, mat1, prod, loss, lossconc, c, nesp, nz, & |
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[2187] | 306 | nb_reaction_3_max, nb_reaction_4_max, nb_phot_max, & |
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| 307 | v_phot, v_3, v_4) |
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| 308 | |
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| 309 | ! adaptative evaluation of the sub time step |
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| 310 | |
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| 311 | call define_dt(nesp, dt_corrected, dt_guess, ctimestep, cold(:), c(iz,:), & |
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[2320] | 312 | mat1, prod, loss, conc(iz), lon, lat) |
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[2187] | 313 | |
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| 314 | if (time + dt_corrected > ptimestep) then |
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| 315 | dt_corrected = ptimestep - time |
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| 316 | end if |
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| 317 | |
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| 318 | ! form the matrix identity + mat*dt_corrected |
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| 319 | |
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| 320 | mat(:,:) = mat1(:,:)*dt_corrected |
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| 321 | do iesp = 1,nesp |
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| 322 | mat(iesp,iesp) = 1. + mat(iesp,iesp) |
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| 323 | end do |
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| 324 | |
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| 325 | ! solve the linear system M*Cn+1 = Cn (RHS in cnew, then replaced by solution) |
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| 326 | |
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| 327 | cnew(:) = c(iz,:) |
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| 328 | |
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| 329 | #ifdef LAPACK |
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| 330 | call dgesv(nesp,1,mat,nesp,indx,cnew,nesp,code) |
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| 331 | #else |
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| 332 | write(*,*) "photochemistry error, missing LAPACK routine dgesv" |
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| 333 | stop |
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| 334 | #endif |
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| 335 | |
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| 336 | ! eliminate small values |
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| 337 | |
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| 338 | where (cnew(:)/conc(iz) < 1.e-30) |
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| 339 | cnew(:) = 0. |
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| 340 | end where |
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| 341 | |
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| 342 | ! update concentrations |
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| 343 | |
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| 344 | cold(:) = c(iz,:) |
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| 345 | c(iz,:) = cnew(:) |
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| 346 | cnew(:) = 0. |
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| 347 | |
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[2836] | 348 | ! force charge neutrality (mod fgg, july 2019) |
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| 349 | |
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| 350 | if (ok_ionchem) then |
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| 351 | if(c(iz,i_elec).ne.c(iz,i_co2plus)+c(iz,i_oplus)+c(iz,i_o2plus)+ & |
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| 352 | c(iz,i_noplus)+c(iz,i_coplus)+c(iz,i_cplus)+c(iz,i_n2plus)+ & |
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| 353 | c(iz,i_nplus)+c(iz,i_hplus)+c(iz,i_hco2plus)+ & |
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| 354 | c(iz,i_hcoplus)+c(iz,i_h2oplus)+c(iz,i_h3oplus)+ & |
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| 355 | c(iz,i_ohplus)) then |
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| 356 | c(iz,i_elec) = c(iz,i_co2plus)+c(iz,i_oplus)+c(iz,i_o2plus)+ & |
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| 357 | c(iz,i_noplus)+c(iz,i_coplus)+c(iz,i_cplus)+ & |
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| 358 | c(iz,i_n2plus)+c(iz,i_nplus)+c(iz,i_hplus)+ & |
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| 359 | c(iz,i_hco2plus)+c(iz,i_hcoplus)+c(iz,i_h2oplus)+ & |
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| 360 | c(iz,i_h3oplus)+c(iz,i_ohplus) |
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| 361 | ! write(*,*)'photochemistry/359' |
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| 362 | ! write(*,*)'Forcing charge neutrality at ilev,',ilev,' ig=',ig |
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| 363 | end if |
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| 364 | end if |
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| 365 | |
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[2187] | 366 | ! increment internal time |
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| 367 | |
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| 368 | time = time + dt_corrected |
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| 369 | dt_guess = dt_corrected ! first-guess timestep for next iteration |
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| 370 | |
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| 371 | end do ! while (time < ptimestep) |
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| 372 | |
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| 373 | ! save mixing ratios |
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| 374 | |
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| 375 | tr(iz,:) = max(c(iz,:)/conc(iz), 1.e-30) |
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[2795] | 376 | |
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| 377 | ! save production and loss terms (for diagnostic only) |
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[2580] | 378 | |
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| 379 | prod_tr(iz,:) = prod(:) |
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| 380 | loss_tr(iz,:) = lossconc(:) |
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[2187] | 381 | |
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| 382 | end do ! end of loop over vertical levels |
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[2795] | 383 | |
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| 384 | ! no and o2(delta) emissions |
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[2187] | 385 | |
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[2795] | 386 | em_no(:) = c(:,i_o)*c(:,i_n)*v_4(:,ind_norec) !2.8e-17*(300./temp(:)))**0.5 |
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| 387 | em_o2(:) = c(:,i_o2dg)/4470. ! 4470 s : lafferty et al., 1998 |
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| 388 | |
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[2187] | 389 | end subroutine photochemistry_venus |
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| 390 | |
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| 391 | !====================================================================== |
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| 392 | |
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| 393 | subroutine init_chimie(nj, nztable, nsza, nso2, jphot, table_colair, & |
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| 394 | table_colso2, table_sza) |
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| 395 | |
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| 396 | !====================================================================== |
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| 397 | |
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| 398 | implicit none |
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| 399 | |
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| 400 | ! photolysis lookup table |
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| 401 | |
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| 402 | integer, INTENT(IN) :: nj, nztable, nsza, nso2 |
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| 403 | real, INTENT(OUT), dimension(nso2,nsza,nztable,nj) :: jphot |
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| 404 | real, INTENT(OUT), dimension(nztable) :: table_colair |
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| 405 | real, INTENT(OUT), dimension(nso2,nztable) :: table_colso2 |
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| 406 | real, INTENT(OUT), dimension(nsza) :: table_sza |
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| 407 | |
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| 408 | integer :: iz, isza, iozo, iso2, ij |
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| 409 | character(len=44) :: jvenus |
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| 410 | |
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| 411 | ! lecture de la table des j |
---|
| 412 | |
---|
| 413 | jphot(:,:,:,:) = 0. |
---|
| 414 | |
---|
| 415 | jvenus = 'jvenus.dat' |
---|
| 416 | open(30, form = 'formatted', status = 'old', file = jvenus) |
---|
| 417 | print*,'lecture de jvenus = ', jvenus |
---|
| 418 | |
---|
| 419 | do iso2 = 1,nso2 |
---|
| 420 | do isza = 1,nsza |
---|
| 421 | do iz = nztable,1,-1 |
---|
| 422 | read(30,*) table_colair(iz), table_colso2(iso2,iz), table_sza(isza) |
---|
| 423 | read(30,'(7e11.4)') (jphot(iso2,isza,iz,ij), ij = 1,nj) |
---|
| 424 | do ij = 1,nj |
---|
| 425 | if (jphot(iso2,isza,iz,ij) == 1.E-30) then |
---|
| 426 | jphot(iso2,isza,iz,ij) = 0. |
---|
| 427 | end if |
---|
| 428 | end do |
---|
| 429 | end do |
---|
| 430 | end do |
---|
| 431 | end do |
---|
| 432 | |
---|
| 433 | close(30) |
---|
| 434 | print*,'lecture de la table des j ok.' |
---|
| 435 | |
---|
| 436 | end subroutine init_chimie |
---|
| 437 | |
---|
| 438 | !====================================================================== |
---|
| 439 | |
---|
[2836] | 440 | subroutine indice(ok_ionchem, nb_phot_max, nb_reaction_3_max, nb_reaction_4_max) |
---|
[2187] | 441 | |
---|
| 442 | !================================================================ |
---|
| 443 | ! set the "indice" arrays used to fill the jacobian matrix ! |
---|
| 444 | !---------------------------------------------------------------- |
---|
| 445 | ! reaction type array ! |
---|
| 446 | !---------------------------------------------------------------- |
---|
| 447 | ! A + hv --> B + C photolysis indice_phot ! |
---|
| 448 | ! A + B --> C + D bimolecular indice_4 ! |
---|
| 449 | ! A + A --> B + C quadratic indice_3 ! |
---|
| 450 | ! A + C --> B + C quenching indice_phot ! |
---|
| 451 | ! A + ice --> B + C heterogeneous indice_phot ! |
---|
| 452 | !================================================================ |
---|
| 453 | |
---|
| 454 | use types_asis |
---|
| 455 | use chemparam_mod |
---|
| 456 | |
---|
| 457 | implicit none |
---|
| 458 | |
---|
| 459 | ! input |
---|
| 460 | |
---|
[2836] | 461 | integer, intent(in) :: nb_reaction_3_max ! number of quadratic reactions |
---|
| 462 | integer, intent(in) :: nb_reaction_4_max ! number of bimolecular reactions |
---|
| 463 | integer, intent(in) :: nb_phot_max ! number of processes treated numerically as photodissociations |
---|
| 464 | logical, intent(in) :: ok_ionchem ! True: Ion reaction |
---|
[2187] | 465 | |
---|
| 466 | ! local |
---|
| 467 | |
---|
| 468 | integer :: nb_phot, nb_reaction_3, nb_reaction_4 |
---|
| 469 | integer :: i_dummy |
---|
| 470 | |
---|
| 471 | allocate (indice_phot(nb_phot_max)) |
---|
| 472 | allocate (indice_3(nb_reaction_3_max)) |
---|
| 473 | allocate (indice_4(nb_reaction_4_max)) |
---|
| 474 | |
---|
| 475 | i_dummy = 1 |
---|
| 476 | |
---|
| 477 | nb_phot = 0 |
---|
| 478 | nb_reaction_3 = 0 |
---|
| 479 | nb_reaction_4 = 0 |
---|
| 480 | |
---|
| 481 | !=========================================================== |
---|
| 482 | ! O2 + hv -> O + O |
---|
| 483 | !=========================================================== |
---|
| 484 | |
---|
| 485 | nb_phot = nb_phot + 1 |
---|
| 486 | |
---|
| 487 | indice_phot(nb_phot) = z3spec(1.0, i_o2, 2.0, i_o, 0.0, i_dummy) |
---|
| 488 | |
---|
| 489 | !=========================================================== |
---|
| 490 | ! O2 + hv -> O + O(1D) |
---|
| 491 | !=========================================================== |
---|
| 492 | |
---|
| 493 | nb_phot = nb_phot + 1 |
---|
| 494 | |
---|
| 495 | indice_phot(nb_phot) = z3spec(1.0, i_o2, 1.0, i_o, 1.0, i_o1d) |
---|
| 496 | |
---|
| 497 | !=========================================================== |
---|
| 498 | ! CO2 + hv -> CO + O |
---|
| 499 | !=========================================================== |
---|
| 500 | |
---|
| 501 | nb_phot = nb_phot + 1 |
---|
| 502 | |
---|
| 503 | indice_phot(nb_phot) = z3spec(1.0, i_co2, 1.0, i_co, 1.0, i_o) |
---|
| 504 | |
---|
| 505 | !=========================================================== |
---|
| 506 | ! CO2 + hv -> CO + O(1D) |
---|
| 507 | !=========================================================== |
---|
| 508 | |
---|
| 509 | nb_phot = nb_phot + 1 |
---|
| 510 | |
---|
| 511 | indice_phot(nb_phot) = z3spec(1.0, i_co2, 1.0, i_co, 1.0, i_o1d) |
---|
| 512 | |
---|
| 513 | !=========================================================== |
---|
| 514 | ! O3 + hv -> O2(Dg) + O(1D) |
---|
| 515 | !=========================================================== |
---|
| 516 | |
---|
| 517 | nb_phot = nb_phot + 1 |
---|
| 518 | |
---|
| 519 | indice_phot(nb_phot) = z3spec(1.0, i_o3, 1.0, i_o2dg, 1.0, i_o1d) |
---|
| 520 | |
---|
| 521 | !=========================================================== |
---|
| 522 | ! O3 + hv -> O2 + O |
---|
| 523 | !=========================================================== |
---|
| 524 | |
---|
| 525 | nb_phot = nb_phot + 1 |
---|
| 526 | |
---|
| 527 | indice_phot(nb_phot) = z3spec(1.0, i_o3, 1.0, i_o2, 1.0, i_o) |
---|
| 528 | |
---|
| 529 | !=========================================================== |
---|
[2851] | 530 | ! H2 + hv -> H + H |
---|
| 531 | !=========================================================== |
---|
| 532 | |
---|
| 533 | nb_phot = nb_phot + 1 |
---|
| 534 | |
---|
| 535 | indice_phot(nb_phot) = z3spec(1.0, i_h2, 2.0, i_h, 0.0, i_dummy) |
---|
| 536 | |
---|
| 537 | |
---|
| 538 | !=========================================================== |
---|
[2187] | 539 | ! H2O + hv -> H + OH |
---|
| 540 | !=========================================================== |
---|
| 541 | |
---|
| 542 | nb_phot = nb_phot + 1 |
---|
| 543 | |
---|
| 544 | indice_phot(nb_phot) = z3spec(1.0, i_h2o, 1.0, i_h, 1.0, i_oh) |
---|
| 545 | |
---|
| 546 | !=========================================================== |
---|
| 547 | ! HO2 + hv -> OH + O |
---|
| 548 | !=========================================================== |
---|
| 549 | |
---|
| 550 | nb_phot = nb_phot + 1 |
---|
| 551 | |
---|
| 552 | indice_phot(nb_phot) = z3spec(1.0, i_ho2, 1.0, i_oh, 1.0, i_o) |
---|
| 553 | |
---|
| 554 | !=========================================================== |
---|
| 555 | ! H2O2 + hv -> OH + OH |
---|
| 556 | !=========================================================== |
---|
| 557 | |
---|
| 558 | nb_phot = nb_phot + 1 |
---|
| 559 | |
---|
| 560 | indice_phot(nb_phot) = z3spec(1.0, i_h2o2, 2.0, i_oh, 0.0, i_dummy) |
---|
| 561 | |
---|
| 562 | !=========================================================== |
---|
| 563 | ! HCl + hv -> H + Cl |
---|
| 564 | !=========================================================== |
---|
| 565 | |
---|
| 566 | nb_phot = nb_phot + 1 |
---|
| 567 | |
---|
| 568 | indice_phot(nb_phot) = z3spec(1.0, i_hcl, 1.0, i_h, 1.0, i_cl) |
---|
| 569 | |
---|
| 570 | !=========================================================== |
---|
| 571 | ! Cl2 + hv -> Cl + Cl |
---|
| 572 | !=========================================================== |
---|
| 573 | |
---|
| 574 | nb_phot = nb_phot + 1 |
---|
| 575 | |
---|
| 576 | indice_phot(nb_phot) = z3spec(1.0, i_cl2, 2.0, i_cl, 0.0, i_dummy) |
---|
| 577 | |
---|
| 578 | !=========================================================== |
---|
| 579 | ! HOCl + hv -> OH + Cl |
---|
| 580 | !=========================================================== |
---|
| 581 | |
---|
| 582 | nb_phot = nb_phot + 1 |
---|
| 583 | |
---|
| 584 | indice_phot(nb_phot) = z3spec(1.0, i_hocl, 1.0, i_oh, 1.0, i_cl) |
---|
| 585 | |
---|
| 586 | !=========================================================== |
---|
| 587 | ! SO2 + hv -> SO + O |
---|
| 588 | !=========================================================== |
---|
| 589 | |
---|
| 590 | nb_phot = nb_phot + 1 |
---|
| 591 | |
---|
| 592 | indice_phot(nb_phot) = z3spec(1.0, i_so2, 1.0, i_so, 1.0, i_o) |
---|
| 593 | |
---|
| 594 | !=========================================================== |
---|
| 595 | ! SO + hv -> S + O |
---|
| 596 | !=========================================================== |
---|
| 597 | |
---|
| 598 | nb_phot = nb_phot + 1 |
---|
| 599 | |
---|
| 600 | indice_phot(nb_phot) = z3spec(1.0, i_so, 1.0, i_s, 1.0, i_o) |
---|
| 601 | |
---|
| 602 | !=========================================================== |
---|
| 603 | ! SO3 + hv -> SO2 + O |
---|
| 604 | !=========================================================== |
---|
| 605 | |
---|
| 606 | nb_phot = nb_phot + 1 |
---|
| 607 | |
---|
| 608 | indice_phot(nb_phot) = z3spec(1.0, i_so3, 1.0, i_so2, 1.0, i_o) |
---|
| 609 | |
---|
| 610 | !=========================================================== |
---|
[2925] | 611 | ! S2 + hv -> S + S |
---|
| 612 | !=========================================================== |
---|
| 613 | |
---|
| 614 | nb_phot = nb_phot + 1 |
---|
| 615 | |
---|
| 616 | indice_phot(nb_phot) = z3spec(1.0, i_s2, 2.0, i_s, 0.0, i_dummy) |
---|
| 617 | |
---|
| 618 | !=========================================================== |
---|
[2187] | 619 | ! ClO + hv -> Cl + O |
---|
| 620 | !=========================================================== |
---|
| 621 | |
---|
| 622 | nb_phot = nb_phot + 1 |
---|
| 623 | |
---|
| 624 | indice_phot(nb_phot) = z3spec(1.0, i_clo, 1.0, i_cl, 1.0, i_o) |
---|
| 625 | |
---|
| 626 | !=========================================================== |
---|
| 627 | ! OCS + hv -> CO + S |
---|
| 628 | !=========================================================== |
---|
| 629 | |
---|
| 630 | nb_phot = nb_phot + 1 |
---|
| 631 | |
---|
| 632 | indice_phot(nb_phot) = z3spec(1.0, i_ocs, 1.0, i_co, 1.0, i_s) |
---|
| 633 | |
---|
| 634 | !=========================================================== |
---|
| 635 | ! COCl2 + hv -> Cl + Cl + CO |
---|
| 636 | !=========================================================== |
---|
| 637 | |
---|
| 638 | nb_phot = nb_phot + 1 |
---|
| 639 | |
---|
| 640 | indice_phot(nb_phot) = z3spec(1.0, i_cocl2, 2.0, i_cl, 1.0, i_co) |
---|
| 641 | |
---|
| 642 | !=========================================================== |
---|
| 643 | ! H2SO4 + hv -> SO3 + H2O |
---|
| 644 | !=========================================================== |
---|
| 645 | |
---|
| 646 | nb_phot = nb_phot + 1 |
---|
| 647 | |
---|
| 648 | indice_phot(nb_phot) = z3spec(1.0, i_h2so4, 1.0, i_so3, 1.0, i_h2o) |
---|
| 649 | |
---|
| 650 | !=========================================================== |
---|
[2795] | 651 | ! NO2 + hv -> NO + O |
---|
| 652 | !=========================================================== |
---|
| 653 | |
---|
| 654 | nb_phot = nb_phot + 1 |
---|
| 655 | |
---|
| 656 | indice_phot(nb_phot) = z3spec(1.0, i_no2, 1.0, i_no, 1.0, i_o) |
---|
| 657 | |
---|
| 658 | !=========================================================== |
---|
| 659 | ! NO + hv -> N + O |
---|
| 660 | !=========================================================== |
---|
| 661 | |
---|
| 662 | nb_phot = nb_phot + 1 |
---|
| 663 | |
---|
| 664 | indice_phot(nb_phot) = z3spec(1.0, i_no, 1.0, i_n, 1.0, i_o) |
---|
| 665 | |
---|
| 666 | !=========================================================== |
---|
| 667 | ! N2 + hv -> N(2D) + N |
---|
| 668 | !=========================================================== |
---|
| 669 | |
---|
| 670 | nb_phot = nb_phot + 1 |
---|
| 671 | |
---|
| 672 | indice_phot(nb_phot) = z3spec(1.0, i_n2, 1.0, i_n, 1.0, i_n2d) |
---|
| 673 | |
---|
[2836] | 674 | !Only if ion chemistry included |
---|
| 675 | if (ok_ionchem) then |
---|
| 676 | |
---|
[2795] | 677 | !=========================================================== |
---|
[2836] | 678 | ! CO2 + hv -> CO2+ + e- |
---|
[2187] | 679 | !=========================================================== |
---|
| 680 | |
---|
[2836] | 681 | nb_phot = nb_phot + 1 |
---|
| 682 | |
---|
| 683 | indice_phot(nb_phot) = z3spec(1.0, i_co2, 1.0, i_co2plus, 1.0, i_elec) |
---|
| 684 | |
---|
| 685 | !=========================================================== |
---|
| 686 | ! CO2 + hv -> O+ + CO + e- |
---|
| 687 | !=========================================================== |
---|
| 688 | !We divide this reaction in two |
---|
| 689 | |
---|
| 690 | !0.5 CO2 + hv -> CO |
---|
| 691 | nb_phot = nb_phot + 1 |
---|
| 692 | |
---|
| 693 | indice_phot(nb_phot) = z3spec(0.5, i_co2, 1.0, i_co, 0.0, i_dummy) |
---|
| 694 | |
---|
| 695 | !0.5 CO2 + hv -> O+ + e- |
---|
| 696 | nb_phot = nb_phot + 1 |
---|
| 697 | |
---|
| 698 | indice_phot(nb_phot) = z3spec(0.5, i_co2, 1.0, i_oplus, 1.0, i_elec) |
---|
| 699 | |
---|
| 700 | !=========================================================== |
---|
| 701 | ! CO2 + hv -> CO+ + O + e- |
---|
| 702 | !=========================================================== |
---|
| 703 | !We divide this reaction in two |
---|
| 704 | |
---|
| 705 | !0.5 CO2 + hv -> O |
---|
| 706 | nb_phot = nb_phot + 1 |
---|
| 707 | |
---|
| 708 | indice_phot(nb_phot) = z3spec(0.5, i_co2, 1.0, i_o, 0.0, i_dummy) |
---|
| 709 | |
---|
| 710 | !0.5 CO2 + hv -> CO+ + e- |
---|
| 711 | nb_phot = nb_phot + 1 |
---|
| 712 | |
---|
| 713 | indice_phot(nb_phot) = z3spec(0.5, i_co2, 1.0, i_coplus, 1.0, i_elec) |
---|
| 714 | |
---|
| 715 | !=========================================================== |
---|
| 716 | ! CO2 + hv -> C+ + O2 + e- |
---|
| 717 | !=========================================================== |
---|
| 718 | !We divide this reaction in two |
---|
| 719 | |
---|
| 720 | !0.5 CO2 + hv -> O2 |
---|
| 721 | nb_phot = nb_phot + 1 |
---|
| 722 | |
---|
| 723 | indice_phot(nb_phot) = z3spec(0.5, i_co2, 1.0, i_o2, 0.0, i_dummy) |
---|
| 724 | |
---|
| 725 | !0.5 CO2 + hv -> C+ + e- |
---|
| 726 | nb_phot = nb_phot + 1 |
---|
| 727 | |
---|
| 728 | indice_phot(nb_phot) = z3spec(0.5, i_co2, 1.0, i_cplus, 1.0, i_elec) |
---|
| 729 | |
---|
| 730 | !=========================================================== |
---|
| 731 | ! O2 + hv -> O2+ + e- |
---|
| 732 | !=========================================================== |
---|
| 733 | |
---|
| 734 | nb_phot = nb_phot + 1 |
---|
| 735 | |
---|
| 736 | indice_phot(nb_phot) = z3spec(1.0, i_o2, 1.0, i_o2plus, 1.0, i_elec) |
---|
| 737 | |
---|
| 738 | !=========================================================== |
---|
| 739 | ! O + hv -> O+ + e- |
---|
| 740 | !=========================================================== |
---|
| 741 | |
---|
| 742 | nb_phot = nb_phot + 1 |
---|
| 743 | |
---|
| 744 | indice_phot(nb_phot) = z3spec(1.0, i_o, 1.0, i_oplus, 1.0, i_elec) |
---|
| 745 | |
---|
| 746 | !=========================================================== |
---|
| 747 | ! NO + hv -> NO+ + e- |
---|
| 748 | !=========================================================== |
---|
| 749 | |
---|
| 750 | nb_phot = nb_phot + 1 |
---|
| 751 | |
---|
| 752 | indice_phot(nb_phot) = z3spec(1.0, i_no, 1.0, i_noplus, 1.0, i_elec) |
---|
| 753 | |
---|
| 754 | !=========================================================== |
---|
| 755 | ! CO + hv -> CO+ + e- |
---|
| 756 | !=========================================================== |
---|
| 757 | |
---|
| 758 | nb_phot = nb_phot + 1 |
---|
| 759 | |
---|
| 760 | indice_phot(nb_phot) = z3spec(1.0, i_co, 1.0, i_coplus, 1.0, i_elec) |
---|
| 761 | |
---|
| 762 | !=========================================================== |
---|
| 763 | ! CO + hv -> C+ + O + e- |
---|
| 764 | !=========================================================== |
---|
| 765 | !We divide this reaction in two |
---|
| 766 | |
---|
| 767 | !0.5 CO + hv -> O |
---|
| 768 | nb_phot = nb_phot + 1 |
---|
| 769 | |
---|
| 770 | indice_phot(nb_phot) = z3spec(0.5, i_co, 1.0, i_o, 0.0, i_dummy) |
---|
| 771 | |
---|
| 772 | !0.5 CO + hv -> C+ + e- |
---|
| 773 | nb_phot = nb_phot + 1 |
---|
| 774 | |
---|
| 775 | indice_phot(nb_phot) = z3spec(0.5, i_co, 1.0, i_cplus, 1.0, i_elec) |
---|
| 776 | |
---|
| 777 | !=========================================================== |
---|
| 778 | ! N2 + hv -> N2+ + e- |
---|
| 779 | !=========================================================== |
---|
| 780 | |
---|
| 781 | nb_phot = nb_phot + 1 |
---|
| 782 | |
---|
| 783 | indice_phot(nb_phot) = z3spec(1.0, i_n2, 1.0, i_n2plus, 1.0, i_elec) |
---|
| 784 | |
---|
| 785 | !=========================================================== |
---|
| 786 | ! N2 + hv -> N+ + N + e- |
---|
| 787 | !=========================================================== |
---|
| 788 | !We divide this reaction in two |
---|
| 789 | |
---|
| 790 | !0.5 N2 + hv -> N |
---|
| 791 | nb_phot = nb_phot + 1 |
---|
| 792 | |
---|
| 793 | indice_phot(nb_phot) = z3spec(0.5, i_n2, 1.0, i_n, 0.0, i_dummy) |
---|
| 794 | |
---|
| 795 | !0.5 N2 + hv -> N+ + e- |
---|
| 796 | nb_phot = nb_phot + 1 |
---|
| 797 | |
---|
| 798 | indice_phot(nb_phot) = z3spec(0.5, i_n2, 1.0, i_nplus, 1.0, i_elec) |
---|
| 799 | |
---|
| 800 | !=========================================================== |
---|
| 801 | ! N + hv -> N+ + e- |
---|
| 802 | !=========================================================== |
---|
| 803 | |
---|
| 804 | nb_phot = nb_phot + 1 |
---|
| 805 | |
---|
| 806 | indice_phot(nb_phot) = z3spec(1.0, i_n, 1.0, i_nplus, 1.0, i_elec) |
---|
| 807 | |
---|
| 808 | !=========================================================== |
---|
| 809 | ! H + hv -> H+ + e- |
---|
| 810 | !=========================================================== |
---|
| 811 | |
---|
| 812 | nb_phot = nb_phot + 1 |
---|
| 813 | |
---|
| 814 | indice_phot(nb_phot) = z3spec(1.0, i_h, 1.0, i_hplus, 1.0, i_elec) |
---|
| 815 | |
---|
| 816 | end if !ok_ionchem |
---|
| 817 | |
---|
| 818 | !=========================================================== |
---|
| 819 | ! a001 : O + O2 + (CO2 or M) -> O3 + (CO2 or M) |
---|
| 820 | !=========================================================== |
---|
| 821 | |
---|
[2187] | 822 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 823 | |
---|
| 824 | indice_4(nb_reaction_4) = z4spec(1.0, i_o, 1.0, i_o2, 1.0, i_o3, 0.0, i_dummy) |
---|
| 825 | |
---|
| 826 | !=========================================================== |
---|
[2836] | 827 | ! a002 : O + O + (CO2 or M) -> O2(Dg) + (CO2 or M) |
---|
[2187] | 828 | !=========================================================== |
---|
| 829 | |
---|
| 830 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 831 | |
---|
| 832 | indice_3(nb_reaction_3) = z3spec(2.0, i_o, 1.0, i_o2dg, 0.0, i_dummy) |
---|
| 833 | |
---|
| 834 | !=========================================================== |
---|
| 835 | ! a003 : O + O3 -> O2 + O2 |
---|
| 836 | !=========================================================== |
---|
| 837 | |
---|
| 838 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 839 | |
---|
| 840 | indice_4(nb_reaction_4) = z4spec(1.0, i_o, 1.0, i_o3, 2.0, i_o2, 0.0, i_dummy) |
---|
| 841 | |
---|
| 842 | !=========================================================== |
---|
| 843 | ! b001 : O(1D) + CO2 -> O + CO2 |
---|
| 844 | !=========================================================== |
---|
| 845 | |
---|
| 846 | nb_phot = nb_phot + 1 |
---|
| 847 | |
---|
| 848 | indice_phot(nb_phot) = z3spec(1.0, i_o1d, 1.0, i_o, 0.0, i_dummy) |
---|
| 849 | |
---|
| 850 | !=========================================================== |
---|
| 851 | ! b002 : O(1D) + H2O -> OH + OH |
---|
| 852 | !=========================================================== |
---|
| 853 | |
---|
| 854 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 855 | |
---|
| 856 | indice_4(nb_reaction_4) = z4spec(1.0, i_o1d, 1.0, i_h2o, 2.0, i_oh, 0.0, i_dummy) |
---|
| 857 | |
---|
| 858 | !=========================================================== |
---|
| 859 | ! b003 : O(1D) + H2 -> OH + H |
---|
| 860 | !=========================================================== |
---|
| 861 | |
---|
| 862 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 863 | |
---|
| 864 | indice_4(nb_reaction_4) = z4spec(1.0, i_o1d, 1.0, i_h2, 1.0, i_oh, 1.0, i_h) |
---|
| 865 | |
---|
| 866 | !=========================================================== |
---|
| 867 | ! b004 : O(1D) + O2 -> O + O2 |
---|
| 868 | !=========================================================== |
---|
| 869 | |
---|
| 870 | nb_phot = nb_phot + 1 |
---|
| 871 | |
---|
| 872 | indice_phot(nb_phot) = z3spec(1.0, i_o1d, 1.0, i_o, 0.0, i_dummy) |
---|
| 873 | |
---|
| 874 | !=========================================================== |
---|
| 875 | ! b005 : O(1D) + O3 -> O2 + O2 |
---|
| 876 | !=========================================================== |
---|
| 877 | |
---|
| 878 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 879 | |
---|
| 880 | indice_4(nb_reaction_4) = z4spec(1.0, i_o1d, 1.0, i_o3, 2.0, i_o2, 0.0, i_dummy) |
---|
| 881 | |
---|
| 882 | !=========================================================== |
---|
| 883 | ! b006 : O(1D) + O3 -> O2 + O + O |
---|
| 884 | !=========================================================== |
---|
| 885 | |
---|
| 886 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 887 | |
---|
| 888 | indice_4(nb_reaction_4) = z4spec(1.0, i_o1d, 1.0, i_o3, 1.0, i_o2, 2.0, i_o) |
---|
| 889 | |
---|
| 890 | !=========================================================== |
---|
| 891 | ! c001 : O + HO2 -> OH + O2 |
---|
| 892 | !=========================================================== |
---|
| 893 | |
---|
| 894 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 895 | |
---|
| 896 | indice_4(nb_reaction_4) = z4spec(1.0, i_o, 1.0, i_ho2, 1.0, i_oh, 1.0, i_o2) |
---|
| 897 | |
---|
| 898 | !=========================================================== |
---|
| 899 | ! c002 : O + OH -> O2 + H |
---|
| 900 | !=========================================================== |
---|
| 901 | |
---|
| 902 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 903 | |
---|
| 904 | indice_4(nb_reaction_4) = z4spec(1.0, i_o, 1.0, i_oh, 1.0, i_o2, 1.0, i_h) |
---|
| 905 | |
---|
| 906 | !=========================================================== |
---|
| 907 | ! c003 : H + O3 -> OH + O2 |
---|
| 908 | !=========================================================== |
---|
| 909 | |
---|
| 910 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 911 | |
---|
| 912 | indice_4(nb_reaction_4) = z4spec(1.0, i_h, 1.0, i_o3, 1.0, i_oh, 1.0, i_o2) |
---|
| 913 | |
---|
| 914 | !=========================================================== |
---|
| 915 | ! c004 : H + HO2 -> OH + OH |
---|
| 916 | !=========================================================== |
---|
| 917 | |
---|
| 918 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 919 | |
---|
| 920 | indice_4(nb_reaction_4) = z4spec(1.0, i_h, 1.0, i_ho2, 2.0, i_oh, 0.0, i_dummy) |
---|
| 921 | |
---|
| 922 | !=========================================================== |
---|
| 923 | ! c005 : H + HO2 -> H2 + O2 |
---|
| 924 | !=========================================================== |
---|
| 925 | |
---|
| 926 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 927 | |
---|
| 928 | indice_4(nb_reaction_4) = z4spec(1.0, i_h, 1.0, i_ho2, 1.0, i_h2, 1.0, i_o2) |
---|
| 929 | |
---|
| 930 | !=========================================================== |
---|
| 931 | ! c006 : H + HO2 -> H2O + O |
---|
| 932 | !=========================================================== |
---|
| 933 | |
---|
| 934 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 935 | |
---|
| 936 | indice_4(nb_reaction_4) = z4spec(1.0, i_h, 1.0, i_ho2, 1.0, i_h2o, 1.0, i_o) |
---|
| 937 | |
---|
| 938 | !=========================================================== |
---|
| 939 | ! c007 : OH + HO2 -> H2O + O2 |
---|
| 940 | !=========================================================== |
---|
| 941 | |
---|
| 942 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 943 | |
---|
| 944 | indice_4(nb_reaction_4) = z4spec(1.0, i_oh, 1.0, i_ho2, 1.0, i_h2o, 1.0, i_o2) |
---|
| 945 | |
---|
| 946 | !=========================================================== |
---|
| 947 | ! c008 : HO2 + HO2 -> H2O2 + O2 |
---|
| 948 | !=========================================================== |
---|
| 949 | |
---|
| 950 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 951 | |
---|
| 952 | indice_3(nb_reaction_3) = z3spec(2.0, i_ho2, 1.0, i_h2o2, 1.0, i_o2) |
---|
| 953 | |
---|
| 954 | !=========================================================== |
---|
| 955 | ! c009 : OH + H2O2 -> H2O + HO2 |
---|
| 956 | !=========================================================== |
---|
| 957 | |
---|
| 958 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 959 | |
---|
| 960 | indice_4(nb_reaction_4) = z4spec(1.0, i_oh, 1.0, i_h2o2, 1.0, i_h2o, 1.0, i_ho2) |
---|
| 961 | |
---|
| 962 | !=========================================================== |
---|
| 963 | ! c010 : OH + H2 -> H2O + H |
---|
| 964 | !=========================================================== |
---|
| 965 | |
---|
| 966 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 967 | |
---|
| 968 | indice_4(nb_reaction_4) = z4spec(1.0, i_oh, 1.0, i_h2, 1.0, i_h2o, 1.0, i_h) |
---|
| 969 | |
---|
| 970 | !=========================================================== |
---|
| 971 | ! c011 : H + O2 + CO2 -> HO2 + CO2 |
---|
| 972 | !=========================================================== |
---|
| 973 | |
---|
| 974 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 975 | |
---|
| 976 | indice_4(nb_reaction_4) = z4spec(1.0, i_h, 1.0, i_o2, 1.0, i_ho2, 0.0, i_dummy) |
---|
| 977 | |
---|
| 978 | !=========================================================== |
---|
| 979 | ! c012 : O + H2O2 -> OH + HO2 |
---|
| 980 | !=========================================================== |
---|
| 981 | |
---|
| 982 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 983 | |
---|
| 984 | indice_4(nb_reaction_4) = z4spec(1.0, i_o, 1.0, i_h2o2, 1.0, i_oh, 1.0, i_ho2) |
---|
| 985 | |
---|
| 986 | !=========================================================== |
---|
| 987 | ! c013 : OH + OH -> H2O + O |
---|
| 988 | !=========================================================== |
---|
| 989 | |
---|
| 990 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 991 | |
---|
| 992 | indice_3(nb_reaction_3) = z3spec(2.0, i_oh, 1.0, i_h2o, 1.0, i_o) |
---|
| 993 | |
---|
| 994 | !=========================================================== |
---|
| 995 | ! c014 : OH + O3 -> HO2 + O2 |
---|
| 996 | !=========================================================== |
---|
| 997 | |
---|
| 998 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 999 | |
---|
| 1000 | indice_4(nb_reaction_4) = z4spec(1.0, i_oh, 1.0, i_o3, 1.0, i_ho2, 1.0, i_o2) |
---|
| 1001 | |
---|
| 1002 | !=========================================================== |
---|
| 1003 | ! c015 : HO2 + O3 -> OH + O2 + O2 |
---|
| 1004 | !=========================================================== |
---|
| 1005 | |
---|
| 1006 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1007 | |
---|
| 1008 | indice_4(nb_reaction_4) = z4spec(1.0, i_ho2, 1.0, i_o3, 1.0, i_oh, 2.0, i_o2) |
---|
| 1009 | |
---|
| 1010 | !=========================================================== |
---|
| 1011 | ! c016 : HO2 + HO2 + CO2 -> H2O2 + O2 + CO2 |
---|
| 1012 | !=========================================================== |
---|
| 1013 | |
---|
| 1014 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 1015 | indice_3(nb_reaction_3) = z3spec(2.0, i_ho2, 1.0, i_h2o2, 1.0, i_o2) |
---|
| 1016 | |
---|
| 1017 | !=========================================================== |
---|
| 1018 | ! c017 : OH + OH + CO2 -> H2O2 + CO2 |
---|
| 1019 | !=========================================================== |
---|
| 1020 | |
---|
| 1021 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 1022 | |
---|
| 1023 | indice_3(nb_reaction_3) = z3spec(2.0, i_oh, 1.0, i_h2o2, 0.0, i_dummy) |
---|
| 1024 | |
---|
| 1025 | !=========================================================== |
---|
| 1026 | ! c018 : H + H + CO2 -> H2 + CO2 |
---|
| 1027 | !=========================================================== |
---|
| 1028 | |
---|
| 1029 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 1030 | |
---|
| 1031 | indice_3(nb_reaction_3) = z3spec(2.0, i_h, 1.0, i_h2, 0.0, i_dummy) |
---|
| 1032 | |
---|
| 1033 | !=========================================================== |
---|
[2795] | 1034 | ! d001 : NO2 + O -> NO + O2 |
---|
| 1035 | !=========================================================== |
---|
| 1036 | |
---|
| 1037 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1038 | |
---|
| 1039 | indice_4(nb_reaction_4) = z4spec(1.0, i_no2, 1.0, i_o, 1.0, i_no, 1.0, i_o2) |
---|
| 1040 | |
---|
| 1041 | !=========================================================== |
---|
| 1042 | ! d002 : NO + O3 -> NO2 + O2 |
---|
| 1043 | !=========================================================== |
---|
| 1044 | |
---|
| 1045 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1046 | |
---|
| 1047 | indice_4(nb_reaction_4) = z4spec(1.0, i_no, 1.0, i_o3, 1.0, i_no2, 1.0, i_o2) |
---|
| 1048 | |
---|
| 1049 | !=========================================================== |
---|
| 1050 | ! d003 : NO + HO2 -> NO2 + OH |
---|
| 1051 | !=========================================================== |
---|
| 1052 | |
---|
| 1053 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1054 | |
---|
| 1055 | indice_4(nb_reaction_4) = z4spec(1.0, i_no, 1.0, i_ho2, 1.0, i_no2, 1.0, i_oh) |
---|
| 1056 | |
---|
| 1057 | !=========================================================== |
---|
| 1058 | ! d004 : N + NO -> N2 + O |
---|
| 1059 | !=========================================================== |
---|
| 1060 | |
---|
| 1061 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1062 | |
---|
| 1063 | indice_4(nb_reaction_4) = z4spec(1.0, i_n, 1.0, i_no, 1.0, i_n2, 1.0, i_o) |
---|
| 1064 | |
---|
| 1065 | !=========================================================== |
---|
| 1066 | ! d005 : N + O2 -> NO + O |
---|
| 1067 | !=========================================================== |
---|
| 1068 | |
---|
| 1069 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1070 | |
---|
| 1071 | indice_4(nb_reaction_4) = z4spec(1.0, i_n, 1.0, i_o2, 1.0, i_no, 1.0, i_o) |
---|
| 1072 | |
---|
| 1073 | !=========================================================== |
---|
| 1074 | ! d006 : NO2 + H -> NO + OH |
---|
| 1075 | !=========================================================== |
---|
| 1076 | |
---|
| 1077 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1078 | |
---|
| 1079 | indice_4(nb_reaction_4) = z4spec(1.0, i_no2, 1.0, i_h, 1.0, i_no, 1.0, i_oh) |
---|
| 1080 | |
---|
| 1081 | !=========================================================== |
---|
| 1082 | ! d007 : N + O -> NO |
---|
| 1083 | !=========================================================== |
---|
| 1084 | |
---|
| 1085 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1086 | |
---|
| 1087 | indice_4(nb_reaction_4) = z4spec(1.0, i_n, 1.0, i_o, 1.0, i_no, 0.0, i_dummy) |
---|
| 1088 | |
---|
| 1089 | !=========================================================== |
---|
| 1090 | ! d008 : N + HO2 -> NO + OH |
---|
| 1091 | !=========================================================== |
---|
| 1092 | |
---|
| 1093 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1094 | |
---|
| 1095 | indice_4(nb_reaction_4) = z4spec(1.0, i_n, 1.0, i_ho2, 1.0, i_no, 1.0, i_oh) |
---|
| 1096 | |
---|
| 1097 | !=========================================================== |
---|
| 1098 | ! d009 : N + OH -> NO + H |
---|
| 1099 | !=========================================================== |
---|
| 1100 | |
---|
| 1101 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1102 | |
---|
| 1103 | indice_4(nb_reaction_4) = z4spec(1.0, i_n, 1.0, i_oh, 1.0, i_no, 1.0, i_h) |
---|
| 1104 | |
---|
| 1105 | !=========================================================== |
---|
| 1106 | ! d010 : N(2D) + O -> N + O |
---|
| 1107 | !=========================================================== |
---|
| 1108 | |
---|
| 1109 | nb_phot = nb_phot + 1 |
---|
| 1110 | |
---|
| 1111 | indice_phot(nb_phot) = z3spec(1.0, i_n2d, 1.0, i_n, 0.0, i_dummy) |
---|
| 1112 | |
---|
| 1113 | !=========================================================== |
---|
| 1114 | ! d011 : N(2D) + N2 -> N + N2 |
---|
| 1115 | !=========================================================== |
---|
| 1116 | |
---|
| 1117 | nb_phot = nb_phot + 1 |
---|
| 1118 | |
---|
| 1119 | indice_phot(nb_phot) = z3spec(1.0, i_n2d, 1.0, i_n, 0.0, i_dummy) |
---|
| 1120 | |
---|
| 1121 | !=========================================================== |
---|
| 1122 | ! d012 : N(2D) + CO2 -> NO + CO |
---|
| 1123 | !=========================================================== |
---|
| 1124 | |
---|
| 1125 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1126 | |
---|
| 1127 | indice_4(nb_reaction_4) = z4spec(1.0, i_n2d, 1.0, i_co2, 1.0, i_no, 1.0, i_co) |
---|
| 1128 | |
---|
| 1129 | !=========================================================== |
---|
| 1130 | ! d013 : N + O + CO2 -> NO + CO2 |
---|
| 1131 | !=========================================================== |
---|
| 1132 | |
---|
| 1133 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1134 | |
---|
| 1135 | indice_4(nb_reaction_4) = z4spec(1.0, i_n, 1.0, i_o, 1.0, i_no, 0.0, i_dummy) |
---|
| 1136 | |
---|
| 1137 | !=========================================================== |
---|
[2925] | 1138 | ! d014 : N(2D) + CO -> N + CO |
---|
| 1139 | !=========================================================== |
---|
| 1140 | |
---|
| 1141 | nb_phot = nb_phot + 1 |
---|
| 1142 | |
---|
| 1143 | indice_phot(nb_phot) = z3spec(1.0, i_n2d, 1.0, i_n, 0.0, i_dummy) |
---|
| 1144 | |
---|
| 1145 | !=========================================================== |
---|
[2187] | 1146 | ! e001 : CO + OH -> CO2 + H |
---|
| 1147 | !=========================================================== |
---|
| 1148 | |
---|
| 1149 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1150 | |
---|
| 1151 | indice_4(nb_reaction_4) = z4spec(1.0, i_co, 1.0, i_oh, 1.0, i_co2, 1.0, i_h) |
---|
| 1152 | |
---|
| 1153 | !=========================================================== |
---|
| 1154 | ! e002 : CO + O + M -> CO2 + M |
---|
| 1155 | !=========================================================== |
---|
| 1156 | |
---|
| 1157 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1158 | |
---|
| 1159 | indice_4(nb_reaction_4) = z4spec(1.0, i_co, 1.0, i_o, 1.0, i_co2, 0.0, i_dummy) |
---|
| 1160 | |
---|
| 1161 | !=========================================================== |
---|
| 1162 | ! f001 : HCl + O(1D) -> OH + Cl |
---|
| 1163 | !=========================================================== |
---|
| 1164 | |
---|
| 1165 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1166 | |
---|
| 1167 | indice_4(nb_reaction_4) = z4spec(1.0, i_hcl, 1.0, i_o1d, 1.0, i_oh, 1.0, i_cl) |
---|
| 1168 | |
---|
| 1169 | !=========================================================== |
---|
| 1170 | ! f002 : HCl + O(1D) -> H + ClO |
---|
| 1171 | !=========================================================== |
---|
| 1172 | |
---|
| 1173 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1174 | |
---|
| 1175 | indice_4(nb_reaction_4) = z4spec(1.0, i_hcl, 1.0, i_o1d, 1.0, i_h, 1.0, i_clo) |
---|
| 1176 | |
---|
| 1177 | !=========================================================== |
---|
| 1178 | ! f003 : HCl + O -> OH + Cl |
---|
| 1179 | !=========================================================== |
---|
| 1180 | |
---|
| 1181 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1182 | |
---|
| 1183 | indice_4(nb_reaction_4) = z4spec(1.0, i_hcl, 1.0, i_o, 1.0, i_oh, 1.0, i_cl) |
---|
| 1184 | |
---|
| 1185 | !=========================================================== |
---|
| 1186 | ! f004 : HCl + OH -> H2O + Cl |
---|
| 1187 | !=========================================================== |
---|
| 1188 | |
---|
| 1189 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1190 | |
---|
| 1191 | indice_4(nb_reaction_4) = z4spec(1.0, i_hcl, 1.0, i_oh, 1.0, i_h2o, 1.0, i_cl) |
---|
| 1192 | |
---|
| 1193 | !=========================================================== |
---|
| 1194 | ! f005 : ClO + O -> Cl + O2 |
---|
| 1195 | !=========================================================== |
---|
| 1196 | |
---|
| 1197 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1198 | |
---|
| 1199 | indice_4(nb_reaction_4) = z4spec(1.0, i_clo, 1.0, i_o, 1.0, i_cl, 1.0, i_o2) |
---|
| 1200 | |
---|
| 1201 | !=========================================================== |
---|
| 1202 | ! f006 : ClO + OH -> Cl + HO2 |
---|
| 1203 | !=========================================================== |
---|
| 1204 | |
---|
| 1205 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1206 | |
---|
| 1207 | indice_4(nb_reaction_4) = z4spec(1.0, i_clo, 1.0, i_oh, 1.0, i_cl, 1.0, i_ho2) |
---|
| 1208 | |
---|
| 1209 | !=========================================================== |
---|
| 1210 | ! f007 : ClO + OH -> HCl + O2 |
---|
| 1211 | !=========================================================== |
---|
| 1212 | |
---|
| 1213 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1214 | |
---|
| 1215 | indice_4(nb_reaction_4) = z4spec(1.0, i_clo, 1.0, i_oh, 1.0, i_hcl, 1.0, i_o2) |
---|
| 1216 | |
---|
| 1217 | !=========================================================== |
---|
| 1218 | ! f008 : Cl + H2 -> HCl + H |
---|
| 1219 | !=========================================================== |
---|
| 1220 | |
---|
| 1221 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1222 | |
---|
| 1223 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_h2, 1.0, i_hcl, 1.0, i_h) |
---|
| 1224 | |
---|
| 1225 | !=========================================================== |
---|
| 1226 | ! f009 : Cl + O3 -> ClO + O2 |
---|
| 1227 | !=========================================================== |
---|
| 1228 | |
---|
| 1229 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1230 | |
---|
| 1231 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_o3, 1.0, i_clo, 1.0, i_o2) |
---|
| 1232 | |
---|
| 1233 | !=========================================================== |
---|
| 1234 | ! f010 : Cl + HO2 -> ClO + OH |
---|
| 1235 | !=========================================================== |
---|
| 1236 | |
---|
| 1237 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1238 | |
---|
| 1239 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_ho2, 1.0, i_clo, 1.0, i_oh) |
---|
| 1240 | |
---|
| 1241 | !=========================================================== |
---|
| 1242 | ! f011 : Cl + HO2 -> HCl + O2 |
---|
| 1243 | !=========================================================== |
---|
| 1244 | |
---|
| 1245 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1246 | |
---|
| 1247 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_ho2, 1.0, i_hcl, 1.0, i_o2) |
---|
| 1248 | |
---|
| 1249 | !=========================================================== |
---|
| 1250 | ! f012 : Cl + H2O2 -> HCl + HO2 |
---|
| 1251 | !=========================================================== |
---|
| 1252 | |
---|
| 1253 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1254 | |
---|
| 1255 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_h2o2, 1.0, i_hcl, 1.0, i_ho2) |
---|
| 1256 | |
---|
| 1257 | !=========================================================== |
---|
| 1258 | ! f013 : Cl + CO + CO2 -> ClCO + CO2 |
---|
| 1259 | !=========================================================== |
---|
| 1260 | |
---|
| 1261 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1262 | |
---|
| 1263 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_co, 1.0, i_clco, 0.0, i_dummy) |
---|
| 1264 | |
---|
| 1265 | !=========================================================== |
---|
| 1266 | ! f014 : ClCO + CO2 -> Cl + CO + CO2 |
---|
| 1267 | !=========================================================== |
---|
| 1268 | |
---|
| 1269 | nb_phot = nb_phot + 1 |
---|
| 1270 | |
---|
| 1271 | indice_phot(nb_phot) = z3spec(1.0, i_clco, 1.0, i_cl, 1.0, i_co) |
---|
| 1272 | |
---|
| 1273 | !=========================================================== |
---|
| 1274 | ! f015 : ClCO + O2 + CO2 -> ClCO3 + CO2 |
---|
| 1275 | !=========================================================== |
---|
| 1276 | |
---|
| 1277 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1278 | |
---|
| 1279 | indice_4(nb_reaction_4) = z4spec(1.0, i_clco, 1.0, i_o2, 1.0, i_clco3, 0.0, i_dummy) |
---|
| 1280 | |
---|
| 1281 | !=========================================================== |
---|
| 1282 | ! f016 : 0.5 ClCO3 + 0.5 Cl -> Cl |
---|
| 1283 | ! 0.5 ClCO3 + 0.5 Cl -> ClO + CO2 |
---|
| 1284 | !=========================================================== |
---|
| 1285 | |
---|
| 1286 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1287 | |
---|
| 1288 | indice_4(nb_reaction_4) = z4spec(0.5, i_clco3, 0.5, i_cl, 1.0, i_cl, 0.0, i_dummy) |
---|
| 1289 | |
---|
| 1290 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1291 | |
---|
| 1292 | indice_4(nb_reaction_4) = z4spec(0.5, i_clco3, 0.5, i_cl, 1.0, i_clo, 1.0, i_co2) |
---|
| 1293 | |
---|
| 1294 | !=========================================================== |
---|
| 1295 | ! f017 : 0.5 ClCO3 + 0.5 O -> Cl |
---|
| 1296 | ! 0.5 ClCO3 + 0.5 O -> O2 + CO2 |
---|
| 1297 | !=========================================================== |
---|
| 1298 | |
---|
| 1299 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1300 | |
---|
| 1301 | indice_4(nb_reaction_4) = z4spec(0.5, i_clco3, 0.5, i_o, 1.0, i_cl, 0.0, i_dummy) |
---|
| 1302 | |
---|
| 1303 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1304 | |
---|
| 1305 | indice_4(nb_reaction_4) = z4spec(0.5, i_clco3, 0.5, i_o, 1.0, i_o2, 1.0, i_co2) |
---|
| 1306 | |
---|
| 1307 | !=========================================================== |
---|
| 1308 | ! f018 : ClO + HO2 -> HOCl + O2 |
---|
| 1309 | !=========================================================== |
---|
| 1310 | |
---|
| 1311 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1312 | |
---|
| 1313 | indice_4(nb_reaction_4) = z4spec(1.0, i_clo, 1.0, i_ho2, 1.0, i_hocl, 1.0, i_o2) |
---|
| 1314 | |
---|
| 1315 | !=========================================================== |
---|
| 1316 | ! f019 : OH + HOCl -> H2O + ClO |
---|
| 1317 | !=========================================================== |
---|
| 1318 | |
---|
| 1319 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1320 | |
---|
| 1321 | indice_4(nb_reaction_4) = z4spec(1.0, i_oh, 1.0, i_hocl, 1.0, i_h2o, 1.0, i_clo) |
---|
| 1322 | |
---|
| 1323 | !=========================================================== |
---|
| 1324 | ! f020 : O + HOCl -> OH + ClO |
---|
| 1325 | !=========================================================== |
---|
| 1326 | |
---|
| 1327 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1328 | |
---|
| 1329 | indice_4(nb_reaction_4) = z4spec(1.0, i_o, 1.0, i_hocl, 1.0, i_oh, 1.0, i_clo) |
---|
| 1330 | |
---|
| 1331 | !=========================================================== |
---|
| 1332 | ! f021 : Cl + Cl + CO2 -> Cl2 + CO2 |
---|
| 1333 | !=========================================================== |
---|
| 1334 | |
---|
| 1335 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 1336 | |
---|
| 1337 | indice_3(nb_reaction_3) = z3spec(2.0, i_cl, 1.0, i_cl2, 0.0, i_dummy) |
---|
| 1338 | |
---|
| 1339 | !=========================================================== |
---|
| 1340 | ! f022 : ClCO + O -> Cl + CO2 |
---|
| 1341 | !=========================================================== |
---|
| 1342 | |
---|
| 1343 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1344 | |
---|
| 1345 | indice_4(nb_reaction_4) = z4spec(1.0, i_clco, 1.0, i_o, 1.0, i_cl, 1.0, i_co2) |
---|
| 1346 | |
---|
| 1347 | !=========================================================== |
---|
| 1348 | ! f023 : Cl2 + O(1D) -> Cl + ClO |
---|
| 1349 | !=========================================================== |
---|
| 1350 | |
---|
| 1351 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1352 | |
---|
| 1353 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl2, 1.0, i_o1d, 1.0, i_cl, 1.0, i_clo) |
---|
| 1354 | |
---|
| 1355 | !=========================================================== |
---|
| 1356 | ! f024 : Cl2 + H -> HCl + Cl |
---|
| 1357 | !=========================================================== |
---|
| 1358 | |
---|
| 1359 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1360 | |
---|
| 1361 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl2, 1.0, i_h, 1.0, i_hcl, 1.0, i_cl) |
---|
| 1362 | |
---|
| 1363 | !=========================================================== |
---|
| 1364 | ! f025 : Cl + ClCO -> Cl2 + CO |
---|
| 1365 | !=========================================================== |
---|
| 1366 | |
---|
| 1367 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1368 | |
---|
| 1369 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_clco, 1.0, i_cl2, 1.0, i_co) |
---|
| 1370 | |
---|
| 1371 | !=========================================================== |
---|
| 1372 | ! f026 : ClCO + ClCO -> COCl2 + CO |
---|
| 1373 | !=========================================================== |
---|
| 1374 | |
---|
| 1375 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 1376 | |
---|
| 1377 | indice_3(nb_reaction_3) = z3spec(2.0, i_clco, 1.0, i_cocl2, 1.0, i_co) |
---|
| 1378 | |
---|
| 1379 | !=========================================================== |
---|
| 1380 | ! f027 : Cl + SO2 + CO2 -> ClSO2 + CO2 |
---|
| 1381 | !=========================================================== |
---|
| 1382 | |
---|
| 1383 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1384 | |
---|
| 1385 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_so2, 1.0, i_clso2, 0.0, i_dummy) |
---|
| 1386 | |
---|
| 1387 | !=========================================================== |
---|
| 1388 | ! f028 : ClSO2 + O -> SO2 + ClO |
---|
| 1389 | !=========================================================== |
---|
| 1390 | |
---|
| 1391 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1392 | |
---|
| 1393 | indice_4(nb_reaction_4) = z4spec(1.0, i_clso2, 1.0, i_o, 1.0, i_so2, 1.0, i_clo) |
---|
| 1394 | |
---|
| 1395 | !=========================================================== |
---|
| 1396 | ! f029 : ClSO2 + H -> SO2 + HCl |
---|
| 1397 | !=========================================================== |
---|
| 1398 | |
---|
| 1399 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1400 | |
---|
| 1401 | indice_4(nb_reaction_4) = z4spec(1.0, i_clso2, 1.0, i_h, 1.0, i_so2, 1.0, i_hcl) |
---|
| 1402 | |
---|
| 1403 | !=========================================================== |
---|
| 1404 | ! f030 : ClSO2 + ClSO2 -> Cl2 + SO2 + SO2 |
---|
| 1405 | !=========================================================== |
---|
| 1406 | |
---|
| 1407 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 1408 | |
---|
| 1409 | indice_3(nb_reaction_3) = z3spec(2.0, i_clso2, 1.0, i_cl2, 2.0, i_so2) |
---|
| 1410 | |
---|
| 1411 | !=========================================================== |
---|
| 1412 | ! f031 : Cl + O + CO2 -> ClO + CO2 |
---|
| 1413 | !=========================================================== |
---|
| 1414 | |
---|
| 1415 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1416 | |
---|
| 1417 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_o, 1.0, i_clo, 0.0, i_dummy) |
---|
| 1418 | |
---|
| 1419 | !=========================================================== |
---|
| 1420 | ! f032 : Cl2 + O -> ClO + Cl |
---|
| 1421 | !=========================================================== |
---|
| 1422 | |
---|
| 1423 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1424 | |
---|
| 1425 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl2, 1.0, i_o, 1.0, i_clo, 1.0, i_cl) |
---|
| 1426 | |
---|
| 1427 | !=========================================================== |
---|
| 1428 | ! f033 : ClCO + OH -> HOCl + CO |
---|
| 1429 | !=========================================================== |
---|
| 1430 | |
---|
| 1431 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1432 | |
---|
| 1433 | indice_4(nb_reaction_4) = z4spec(1.0, i_clco, 1.0, i_oh, 1.0, i_hocl, 1.0, i_co) |
---|
| 1434 | |
---|
| 1435 | !=========================================================== |
---|
| 1436 | ! f034 : Cl2 + OH -> Cl + HOCl |
---|
| 1437 | !=========================================================== |
---|
| 1438 | |
---|
| 1439 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1440 | |
---|
| 1441 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl2, 1.0, i_oh, 1.0, i_cl, 1.0, i_hocl) |
---|
| 1442 | |
---|
| 1443 | !=========================================================== |
---|
| 1444 | ! f035 : ClCO + O -> CO + ClO |
---|
| 1445 | !=========================================================== |
---|
| 1446 | |
---|
| 1447 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1448 | |
---|
| 1449 | indice_4(nb_reaction_4) = z4spec(1.0, i_clco, 1.0, i_o, 1.0, i_co, 1.0, i_clo) |
---|
| 1450 | |
---|
| 1451 | !=========================================================== |
---|
| 1452 | ! f036 : ClCO + Cl2 -> COCl2 + Cl |
---|
| 1453 | !=========================================================== |
---|
| 1454 | |
---|
| 1455 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1456 | |
---|
| 1457 | indice_4(nb_reaction_4) = z4spec(1.0, i_clco, 1.0, i_cl2, 1.0, i_cocl2, 1.0, i_cl) |
---|
| 1458 | |
---|
| 1459 | !=========================================================== |
---|
| 1460 | ! f037 : HCl + H -> H2 + Cl |
---|
| 1461 | !=========================================================== |
---|
| 1462 | |
---|
| 1463 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1464 | |
---|
| 1465 | indice_4(nb_reaction_4) = z4spec(1.0, i_hcl, 1.0, i_h, 1.0, i_h2, 1.0, i_cl) |
---|
| 1466 | |
---|
| 1467 | !=========================================================== |
---|
| 1468 | ! f038 : ClCO + H -> HCl + CO |
---|
| 1469 | !=========================================================== |
---|
| 1470 | |
---|
| 1471 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1472 | |
---|
| 1473 | indice_4(nb_reaction_4) = z4spec(1.0, i_clco, 1.0, i_h, 1.0, i_hcl, 1.0, i_co) |
---|
| 1474 | |
---|
| 1475 | !=========================================================== |
---|
| 1476 | ! f039 : Cl + H + M -> HCl + M |
---|
| 1477 | !=========================================================== |
---|
| 1478 | |
---|
| 1479 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1480 | |
---|
| 1481 | indice_4(nb_reaction_4) = z4spec(1.0, i_cl, 1.0, i_h, 1.0, i_hcl, 0.0, i_dummy) |
---|
| 1482 | |
---|
| 1483 | !=========================================================== |
---|
| 1484 | ! g001 : S + O2 -> SO + O |
---|
| 1485 | !=========================================================== |
---|
| 1486 | |
---|
| 1487 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1488 | |
---|
| 1489 | indice_4(nb_reaction_4) = z4spec(1.0, i_s, 1.0, i_o2, 1.0, i_so, 1.0, i_o) |
---|
| 1490 | |
---|
| 1491 | !=========================================================== |
---|
| 1492 | ! g002 : S + O3 -> SO + O2 |
---|
| 1493 | !=========================================================== |
---|
| 1494 | |
---|
| 1495 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1496 | |
---|
| 1497 | indice_4(nb_reaction_4) = z4spec(1.0, i_s, 1.0, i_o3, 1.0, i_so, 1.0, i_o2) |
---|
| 1498 | |
---|
| 1499 | !=========================================================== |
---|
| 1500 | ! g003 : SO + O2 -> SO2 + O |
---|
| 1501 | !=========================================================== |
---|
| 1502 | |
---|
| 1503 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1504 | |
---|
| 1505 | indice_4(nb_reaction_4) = z4spec(1.0, i_so, 1.0, i_o2, 1.0, i_so2, 1.0, i_o) |
---|
| 1506 | |
---|
| 1507 | !=========================================================== |
---|
| 1508 | ! g004 : SO + O3 -> SO2 + O2 |
---|
| 1509 | !=========================================================== |
---|
| 1510 | |
---|
| 1511 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1512 | |
---|
| 1513 | indice_4(nb_reaction_4) = z4spec(1.0, i_so, 1.0, i_o3, 1.0, i_so2, 1.0, i_o2) |
---|
| 1514 | |
---|
| 1515 | !=========================================================== |
---|
| 1516 | ! g005 : SO + OH -> SO2 + H |
---|
| 1517 | !=========================================================== |
---|
| 1518 | |
---|
| 1519 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1520 | |
---|
| 1521 | indice_4(nb_reaction_4) = z4spec(1.0, i_so, 1.0, i_oh, 1.0, i_so2, 1.0, i_h) |
---|
| 1522 | |
---|
| 1523 | !=========================================================== |
---|
| 1524 | ! g006 : S + OH -> SO + H |
---|
| 1525 | !=========================================================== |
---|
| 1526 | |
---|
| 1527 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1528 | |
---|
| 1529 | indice_4(nb_reaction_4) = z4spec(1.0, i_s, 1.0, i_oh, 1.0, i_so, 1.0, i_h) |
---|
| 1530 | |
---|
| 1531 | !=========================================================== |
---|
| 1532 | ! g007 : SO + O + CO2 -> SO2 + CO2 |
---|
| 1533 | !=========================================================== |
---|
| 1534 | |
---|
| 1535 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1536 | |
---|
| 1537 | indice_4(nb_reaction_4) = z4spec(1.0, i_so, 1.0, i_o, 1.0, i_so2, 0.0, i_dummy) |
---|
| 1538 | |
---|
| 1539 | !=========================================================== |
---|
| 1540 | ! g008 : SO + HO2 -> SO2 + OH |
---|
| 1541 | !=========================================================== |
---|
| 1542 | |
---|
| 1543 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1544 | |
---|
| 1545 | indice_4(nb_reaction_4) = z4spec(1.0, i_so, 1.0, i_ho2, 1.0, i_so2, 1.0, i_oh) |
---|
| 1546 | |
---|
| 1547 | !=========================================================== |
---|
| 1548 | ! g009 : SO2 + O + CO2 -> SO3 + CO2 |
---|
| 1549 | !=========================================================== |
---|
| 1550 | |
---|
| 1551 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1552 | |
---|
| 1553 | indice_4(nb_reaction_4) = z4spec(1.0, i_so2, 1.0, i_o, 1.0, i_so3, 0.0, i_dummy) |
---|
| 1554 | |
---|
| 1555 | !=========================================================== |
---|
| 1556 | ! g010 : S + O + CO2 -> SO + CO2 |
---|
| 1557 | !=========================================================== |
---|
| 1558 | |
---|
| 1559 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1560 | |
---|
| 1561 | indice_4(nb_reaction_4) = z4spec(1.0, i_s, 1.0, i_o, 1.0, i_so, 0.0, i_dummy) |
---|
| 1562 | |
---|
| 1563 | !=========================================================== |
---|
| 1564 | ! g011 : SO3 + H2O -> H2SO4 |
---|
| 1565 | !=========================================================== |
---|
| 1566 | |
---|
| 1567 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1568 | |
---|
| 1569 | indice_4(nb_reaction_4) = z4spec(1.0, i_so3, 1.0, i_h2o, 1.0, i_h2so4, 0.0, i_dummy) |
---|
| 1570 | |
---|
| 1571 | !=========================================================== |
---|
| 1572 | ! g012 : SO + ClO -> SO2 + Cl |
---|
| 1573 | !=========================================================== |
---|
| 1574 | |
---|
| 1575 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1576 | |
---|
| 1577 | indice_4(nb_reaction_4) = z4spec(1.0, i_so, 1.0, i_clo, 1.0, i_so2, 1.0, i_cl) |
---|
| 1578 | |
---|
| 1579 | !=========================================================== |
---|
| 1580 | ! g013 : SO + SO3 -> SO2 + SO2 |
---|
| 1581 | !=========================================================== |
---|
| 1582 | |
---|
| 1583 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1584 | |
---|
| 1585 | indice_4(nb_reaction_4) = z4spec(1.0, i_so, 1.0, i_so3, 2.0, i_so2, 0.0, i_dummy) |
---|
| 1586 | |
---|
| 1587 | !=========================================================== |
---|
| 1588 | ! g014 : SO3 + O -> SO2 + O2 |
---|
| 1589 | !=========================================================== |
---|
| 1590 | |
---|
| 1591 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1592 | |
---|
| 1593 | indice_4(nb_reaction_4) = z4spec(1.0, i_so3, 1.0, i_o, 1.0, i_so2, 1.0, i_o2) |
---|
| 1594 | |
---|
| 1595 | !=========================================================== |
---|
| 1596 | ! g015 : SO + SO + CO2 -> S2O2 + CO2 |
---|
| 1597 | !=========================================================== |
---|
| 1598 | |
---|
| 1599 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 1600 | |
---|
| 1601 | indice_3(nb_reaction_3) = z3spec(2.0, i_so, 1.0, i_s2o2, 0.0, i_dummy) |
---|
| 1602 | |
---|
| 1603 | !=========================================================== |
---|
| 1604 | ! g016 : S2O2 + CO2 -> SO + SO + CO2 |
---|
| 1605 | !=========================================================== |
---|
| 1606 | |
---|
| 1607 | nb_phot = nb_phot + 1 |
---|
| 1608 | |
---|
| 1609 | indice_phot(nb_phot) = z3spec(1.0, i_s2o2, 2.0, i_so, 0.0, i_dummy) |
---|
| 1610 | |
---|
| 1611 | !=========================================================== |
---|
| 1612 | ! g017 : 0.5 ClCO3 + 0.5 SO -> Cl |
---|
| 1613 | ! 0.5 ClCO3 + 0.5 SO -> SO2 + CO2 |
---|
| 1614 | !=========================================================== |
---|
| 1615 | |
---|
| 1616 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1617 | |
---|
| 1618 | indice_4(nb_reaction_4) = z4spec(0.5, i_clco3, 0.5, i_so, 1.0, i_cl, 0.0, i_dummy) |
---|
| 1619 | |
---|
| 1620 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1621 | |
---|
| 1622 | indice_4(nb_reaction_4) = z4spec(0.5, i_clco3, 0.5, i_so, 1.0, i_so2, 1.0, i_co2) |
---|
| 1623 | |
---|
| 1624 | !=========================================================== |
---|
| 1625 | ! g018 : S + CO + CO2 -> OCS + CO2 |
---|
| 1626 | !=========================================================== |
---|
| 1627 | |
---|
| 1628 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1629 | |
---|
| 1630 | indice_4(nb_reaction_4) = z4spec(1.0, i_s, 1.0, i_co, 1.0, i_ocs, 0.0, i_dummy) |
---|
| 1631 | |
---|
| 1632 | !=========================================================== |
---|
| 1633 | ! g019 : ClCO + S -> OCS + Cl |
---|
| 1634 | !=========================================================== |
---|
| 1635 | |
---|
| 1636 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1637 | |
---|
| 1638 | indice_4(nb_reaction_4) = z4spec(1.0, i_clco, 1.0, i_s, 1.0, i_ocs, 1.0, i_cl) |
---|
| 1639 | |
---|
| 1640 | !=========================================================== |
---|
| 1641 | ! g020 : SO2 + OH + CO2 -> HSO3 + CO2 |
---|
| 1642 | !=========================================================== |
---|
| 1643 | |
---|
| 1644 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1645 | |
---|
| 1646 | indice_4(nb_reaction_4) = z4spec(1.0, i_so2, 1.0, i_oh, 1.0, i_hso3, 0.0, i_dummy) |
---|
| 1647 | |
---|
| 1648 | !=========================================================== |
---|
| 1649 | ! g021 : HSO3 + O2 -> HO2 + SO3 |
---|
| 1650 | !=========================================================== |
---|
| 1651 | |
---|
| 1652 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1653 | |
---|
| 1654 | indice_4(nb_reaction_4) = z4spec(1.0, i_hso3, 1.0, i_o2, 1.0, i_ho2, 1.0, i_so3) |
---|
| 1655 | |
---|
| 1656 | !=========================================================== |
---|
| 1657 | ! g022 : S + S + CO2 -> S2 + CO2 |
---|
| 1658 | !=========================================================== |
---|
| 1659 | |
---|
| 1660 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 1661 | |
---|
| 1662 | indice_3(nb_reaction_3) = z3spec(2.0, i_s, 1.0, i_s2, 0.0, i_dummy) |
---|
| 1663 | |
---|
| 1664 | !=========================================================== |
---|
[2925] | 1665 | ! g023 : S2 + O -> SO + S |
---|
[2187] | 1666 | !=========================================================== |
---|
| 1667 | |
---|
| 1668 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1669 | |
---|
| 1670 | indice_4(nb_reaction_4) = z4spec(1.0, i_s2, 1.0, i_o, 1.0, i_so, 1.0, i_s) |
---|
| 1671 | |
---|
| 1672 | !=========================================================== |
---|
[2925] | 1673 | ! g024 : S + OCS -> S2 + CO |
---|
[2187] | 1674 | !=========================================================== |
---|
| 1675 | |
---|
| 1676 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1677 | |
---|
| 1678 | indice_4(nb_reaction_4) = z4spec(1.0, i_s, 1.0, i_ocs, 1.0, i_s2, 1.0, i_co) |
---|
| 1679 | |
---|
| 1680 | !=========================================================== |
---|
[2925] | 1681 | ! g025 : OCS + O -> SO + CO |
---|
[2187] | 1682 | !=========================================================== |
---|
| 1683 | |
---|
| 1684 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1685 | |
---|
| 1686 | indice_4(nb_reaction_4) = z4spec(1.0, i_ocs, 1.0, i_o, 1.0, i_so, 1.0, i_co) |
---|
| 1687 | |
---|
| 1688 | !=========================================================== |
---|
[2925] | 1689 | ! g026 : S + SO3 -> SO2 + SO |
---|
[2187] | 1690 | !=========================================================== |
---|
| 1691 | |
---|
| 1692 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1693 | |
---|
| 1694 | indice_4(nb_reaction_4) = z4spec(1.0, i_s, 1.0, i_so3, 1.0, i_so2, 1.0, i_so) |
---|
| 1695 | |
---|
| 1696 | !=========================================================== |
---|
[2925] | 1697 | ! g027 : S + HO2 -> SO + OH |
---|
[2187] | 1698 | !=========================================================== |
---|
| 1699 | |
---|
| 1700 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1701 | |
---|
| 1702 | indice_4(nb_reaction_4) = z4spec(1.0, i_s, 1.0, i_ho2, 1.0, i_so, 1.0, i_oh) |
---|
| 1703 | |
---|
| 1704 | !=========================================================== |
---|
[2925] | 1705 | ! g028 : S + ClO -> SO + Cl |
---|
[2187] | 1706 | !=========================================================== |
---|
| 1707 | |
---|
| 1708 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1709 | |
---|
| 1710 | indice_4(nb_reaction_4) = z4spec(1.0, i_s, 1.0, i_clo, 1.0, i_so, 1.0, i_cl) |
---|
| 1711 | |
---|
| 1712 | !=========================================================== |
---|
[2925] | 1713 | ! g029: h2so4 + h2o -> so3 + h2o + h2o |
---|
[2187] | 1714 | !=========================================================== |
---|
| 1715 | |
---|
| 1716 | nb_phot = nb_phot + 1 |
---|
| 1717 | |
---|
| 1718 | indice_phot(nb_phot) = z3spec(1.0, i_h2so4, 1.0, i_so3, 1.0, i_h2o) |
---|
| 1719 | |
---|
| 1720 | !=========================================================== |
---|
[2925] | 1721 | ! g030: so3 + ocs -> s2o2 + co2 |
---|
[2187] | 1722 | !=========================================================== |
---|
| 1723 | |
---|
| 1724 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1725 | |
---|
| 1726 | indice_4(nb_reaction_4) = z4spec(1.0, i_so3, 1.0, i_ocs, 1.0, i_s2o2, 1.0, i_co2) |
---|
| 1727 | |
---|
| 1728 | !=========================================================== |
---|
[2925] | 1729 | ! g031: s2o2 + ocs -> co + so2 + s2 |
---|
[2187] | 1730 | !=========================================================== |
---|
| 1731 | ! decomposee en |
---|
| 1732 | ! 0.5 s2o2 + 0.5 ocs -> co |
---|
| 1733 | ! 0.5 s2o2 + 0.5 ocs -> so2 + s2 |
---|
| 1734 | !=========================================================== |
---|
| 1735 | |
---|
| 1736 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1737 | |
---|
| 1738 | indice_4(nb_reaction_4) = z4spec(0.5, i_s2o2, 0.5, i_ocs, 1.0, i_co, 0.0, i_dummy) |
---|
| 1739 | |
---|
| 1740 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1741 | |
---|
| 1742 | indice_4(nb_reaction_4) = z4spec(0.5, i_s2o2, 0.5, i_ocs, 1.0, i_so2, 1.0, i_s2) |
---|
| 1743 | |
---|
| 1744 | !=========================================================== |
---|
[2925] | 1745 | ! g032: so + so -> so2 + s |
---|
[2187] | 1746 | !=========================================================== |
---|
| 1747 | |
---|
| 1748 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 1749 | |
---|
| 1750 | indice_3(nb_reaction_3) = z3spec(2.0, i_so, 1.0, i_so2, 1.0, i_s) |
---|
| 1751 | |
---|
| 1752 | !=========================================================== |
---|
| 1753 | ! h001: HO2 + ice -> products |
---|
| 1754 | ! treated as |
---|
| 1755 | ! HO2 -> 0.5 H2O + 0.75 O2 |
---|
| 1756 | !=========================================================== |
---|
| 1757 | |
---|
| 1758 | nb_phot = nb_phot + 1 |
---|
| 1759 | |
---|
| 1760 | indice_phot(nb_phot) = z3spec(1.0, i_ho2, 0.5, i_h2o, 0.75, i_o2) |
---|
| 1761 | |
---|
| 1762 | !=========================================================== |
---|
| 1763 | ! h002: OH + ice -> products |
---|
| 1764 | ! treated as |
---|
| 1765 | ! OH -> 0.5 H2O + 0.25 O2 |
---|
| 1766 | !=========================================================== |
---|
| 1767 | |
---|
| 1768 | nb_phot = nb_phot + 1 |
---|
| 1769 | |
---|
| 1770 | indice_phot(nb_phot) = z3spec(1.0, i_oh, 0.5, i_h2o, 0.25, i_o2) |
---|
| 1771 | |
---|
| 1772 | !=========================================================== |
---|
| 1773 | ! h003: H2O2 + ice -> products |
---|
| 1774 | ! treated as |
---|
| 1775 | ! H2O2 -> H2O + 0.5 O2 |
---|
| 1776 | !=========================================================== |
---|
| 1777 | |
---|
| 1778 | nb_phot = nb_phot + 1 |
---|
| 1779 | |
---|
| 1780 | indice_phot(nb_phot) = z3spec(1.0, i_h2o2, 1.0, i_h2o, 0.5, i_o2) |
---|
| 1781 | |
---|
[2836] | 1782 | !Only if ion chemistry |
---|
| 1783 | if (ok_ionchem) then |
---|
| 1784 | |
---|
[2187] | 1785 | !=========================================================== |
---|
[2836] | 1786 | ! i001 : CO2+ + O2 -> O2+ + CO2 |
---|
[2187] | 1787 | !=========================================================== |
---|
| 1788 | |
---|
[2836] | 1789 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1790 | |
---|
| 1791 | indice_4(nb_reaction_4) = z4spec(1.0, i_co2plus, 1.0, i_o2, 1.0, i_o2plus, 1.0, i_co2) |
---|
| 1792 | |
---|
| 1793 | !=========================================================== |
---|
| 1794 | ! i002 : CO2+ + O -> O+ + CO2 |
---|
| 1795 | !=========================================================== |
---|
| 1796 | |
---|
| 1797 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1798 | |
---|
| 1799 | indice_4(nb_reaction_4) = z4spec(1.0, i_co2plus, 1.0, i_o, 1.0, i_oplus, 1.0, i_co2) |
---|
| 1800 | |
---|
| 1801 | !=========================================================== |
---|
| 1802 | ! i003 : CO2+ + O -> O2+ + CO |
---|
| 1803 | !=========================================================== |
---|
| 1804 | |
---|
| 1805 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1806 | |
---|
| 1807 | indice_4(nb_reaction_4) = z4spec(1.0, i_co2plus, 1.0, i_o, 1.0, i_o2plus, 1.0, i_co) |
---|
| 1808 | |
---|
| 1809 | !=========================================================== |
---|
| 1810 | ! i004 : O2+ + e- -> O + O |
---|
| 1811 | !=========================================================== |
---|
| 1812 | |
---|
| 1813 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1814 | |
---|
| 1815 | indice_4(nb_reaction_4) = z4spec(1.0, i_o2plus, 1.0, i_elec, 2.0, i_o, 0.0, i_dummy) |
---|
| 1816 | |
---|
| 1817 | !=========================================================== |
---|
| 1818 | ! i005 : O+ + CO2 -> O2+ + CO |
---|
| 1819 | !=========================================================== |
---|
| 1820 | |
---|
| 1821 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1822 | |
---|
| 1823 | indice_4(nb_reaction_4) = z4spec(1.0, i_oplus, 1.0, i_co2, 1.0, i_o2plus, 1.0, i_co) |
---|
| 1824 | |
---|
| 1825 | !=========================================================== |
---|
| 1826 | ! i006 : CO2+ + e -> CO + O |
---|
| 1827 | !=========================================================== |
---|
| 1828 | |
---|
| 1829 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1830 | |
---|
| 1831 | indice_4(nb_reaction_4) = z4spec(1.0, i_co2plus, 1.0, i_elec, 1.0, i_co, 1.0, i_o) |
---|
| 1832 | |
---|
| 1833 | !=========================================================== |
---|
| 1834 | ! i007 : CO2+ + NO -> NO+ + CO2 |
---|
| 1835 | !=========================================================== |
---|
| 1836 | |
---|
| 1837 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1838 | |
---|
| 1839 | indice_4(nb_reaction_4) = z4spec(1.0, i_co2plus, 1.0, i_no, 1.0, i_noplus, 1.0, i_co2) |
---|
| 1840 | |
---|
| 1841 | !=========================================================== |
---|
| 1842 | ! i008 : O2+ + NO -> NO+ + O2 |
---|
| 1843 | !=========================================================== |
---|
| 1844 | |
---|
| 1845 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1846 | |
---|
| 1847 | indice_4(nb_reaction_4) = z4spec(1.0, i_o2plus, 1.0, i_no, 1.0, i_noplus, 1.0, i_o2) |
---|
| 1848 | |
---|
| 1849 | !=========================================================== |
---|
| 1850 | ! i009 : O2+ + N2 -> NO+ + NO |
---|
| 1851 | !=========================================================== |
---|
| 1852 | |
---|
| 1853 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1854 | |
---|
| 1855 | indice_4(nb_reaction_4) = z4spec(1.0, i_o2plus, 1.0, i_n2, 1.0, i_noplus, 1.0, i_no) |
---|
| 1856 | |
---|
| 1857 | !=========================================================== |
---|
| 1858 | ! i010 : O2+ + N -> NO+ + O |
---|
| 1859 | !=========================================================== |
---|
| 1860 | |
---|
| 1861 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1862 | |
---|
| 1863 | indice_4(nb_reaction_4) = z4spec(1.0, i_o2plus, 1.0, i_n, 1.0, i_noplus, 1.0, i_o) |
---|
| 1864 | |
---|
| 1865 | !=========================================================== |
---|
| 1866 | ! i011 : O+ + N2 -> NO+ + N |
---|
| 1867 | !=========================================================== |
---|
| 1868 | |
---|
| 1869 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1870 | |
---|
| 1871 | indice_4(nb_reaction_4) = z4spec(1.0, i_oplus, 1.0, i_n2, 1.0, i_noplus, 1.0, i_n) |
---|
| 1872 | |
---|
| 1873 | !=========================================================== |
---|
| 1874 | ! i012 : NO+ + e -> N + O |
---|
| 1875 | !=========================================================== |
---|
| 1876 | |
---|
| 1877 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1878 | |
---|
| 1879 | indice_4(nb_reaction_4) = z4spec(1.0, i_noplus, 1.0, i_elec, 1.0, i_n, 1.0, i_o) |
---|
| 1880 | |
---|
| 1881 | !=========================================================== |
---|
| 1882 | ! i013 : CO+ + CO2 -> CO2+ + CO |
---|
| 1883 | !=========================================================== |
---|
| 1884 | |
---|
| 1885 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1886 | |
---|
| 1887 | indice_4(nb_reaction_4) = z4spec(1.0, i_coplus, 1.0, i_co2, 1.0, i_co2plus, 1.0, i_co) |
---|
| 1888 | |
---|
| 1889 | !=========================================================== |
---|
| 1890 | ! i014 : CO+ + O -> O+ + CO |
---|
| 1891 | !=========================================================== |
---|
| 1892 | |
---|
| 1893 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1894 | |
---|
| 1895 | indice_4(nb_reaction_4) = z4spec(1.0, i_coplus, 1.0, i_o, 1.0, i_oplus, 1.0, i_co) |
---|
| 1896 | |
---|
| 1897 | !=========================================================== |
---|
| 1898 | ! i015 : C+ + CO2 -> CO+ + CO |
---|
| 1899 | !=========================================================== |
---|
| 1900 | |
---|
| 1901 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1902 | |
---|
| 1903 | indice_4(nb_reaction_4) = z4spec(1.0, i_cplus, 1.0, i_co2, 1.0, i_coplus, 1.0, i_co) |
---|
| 1904 | |
---|
| 1905 | !=========================================================== |
---|
[2925] | 1906 | |
---|
[2836] | 1907 | ! i016 : N2+ + CO2 -> CO2+ + N2 |
---|
| 1908 | !=========================================================== |
---|
| 1909 | |
---|
| 1910 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1911 | |
---|
| 1912 | indice_4(nb_reaction_4) = z4spec(1.0, i_n2plus, 1.0, i_co2, 1.0, i_co2plus, 1.0, i_n2) |
---|
| 1913 | |
---|
| 1914 | !=========================================================== |
---|
| 1915 | ! i017 : N2+ + O -> NO+ + N |
---|
| 1916 | !=========================================================== |
---|
| 1917 | |
---|
| 1918 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1919 | |
---|
| 1920 | indice_4(nb_reaction_4) = z4spec(1.0, i_n2plus, 1.0, i_o, 1.0, i_noplus, 1.0, i_n) |
---|
| 1921 | |
---|
| 1922 | !=========================================================== |
---|
| 1923 | ! i018 : N2+ + CO -> CO+ + N2 |
---|
| 1924 | !=========================================================== |
---|
| 1925 | |
---|
| 1926 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1927 | |
---|
| 1928 | indice_4(nb_reaction_4) = z4spec(1.0, i_n2plus, 1.0, i_co, 1.0, i_coplus, 1.0, i_n2) |
---|
| 1929 | |
---|
| 1930 | !=========================================================== |
---|
| 1931 | ! i019 : N2+ + e -> N + N |
---|
| 1932 | !=========================================================== |
---|
| 1933 | |
---|
| 1934 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1935 | |
---|
| 1936 | indice_4(nb_reaction_4) = z4spec(1.0, i_n2plus, 1.0, i_elec, 2.0, i_n, 0.0, i_dummy) |
---|
| 1937 | |
---|
| 1938 | !=========================================================== |
---|
| 1939 | ! i020 : N2+ + O -> O+ + N2 |
---|
| 1940 | !=========================================================== |
---|
| 1941 | |
---|
| 1942 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1943 | |
---|
| 1944 | indice_4(nb_reaction_4) = z4spec(1.0, i_n2plus, 1.0, i_o, 1.0, i_oplus, 1.0, i_n2) |
---|
| 1945 | |
---|
| 1946 | !=========================================================== |
---|
| 1947 | ! i021 : N+ + CO2 -> CO2+ + N |
---|
| 1948 | !=========================================================== |
---|
| 1949 | |
---|
| 1950 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1951 | |
---|
| 1952 | indice_4(nb_reaction_4) = z4spec(1.0, i_nplus, 1.0, i_co2, 1.0, i_co2plus, 1.0, i_n) |
---|
| 1953 | |
---|
| 1954 | !=========================================================== |
---|
| 1955 | ! i022 : CO+ + H -> H+ + CO |
---|
| 1956 | !=========================================================== |
---|
| 1957 | |
---|
| 1958 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1959 | |
---|
| 1960 | indice_4(nb_reaction_4) = z4spec(1.0, i_coplus, 1.0, i_h, 1.0, i_hplus, 1.0, i_co) |
---|
| 1961 | |
---|
| 1962 | !=========================================================== |
---|
| 1963 | ! i023 : O+ + H -> H+ + O |
---|
| 1964 | !=========================================================== |
---|
| 1965 | |
---|
| 1966 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1967 | |
---|
| 1968 | indice_4(nb_reaction_4) = z4spec(1.0, i_oplus, 1.0, i_h, 1.0, i_hplus, 1.0, i_o) |
---|
| 1969 | |
---|
| 1970 | !=========================================================== |
---|
| 1971 | ! i024 : H+ + O -> O+ + H |
---|
| 1972 | !=========================================================== |
---|
| 1973 | |
---|
| 1974 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1975 | |
---|
| 1976 | indice_4(nb_reaction_4) = z4spec(1.0, i_hplus, 1.0, i_o, 1.0, i_oplus, 1.0, i_h) |
---|
| 1977 | |
---|
| 1978 | !=========================================================== |
---|
| 1979 | ! i025 : CO2+ + H2 -> HCO2+ + H |
---|
| 1980 | !=========================================================== |
---|
| 1981 | |
---|
| 1982 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1983 | |
---|
| 1984 | indice_4(nb_reaction_4) = z4spec(1.0, i_co2plus, 1.0, i_h2, 1.0, i_hco2plus, 1.0, i_h) |
---|
| 1985 | |
---|
| 1986 | !=========================================================== |
---|
| 1987 | ! i026 : HCO2+ + e -> H + CO2 |
---|
| 1988 | !=========================================================== |
---|
| 1989 | |
---|
| 1990 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 1991 | |
---|
| 1992 | indice_4(nb_reaction_4) = z4spec(1.0, i_hco2plus, 1.0, i_elec, 1.0, i_h, 1.0, i_co2) |
---|
| 1993 | |
---|
| 1994 | !=========================================================== |
---|
| 1995 | ! i027 : HCO2+ + e -> H + O + CO |
---|
| 1996 | !=========================================================== |
---|
| 1997 | !We divide this reaction in two |
---|
| 1998 | |
---|
| 1999 | !0.5HCO2+ + 0.5e -> H |
---|
| 2000 | |
---|
| 2001 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2002 | |
---|
| 2003 | indice_4(nb_reaction_4) = z4spec(.5, i_hco2plus, 0.5, i_elec, 1.0, i_h, 0.0, i_dummy) |
---|
| 2004 | |
---|
| 2005 | !0.5 HCO2+ + 0.5 e -> O + CO |
---|
| 2006 | |
---|
| 2007 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2008 | |
---|
| 2009 | indice_4(nb_reaction_4) = z4spec(0.5, i_hco2plus, 0.5, i_elec, 1.0, i_o, 1.0, i_co) |
---|
| 2010 | |
---|
| 2011 | !=========================================================== |
---|
| 2012 | ! i029 : HCO2+ + e -> OH + CO |
---|
| 2013 | !=========================================================== |
---|
| 2014 | |
---|
| 2015 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2016 | |
---|
| 2017 | indice_4(nb_reaction_4) = z4spec(1.0, i_hco2plus, 1.0, i_elec, 1.0, i_oh, 1.0, i_co) |
---|
| 2018 | |
---|
| 2019 | |
---|
| 2020 | !=========================================================== |
---|
| 2021 | ! i030 : HCO2+ + e -> H + CO2 |
---|
| 2022 | !=========================================================== |
---|
| 2023 | |
---|
| 2024 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2025 | |
---|
| 2026 | indice_4(nb_reaction_4) = z4spec(1.0, i_hco2plus, 1.0, i_elec, 1.0, i_h, 1.0, i_co2) |
---|
| 2027 | |
---|
| 2028 | |
---|
| 2029 | !=========================================================== |
---|
| 2030 | ! i031 : HCO2+ + O -> HCO+ + O2 |
---|
| 2031 | !=========================================================== |
---|
| 2032 | |
---|
| 2033 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2034 | |
---|
| 2035 | indice_4(nb_reaction_4) = z4spec(1.0, i_hco2plus, 1.0, i_o, 1.0, i_hcoplus, 1.0, i_o2) |
---|
| 2036 | |
---|
| 2037 | |
---|
| 2038 | !=========================================================== |
---|
| 2039 | ! i032 : HCO2+ + CO -> HCO+ + CO2 |
---|
| 2040 | !=========================================================== |
---|
| 2041 | |
---|
| 2042 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2043 | indice_4(nb_reaction_4) = z4spec(1.0, i_hco2plus, 1.0, i_co, 1.0, i_hcoplus, 1.0, i_co2) |
---|
| 2044 | |
---|
| 2045 | |
---|
| 2046 | !=========================================================== |
---|
| 2047 | ! i033 : H+ + CO2 -> HCO+ + O |
---|
| 2048 | !=========================================================== |
---|
| 2049 | |
---|
| 2050 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2051 | indice_4(nb_reaction_4) = z4spec(1.0, i_hplus, 1.0, i_co2, 1.0, i_hcoplus, 1.0, i_o) |
---|
| 2052 | |
---|
| 2053 | |
---|
| 2054 | !=========================================================== |
---|
| 2055 | ! i034 : CO2+ + H -> HCO+ + O |
---|
| 2056 | !=========================================================== |
---|
| 2057 | |
---|
| 2058 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2059 | indice_4(nb_reaction_4) = z4spec(1.0, i_co2plus, 1.0, i_h, 1.0, i_hcoplus, 1.0, i_o) |
---|
| 2060 | |
---|
| 2061 | |
---|
| 2062 | !=========================================================== |
---|
| 2063 | ! i035 : CO+ + H2 -> HCO+ + H |
---|
| 2064 | !=========================================================== |
---|
| 2065 | |
---|
| 2066 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2067 | indice_4(nb_reaction_4) = z4spec(1.0, i_coplus, 1.0, i_h2, 1.0, i_hcoplus, 1.0, i_h) |
---|
| 2068 | |
---|
| 2069 | |
---|
| 2070 | !=========================================================== |
---|
| 2071 | ! i036 : HCO+ + e- -> CO + H |
---|
| 2072 | !=========================================================== |
---|
| 2073 | |
---|
| 2074 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2075 | indice_4(nb_reaction_4) = z4spec(1.0, i_hcoplus, 1.0, i_elec, 1.0, i_co, 1.0, i_h) |
---|
| 2076 | |
---|
| 2077 | !=========================================================== |
---|
| 2078 | ! i037 : CO2+ + H2O -> H2O+ + CO2 |
---|
| 2079 | !=========================================================== |
---|
| 2080 | |
---|
| 2081 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2082 | indice_4(nb_reaction_4) = z4spec(1.0, i_co2plus, 1.0, i_h2o, 1.0, i_h2oplus, 1.0, i_co2) |
---|
| 2083 | |
---|
| 2084 | !=========================================================== |
---|
| 2085 | ! i038 : CO+ + H2O -> H2O+ + CO |
---|
| 2086 | !=========================================================== |
---|
| 2087 | |
---|
| 2088 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2089 | indice_4(nb_reaction_4) = z4spec(1.0, i_coplus, 1.0, i_h2o, 1.0, i_h2oplus, 1.0, i_co) |
---|
| 2090 | |
---|
| 2091 | !=========================================================== |
---|
| 2092 | ! i039 : O+ + H2O -> H2O+ + O |
---|
| 2093 | !=========================================================== |
---|
| 2094 | |
---|
| 2095 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2096 | indice_4(nb_reaction_4) = z4spec(1.0, i_oplus, 1.0, i_h2o, 1.0, i_h2oplus, 1.0, i_o) |
---|
| 2097 | |
---|
| 2098 | !=========================================================== |
---|
| 2099 | ! i040 : N2+ + H2O -> H2O+ + N2 |
---|
| 2100 | !=========================================================== |
---|
| 2101 | |
---|
| 2102 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2103 | indice_4(nb_reaction_4) = z4spec(1.0, i_n2plus, 1.0, i_h2o, 1.0, i_h2oplus, 1.0, i_n2) |
---|
| 2104 | |
---|
| 2105 | !=========================================================== |
---|
| 2106 | ! i041 : N+ + H2O -> H2O+ + N |
---|
| 2107 | !=========================================================== |
---|
| 2108 | |
---|
| 2109 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2110 | indice_4(nb_reaction_4) = z4spec(1.0, i_nplus, 1.0, i_h2o, 1.0, i_h2oplus, 1.0, i_n) |
---|
| 2111 | |
---|
| 2112 | !=========================================================== |
---|
| 2113 | ! i042 : H+ + H2O -> H2O+ + H |
---|
| 2114 | !=========================================================== |
---|
| 2115 | |
---|
| 2116 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2117 | indice_4(nb_reaction_4) = z4spec(1.0, i_hplus, 1.0, i_h2o, 1.0, i_h2oplus, 1.0, i_h) |
---|
| 2118 | |
---|
| 2119 | !=========================================================== |
---|
| 2120 | ! i043 : H2O+ + O2 -> O2+ + H2O |
---|
| 2121 | !=========================================================== |
---|
| 2122 | |
---|
| 2123 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2124 | indice_4(nb_reaction_4) = z4spec(1.0, i_h2oplus, 1.0, i_o2, 1.0, i_o2plus, 1.0, i_h2o) |
---|
| 2125 | |
---|
| 2126 | !=========================================================== |
---|
| 2127 | ! i044 : H2O+ + CO -> HCO+ + OH |
---|
| 2128 | !=========================================================== |
---|
| 2129 | |
---|
| 2130 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2131 | indice_4(nb_reaction_4) = z4spec(1.0, i_h2oplus, 1.0, i_co, 1.0, i_hcoplus, 1.0, i_oh) |
---|
| 2132 | |
---|
| 2133 | !=========================================================== |
---|
| 2134 | ! i045 : H2O+ + O -> O2+ + H2 |
---|
| 2135 | !=========================================================== |
---|
| 2136 | |
---|
| 2137 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2138 | indice_4(nb_reaction_4) = z4spec(1.0, i_h2oplus, 1.0, i_o, 1.0, i_o2plus, 1.0, i_h2) |
---|
| 2139 | |
---|
| 2140 | !=========================================================== |
---|
| 2141 | ! i046 : H2O+ + NO -> NO+ + H2O |
---|
| 2142 | !=========================================================== |
---|
| 2143 | |
---|
| 2144 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2145 | indice_4(nb_reaction_4) = z4spec(1.0, i_h2oplus, 1.0, i_no, 1.0, i_noplus, 1.0, i_h2o) |
---|
| 2146 | |
---|
| 2147 | !=========================================================== |
---|
| 2148 | ! i047 : H2O+ + e- -> H + H + O |
---|
| 2149 | !=========================================================== |
---|
| 2150 | |
---|
| 2151 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2152 | indice_4(nb_reaction_4) = z4spec(1.0, i_h2oplus, 1.0, i_elec, 2.0, i_h, 1.0, i_o) |
---|
| 2153 | |
---|
| 2154 | !=========================================================== |
---|
| 2155 | ! i048 : H2O+ + e- -> H + OH |
---|
| 2156 | !=========================================================== |
---|
| 2157 | |
---|
| 2158 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2159 | indice_4(nb_reaction_4) = z4spec(1.0, i_h2oplus, 1.0, i_elec, 1.0, i_h, 1.0, i_oh) |
---|
| 2160 | |
---|
| 2161 | !=========================================================== |
---|
| 2162 | ! i049 : H2O+ + e- -> H2 + O |
---|
| 2163 | !=========================================================== |
---|
| 2164 | |
---|
| 2165 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2166 | indice_4(nb_reaction_4) = z4spec(1.0, i_h2oplus, 1.0, i_elec, 1.0, i_h2, 1.0, i_o) |
---|
| 2167 | |
---|
| 2168 | !=========================================================== |
---|
| 2169 | ! i050 : H2O+ + H2O -> H3O+ + OH |
---|
| 2170 | !=========================================================== |
---|
| 2171 | |
---|
| 2172 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2173 | indice_4(nb_reaction_4) = z4spec(1.0, i_h2oplus, 1.0, i_h2o, 1.0, i_h3oplus, 1.0, i_oh) |
---|
| 2174 | |
---|
| 2175 | !=========================================================== |
---|
| 2176 | ! i051 : H2O+ + H2 -> H3O+ + H |
---|
| 2177 | !=========================================================== |
---|
| 2178 | |
---|
| 2179 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2180 | indice_4(nb_reaction_4) = z4spec(1.0, i_h2oplus, 1.0, i_h2, 1.0, i_h3oplus, 1.0, i_h) |
---|
| 2181 | |
---|
| 2182 | !=========================================================== |
---|
| 2183 | ! i052 : HCO+ + H2O -> H3O+ + CO |
---|
| 2184 | !=========================================================== |
---|
| 2185 | |
---|
| 2186 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2187 | indice_4(nb_reaction_4) = z4spec(1.0, i_hcoplus, 1.0, i_h2o, 1.0, i_h3oplus, 1.0, i_co) |
---|
| 2188 | |
---|
| 2189 | !=========================================================== |
---|
| 2190 | ! i053: H3O+ + e -> OH + H + H |
---|
| 2191 | !=========================================================== |
---|
| 2192 | |
---|
| 2193 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2194 | indice_4(nb_reaction_4) = z4spec(1.0, i_h3oplus, 1.0, i_elec, 1.0, i_oh, 2.0, i_h) |
---|
| 2195 | |
---|
| 2196 | !=========================================================== |
---|
| 2197 | ! i054: H3O+ + e -> H2O + H |
---|
| 2198 | !=========================================================== |
---|
| 2199 | |
---|
| 2200 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2201 | indice_4(nb_reaction_4) = z4spec(1.0, i_h3oplus, 1.0, i_elec, 1.0, i_h2o, 1.0, i_h) |
---|
| 2202 | |
---|
| 2203 | !=========================================================== |
---|
| 2204 | ! i055: H3O+ + e -> HO + H2 |
---|
| 2205 | !=========================================================== |
---|
| 2206 | |
---|
| 2207 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2208 | indice_4(nb_reaction_4) = z4spec(1.0, i_h3oplus, 1.0, i_elec, 1.0, i_oh, 1.0, i_h2) |
---|
| 2209 | |
---|
| 2210 | !=========================================================== |
---|
| 2211 | ! i056: H3O+ + e -> O + H2 + H |
---|
| 2212 | !=========================================================== |
---|
| 2213 | !We divide this reaction in two |
---|
| 2214 | |
---|
| 2215 | !0.5H3O+ + 0.5e -> O |
---|
| 2216 | |
---|
| 2217 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2218 | indice_4(nb_reaction_4) = z4spec(0.5, i_h3oplus, 0.5, i_elec, 1.0, i_o, 0.0, i_dummy) |
---|
| 2219 | |
---|
| 2220 | !0.5H3O+ + 0.5e -> H2 + H |
---|
| 2221 | |
---|
| 2222 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2223 | indice_4(nb_reaction_4) = z4spec(0.5, i_h3oplus, 0.5, i_elec, 1.0, i_h2, 1.0, i_h) |
---|
| 2224 | |
---|
| 2225 | !=========================================================== |
---|
| 2226 | ! i057: O+ + H2 -> OH+ + H |
---|
| 2227 | !=========================================================== |
---|
| 2228 | |
---|
| 2229 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2230 | indice_4(nb_reaction_4) = z4spec(1.0, i_oplus, 1.0, i_h2, 1.0, i_ohplus, 1.0, i_h) |
---|
| 2231 | |
---|
| 2232 | !=========================================================== |
---|
| 2233 | ! i058: OH+ + O -> O2+ + H |
---|
| 2234 | !=========================================================== |
---|
| 2235 | |
---|
| 2236 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2237 | indice_4(nb_reaction_4) = z4spec(1.0, i_ohplus, 1.0, i_o, 1.0, i_o2plus, 1.0, i_h) |
---|
| 2238 | |
---|
| 2239 | !=========================================================== |
---|
| 2240 | ! i059: OH+ + CO2 -> HCO2+ + O |
---|
| 2241 | !=========================================================== |
---|
| 2242 | |
---|
| 2243 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2244 | indice_4(nb_reaction_4) = z4spec(1.0, i_ohplus, 1.0, i_co2, 1.0, i_hco2plus, 1.0, i_o) |
---|
| 2245 | |
---|
| 2246 | !=========================================================== |
---|
| 2247 | ! i060: OH+ + CO -> HCO+ + O |
---|
| 2248 | !=========================================================== |
---|
| 2249 | |
---|
| 2250 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2251 | indice_4(nb_reaction_4) = z4spec(1.0, i_ohplus, 1.0, i_co, 1.0, i_hcoplus, 1.0, i_o) |
---|
| 2252 | |
---|
| 2253 | !=========================================================== |
---|
| 2254 | ! i061: OH+ + NO -> NO+ + OH |
---|
| 2255 | !=========================================================== |
---|
| 2256 | |
---|
| 2257 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2258 | indice_4(nb_reaction_4) = z4spec(1.0, i_ohplus, 1.0, i_no, 1.0, i_noplus, 1.0, i_oh) |
---|
| 2259 | |
---|
| 2260 | !=========================================================== |
---|
| 2261 | ! i062: OH+ + H2 -> H2O+ + H |
---|
| 2262 | !=========================================================== |
---|
| 2263 | |
---|
| 2264 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2265 | indice_4(nb_reaction_4) = z4spec(1.0, i_ohplus, 1.0, i_h2, 1.0, i_h2oplus, 1.0, i_h) |
---|
| 2266 | |
---|
| 2267 | !=========================================================== |
---|
| 2268 | ! i063: OH+ + O2 -> O2+ + OH |
---|
| 2269 | !=========================================================== |
---|
| 2270 | |
---|
| 2271 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2272 | indice_4(nb_reaction_4) = z4spec(1.0, i_ohplus, 1.0, i_o2, 1.0, i_o2plus, 1.0, i_oh) |
---|
| 2273 | |
---|
| 2274 | end if !ok_ionchem |
---|
| 2275 | |
---|
| 2276 | !=========================================================== |
---|
| 2277 | ! j001: O2(Dg) + (CO2 or O) -> O2 + (CO2 or O) |
---|
| 2278 | !=========================================================== |
---|
| 2279 | |
---|
[2187] | 2280 | nb_phot = nb_phot + 1 |
---|
| 2281 | |
---|
| 2282 | indice_phot(nb_phot) = z3spec(1.0, i_o2dg, 1.0, i_o2, 0.0, i_dummy) |
---|
| 2283 | |
---|
| 2284 | !=========================================================== |
---|
[2836] | 2285 | ! j002: O2(Dg) -> O2 + hv |
---|
[2187] | 2286 | !=========================================================== |
---|
| 2287 | |
---|
| 2288 | nb_phot = nb_phot + 1 |
---|
| 2289 | |
---|
| 2290 | indice_phot(nb_phot) = z3spec(1.0, i_o2dg, 1.0, i_o2, 0.0, i_dummy) |
---|
| 2291 | |
---|
| 2292 | !=========================================================== |
---|
| 2293 | ! check dimensions |
---|
| 2294 | !=========================================================== |
---|
| 2295 | |
---|
| 2296 | print*, 'nb_phot = ', nb_phot |
---|
[2925] | 2297 | print*, 'nb_phot_max = ', nb_phot_max |
---|
[2187] | 2298 | print*, 'nb_reaction_4 = ', nb_reaction_4 |
---|
[2925] | 2299 | print*, 'nb_reaction_4_max = ', nb_reaction_4_max |
---|
[2187] | 2300 | print*, 'nb_reaction_3 = ', nb_reaction_3 |
---|
[2925] | 2301 | print*, 'nb_reaction_3_max = ', nb_reaction_3_max |
---|
[2187] | 2302 | |
---|
| 2303 | !print*, 'check dimension' |
---|
| 2304 | if ((nb_phot /= nb_phot_max) .or. & |
---|
| 2305 | (nb_reaction_3 /= nb_reaction_3_max) .or. & |
---|
| 2306 | (nb_reaction_4 /= nb_reaction_4_max)) then |
---|
[2795] | 2307 | print*, 'wrong dimensions in indice' |
---|
| 2308 | stop |
---|
[2187] | 2309 | end if |
---|
| 2310 | |
---|
| 2311 | end subroutine indice |
---|
| 2312 | |
---|
| 2313 | !=========================================================== |
---|
| 2314 | |
---|
| 2315 | subroutine phot(nj, nztable, nsza, nso2, sza_input, dist_sol, mumean, rmco2, rmso2, & |
---|
| 2316 | jphot, table_colair, table_colso2, table_sza, nz, nb_phot_max, t, p, v_phot) |
---|
| 2317 | |
---|
| 2318 | !=========================================================== |
---|
| 2319 | |
---|
| 2320 | implicit none |
---|
[2580] | 2321 | #include "clesphys.h" |
---|
[2187] | 2322 | |
---|
| 2323 | integer, INTENT(IN) :: nz |
---|
| 2324 | integer, INTENT(IN) :: nj, nztable, nsza, nso2 |
---|
| 2325 | |
---|
| 2326 | real, INTENT(IN), dimension(nz) :: t, p |
---|
| 2327 | real, INTENT(IN), dimension(nz) :: mumean ! [g/mol] |
---|
| 2328 | real, INTENT(IN), dimension(nso2,nsza,nztable,nj) :: jphot |
---|
| 2329 | real, INTENT(IN), dimension(nso2,nztable) :: table_colso2 |
---|
| 2330 | real, INTENT(IN), dimension(nztable) :: table_colair |
---|
| 2331 | real, INTENT(IN), dimension(nsza) :: table_sza |
---|
| 2332 | real, INTENT(IN), dimension(nz) :: rmco2, rmso2 |
---|
| 2333 | real, INTENT(IN) :: sza_input, dist_sol |
---|
| 2334 | |
---|
| 2335 | real, dimension(nz,nj) :: j |
---|
| 2336 | real, dimension(nz) :: coef, col, colso2 |
---|
| 2337 | real, dimension(nso2) :: colref |
---|
| 2338 | real, dimension(2,2,2) :: poids |
---|
| 2339 | real :: cicol, cisza, ciso2 |
---|
| 2340 | real :: avogadro, gvenus, dp |
---|
| 2341 | |
---|
| 2342 | integer :: indcol, indsza, indso2 |
---|
| 2343 | integer :: isza, iz, i, iso2, ij |
---|
| 2344 | integer :: nb_phot_max |
---|
| 2345 | real, dimension(nz,nb_phot_max), INTENT(INOUT) :: v_phot |
---|
| 2346 | |
---|
| 2347 | !mugaz = 43.44E-3 |
---|
| 2348 | avogadro = 6.022E+23 |
---|
| 2349 | gvenus = 8.87 |
---|
| 2350 | |
---|
| 2351 | ! day/night test |
---|
| 2352 | |
---|
| 2353 | if (sza_input <= 95.) then ! day |
---|
| 2354 | |
---|
| 2355 | ! interpolation in solar zenith angle |
---|
| 2356 | |
---|
| 2357 | indsza = nsza - 1 |
---|
| 2358 | do isza = 1,nsza |
---|
| 2359 | if (table_sza(isza) >= sza_input) then |
---|
| 2360 | indsza = min(indsza,isza - 1) |
---|
| 2361 | indsza = max(indsza, 1) |
---|
| 2362 | end if |
---|
| 2363 | end do |
---|
| 2364 | |
---|
| 2365 | cisza = (sza_input - table_sza(indsza)) & |
---|
| 2366 | /(table_sza(indsza + 1) - table_sza(indsza)) |
---|
| 2367 | |
---|
| 2368 | ! print*, 'indsza = ', indsza |
---|
| 2369 | ! print*, 'table_sza = ', table_sza(indsza) |
---|
| 2370 | ! print*, 'cisza = ', cisza |
---|
| 2371 | |
---|
| 2372 | ! co2 and so2 columns |
---|
| 2373 | |
---|
| 2374 | coef(nz) = avogadro/(gvenus*mumean(nz)*1.E-3)*1.E-4 |
---|
| 2375 | col(nz) = coef(nz)*rmco2(nz)*p(nz)*100. |
---|
| 2376 | colso2(nz) = coef(nz)*rmso2(nz)*p(nz)*100. |
---|
| 2377 | |
---|
| 2378 | do iz = nz-1, 1, -1 |
---|
| 2379 | ! print*,"L2490 new_photochemistry", iz,mumean(iz) |
---|
| 2380 | dp = (p(iz) - p(iz+1))*100. |
---|
| 2381 | coef(iz) = avogadro/(gvenus*mumean(iz)*1.E-3)*1.E-4 |
---|
| 2382 | col(iz) = col(iz+1) + coef(iz)*(rmco2(iz+1) + rmco2(iz))*0.5*dp |
---|
| 2383 | col(iz) = min(col(iz), table_colair(1)) |
---|
| 2384 | colso2(iz) = colso2(iz+1) + coef(iz)*(rmso2(iz+1) + rmso2(iz))*0.5*dp |
---|
| 2385 | colso2(iz) = min(colso2(iz), table_colso2(nso2,1)) |
---|
| 2386 | end do |
---|
| 2387 | |
---|
| 2388 | ! loop over altitude |
---|
| 2389 | |
---|
| 2390 | do iz = 1,nz |
---|
| 2391 | |
---|
| 2392 | ! interpolation in co2 column |
---|
| 2393 | |
---|
[2453] | 2394 | indcol = nztable - 1 |
---|
[2418] | 2395 | cicol = 0. |
---|
| 2396 | |
---|
[2464] | 2397 | do i = 1,nztable-1 |
---|
[2187] | 2398 | if (table_colair(i) < col(iz)) then |
---|
| 2399 | cicol = (log(col(iz)) - log(table_colair(i))) & |
---|
| 2400 | /(log(table_colair(i-1)) - log(table_colair(i))) |
---|
| 2401 | indcol = i - 1 |
---|
| 2402 | exit |
---|
| 2403 | end if |
---|
| 2404 | end do |
---|
| 2405 | |
---|
| 2406 | ! interpolation in so2 column |
---|
| 2407 | |
---|
| 2408 | ! initialize indso2 and ciso2 in case colref is never larger |
---|
| 2409 | ! than the gcm so2 column. |
---|
| 2410 | |
---|
| 2411 | indso2 = nso2 - 1 |
---|
| 2412 | ciso2 = 1. |
---|
| 2413 | |
---|
| 2414 | ! search for the index indso2 between which interpolate |
---|
| 2415 | |
---|
| 2416 | do iso2 = 1,nso2 |
---|
| 2417 | colref(iso2) = cicol*table_colso2(iso2,indcol) & |
---|
| 2418 | + (1.-cicol)*table_colso2(iso2,indcol+1) |
---|
| 2419 | if (colref(iso2) > colso2(iz)) then |
---|
| 2420 | ciso2 = (colso2(iz) - colref(iso2-1)) & |
---|
| 2421 | /(colref(iso2) - colref(iso2-1)) |
---|
| 2422 | indso2 = iso2 - 1 |
---|
| 2423 | exit |
---|
| 2424 | end if |
---|
| 2425 | end do |
---|
| 2426 | |
---|
| 2427 | ! 4-dimensional interpolation weights |
---|
| 2428 | |
---|
| 2429 | ! poids(so2,sza_input,co2) |
---|
| 2430 | |
---|
| 2431 | poids(1,1,1) = (1.-ciso2)*(1.-cisza)* cicol |
---|
| 2432 | poids(1,1,2) = (1.-ciso2)*(1.-cisza)*(1.-cicol) |
---|
| 2433 | poids(1,2,1) = (1.-ciso2)* cisza * cicol |
---|
| 2434 | poids(1,2,2) = (1.-ciso2)* cisza *(1.-cicol) |
---|
| 2435 | poids(2,1,1) = ciso2 *(1.-cisza)* cicol |
---|
| 2436 | poids(2,1,2) = ciso2 *(1.-cisza)*(1.-cicol) |
---|
| 2437 | poids(2,2,1) = ciso2 * cisza * cicol |
---|
| 2438 | poids(2,2,2) = ciso2 * cisza *(1.-cicol) |
---|
| 2439 | |
---|
| 2440 | ! 4-dimensional interpolation in the lookup table |
---|
| 2441 | |
---|
| 2442 | do ij = 1,nj |
---|
| 2443 | j(iz,ij) = & |
---|
| 2444 | poids(1,1,1)*jphot(indso2 ,indsza ,indcol ,ij) & |
---|
| 2445 | + poids(1,1,2)*jphot(indso2 ,indsza ,indcol+1,ij) & |
---|
| 2446 | + poids(1,2,1)*jphot(indso2 ,indsza+1,indcol ,ij) & |
---|
| 2447 | + poids(1,2,2)*jphot(indso2 ,indsza+1,indcol+1,ij) & |
---|
| 2448 | + poids(2,1,1)*jphot(indso2+1,indsza ,indcol ,ij) & |
---|
| 2449 | + poids(2,1,2)*jphot(indso2+1,indsza ,indcol+1,ij) & |
---|
| 2450 | + poids(2,2,1)*jphot(indso2+1,indsza+1,indcol ,ij) & |
---|
| 2451 | + poids(2,2,2)*jphot(indso2+1,indsza+1,indcol+1,ij) |
---|
| 2452 | end do |
---|
| 2453 | |
---|
| 2454 | end do ! end of loop over altitude |
---|
| 2455 | |
---|
| 2456 | else ! night |
---|
| 2457 | j(:,:) = 0. |
---|
| 2458 | end if |
---|
| 2459 | |
---|
| 2460 | ! photodissociation rates numbering in the lookup table |
---|
| 2461 | |
---|
| 2462 | ! 1 o2 + hv -> o + o |
---|
| 2463 | ! 2 o2 + hv -> o + o(1d) |
---|
| 2464 | ! 3 co2 + hv -> co + o |
---|
| 2465 | ! 4 co2 + hv -> co + o(1d) |
---|
| 2466 | ! 5 o3 + hv -> o2(Dg) + o(1d) |
---|
| 2467 | ! 6 o3 + hv -> o2 + o |
---|
| 2468 | ! 7 h2o + hv -> h + oh |
---|
| 2469 | ! 8 ho2 + hv -> oh + o |
---|
| 2470 | ! 9 h2o2 + hv -> oh + oh |
---|
| 2471 | ! 10 hcl + hv -> h + cl |
---|
| 2472 | ! 11 cl2 + hv -> cl + cl |
---|
| 2473 | ! 12 hocl + hv -> oh + cl |
---|
| 2474 | ! 13 so2 + hv -> so + o |
---|
| 2475 | ! 14 so + hv -> s + o |
---|
| 2476 | ! 15 so3 + hv -> so2 + o |
---|
| 2477 | ! 16 clo + hv -> cl + o |
---|
| 2478 | ! 17 ocs + hv -> co + s |
---|
| 2479 | ! 18 cocl2 + hv -> cl + cl + co |
---|
| 2480 | ! 19 h2so4 + hv -> so3 + h2o |
---|
[2795] | 2481 | ! 20 no2 + hv -> no + o |
---|
| 2482 | ! 21 no + hv -> n + o |
---|
| 2483 | ! 22 n2 + hv -> n + n |
---|
[2187] | 2484 | |
---|
| 2485 | ! fill v_phot array |
---|
| 2486 | |
---|
| 2487 | do ij = 1,nj |
---|
| 2488 | v_phot(:,ij) = j(:,ij) |
---|
| 2489 | end do |
---|
| 2490 | |
---|
[2580] | 2491 | !!! TEST: artificial increase of CO2 photodissociation |
---|
| 2492 | if (tuneupperatm) then |
---|
| 2493 | !-- TuneA |
---|
| 2494 | ! v_phot(65:78,4) = v_phot(65:78,4)*10. |
---|
| 2495 | ! v_phot(60:64,4) = v_phot(60:64,4)*3. |
---|
| 2496 | ! v_phot(55:59,3) = v_phot(55:59,3)*2. |
---|
| 2497 | !-- |
---|
| 2498 | !-- TuneB |
---|
| 2499 | ! v_phot(65:78,4) = v_phot(65:78,4)*10. |
---|
| 2500 | ! v_phot(55:59,3) = v_phot(55:59,3)*5. |
---|
| 2501 | !-- |
---|
| 2502 | !-- TuneC |
---|
| 2503 | ! VCD 1.1 tuning |
---|
[2622] | 2504 | ! v_phot(65:78,4) = v_phot(65:78,4)*10. |
---|
| 2505 | ! v_phot(52:59,3) = v_phot(52:59,3)*5. |
---|
[2580] | 2506 | !-- |
---|
| 2507 | !-- TuneE |
---|
| 2508 | ! VCD 2.0 tuning |
---|
[3035] | 2509 | v_phot(65:nz,4) = v_phot(65:nz,4)*10. ! CO2 + hv ==> O(1D) + CO |
---|
[2580] | 2510 | !-- |
---|
| 2511 | ! v_phot(:,4) = v_phot(:,4)*10. |
---|
| 2512 | !do ij=3,4 |
---|
| 2513 | ! v_phot(:,ij) = v_phot(:,ij)*10. |
---|
| 2514 | !end do |
---|
| 2515 | endif |
---|
| 2516 | !!!!!!!!!!!!!!! |
---|
| 2517 | |
---|
[2187] | 2518 | !PRINT*,'sza_input: ',sza_input |
---|
| 2519 | !IF (sza_input.le.40.5 .AND. sza_input.gt.39.5) THEN |
---|
| 2520 | !open(200, form = 'formatted') |
---|
| 2521 | !100 format(e20.6) |
---|
| 2522 | !write(200,100)(v_phot(:,19)) |
---|
| 2523 | !stop |
---|
| 2524 | !END IF |
---|
| 2525 | |
---|
| 2526 | end subroutine phot |
---|
| 2527 | |
---|
| 2528 | !====================================================================== |
---|
| 2529 | |
---|
[2836] | 2530 | subroutine krates(hetero_ice,hetero_dust,ok_ionchem, nphotion, & |
---|
| 2531 | nz, nesp, c, conc, t, t_elect, p, & |
---|
| 2532 | nb_phot_max, nb_reaction_3_max, nb_reaction_4_max, & |
---|
| 2533 | tuneupperatm, v_3, v_4, v_phot,sza_input, & |
---|
| 2534 | ind_norec, ind_orec) |
---|
[2187] | 2535 | |
---|
| 2536 | !================================================================ |
---|
| 2537 | ! compute reaction rates ! |
---|
| 2538 | !---------------------------------------------------------------- |
---|
| 2539 | ! reaction type array ! |
---|
| 2540 | !---------------------------------------------------------------- |
---|
| 2541 | ! A + B --> C + D bimolecular v_4 ! |
---|
| 2542 | ! A + A --> B + C quadratic v_3 ! |
---|
| 2543 | ! A + C --> B + C quenching v_phot ! |
---|
| 2544 | ! A + ice --> B + C heterogeneous v_phot ! |
---|
| 2545 | !================================================================ |
---|
| 2546 | |
---|
| 2547 | USE chemparam_mod |
---|
[2836] | 2548 | USE photolysis_mod, only : nphot |
---|
[2187] | 2549 | implicit none |
---|
| 2550 | |
---|
[2836] | 2551 | !---------------------------------------------------------------------- |
---|
| 2552 | ! input |
---|
| 2553 | !---------------------------------------------------------------------- |
---|
| 2554 | |
---|
| 2555 | integer, INTENT(IN) :: nesp, nz |
---|
| 2556 | real, INTENT(IN) :: sza_input ! [degree] |
---|
| 2557 | real, INTENT(IN), dimension(nz) :: t_elect, t, p, conc |
---|
| 2558 | logical, INTENT(IN) :: hetero_ice, hetero_dust, tuneupperatm |
---|
| 2559 | |
---|
| 2560 | real, INTENT(IN), dimension(nz,nesp) :: c |
---|
| 2561 | |
---|
| 2562 | integer, intent(in) :: nb_reaction_3_max ! number of quadratic reactions |
---|
| 2563 | integer, intent(in) :: nb_reaction_4_max ! number of bimolecular reactions |
---|
| 2564 | integer, intent(in) :: nb_phot_max ! number of reactions treated numerically as photodissociations |
---|
| 2565 | integer, intent(in) :: nphotion ! number of photoionizations |
---|
| 2566 | logical, intent(in) :: ok_ionchem ! if .true. then ionchem reaction used |
---|
| 2567 | |
---|
| 2568 | !---------------------------------------------------------------------- |
---|
| 2569 | ! output |
---|
| 2570 | !---------------------------------------------------------------------- |
---|
| 2571 | |
---|
| 2572 | real (kind = 8), dimension(nz, nb_phot_max) :: v_phot |
---|
| 2573 | real (kind = 8), dimension(nz, nb_reaction_3_max) :: v_3 |
---|
| 2574 | real (kind = 8), dimension(nz, nb_reaction_4_max) :: v_4 |
---|
| 2575 | integer :: ind_norec |
---|
| 2576 | integer :: ind_orec |
---|
| 2577 | |
---|
| 2578 | !---------------------------------------------------------------------- |
---|
| 2579 | ! local |
---|
| 2580 | !---------------------------------------------------------------------- |
---|
| 2581 | |
---|
[2187] | 2582 | integer :: iz |
---|
[2795] | 2583 | real :: ak0, ak1, xpo, rate, rate1, rate2, pi, gam |
---|
[2851] | 2584 | real :: k1a0, k1b0, k1ainf, k1a, k1b, k0, kinf, kf, kint, kca, fc, fx, x, y |
---|
[2836] | 2585 | integer :: nb_phot, nb_reaction_3, nb_reaction_4 |
---|
[2187] | 2586 | real, dimension(nz) :: surfice1d, surfdust1d |
---|
| 2587 | real, dimension(nz) :: deq |
---|
| 2588 | real, dimension(nz) :: a001, a002, a003, & |
---|
| 2589 | b001, b002, b003, b004, b005, b006, b007, & |
---|
| 2590 | b008, b009, & |
---|
| 2591 | c001, c002, c003, c004, c005, c006, c007, & |
---|
| 2592 | c008, c009, c010, c011, c012, c013, c014, & |
---|
| 2593 | c015, c016, c017, c018, & |
---|
[2795] | 2594 | d001, d002, d003, d004, d005, d006, d007, & |
---|
[2925] | 2595 | d008, d009, d010, d011, d012, d013, d014, & |
---|
[2187] | 2596 | e001, e002, e003, e004, e005, e006, e007, & |
---|
| 2597 | e008, e009, e010, e011, e012, e013, e014, & |
---|
| 2598 | e015, e016, e017, e018, e019, e020, e021, & |
---|
| 2599 | e022, e023, e024, e025, e026, e027, e028, & |
---|
| 2600 | e029, e030, e031, e032, e033, e034, e035, & |
---|
| 2601 | e036, e037, e038, e039, e040, e041, e042, & |
---|
| 2602 | e043, & |
---|
| 2603 | f001, f002, f003, f004, f005, f006, f007, & |
---|
| 2604 | f008, f009, f010, f011, f012, f013, f014, & |
---|
| 2605 | f015, f016, f017, f018, f019, f020, f021, & |
---|
| 2606 | f022, f023, f024, f025, f026, f027, f028, & |
---|
| 2607 | f029, f030, f031, f032, f033, f034, f035, & |
---|
| 2608 | f036, f037, f038, f039, & |
---|
| 2609 | g001, g002, g003, g004, g005, g006, g007, & |
---|
| 2610 | g008, g009, g010, g011, g012, g013, g014, & |
---|
| 2611 | g015, g016, g017, g018, g019, g020, g021, & |
---|
| 2612 | g022, g023, g024, g025, g026, g027, g028, & |
---|
[2925] | 2613 | g029, g030, g031, g032, & |
---|
[2187] | 2614 | h001, h002, h003, & |
---|
[2836] | 2615 | i001, i002, i003, i004, i005, i006, & |
---|
| 2616 | i007, i008, i009, i010, i011, i012, & |
---|
| 2617 | i013, i014, i015, i016, i017, i018, i019, & |
---|
| 2618 | i020, i021, i022, i023, i024, i025, i026, & |
---|
| 2619 | i027, i028, i029, i030, i031, i032, i033, & |
---|
| 2620 | i034, i035, i036, i037, i038, i039, i040, & |
---|
| 2621 | i041, i042, i043, i044, i045, i046, i047, & |
---|
| 2622 | i048, i049, i050, i051, i052, i053, i054, & |
---|
| 2623 | i055, i056, i057, i058, i059, i060, i061, & |
---|
| 2624 | i062, i063, & |
---|
[2925] | 2625 | j001, j002 |
---|
[2836] | 2626 | !---------------------------------------------------------------------- |
---|
| 2627 | ! initialisation |
---|
| 2628 | !---------------------------------------------------------------------- |
---|
[2187] | 2629 | |
---|
[2836] | 2630 | pi = acos(-1.) |
---|
| 2631 | |
---|
| 2632 | nb_phot = nphot + nphotion ! initialised to the number of photolysis + number of photoionization rates |
---|
| 2633 | nb_reaction_3 = 0 |
---|
| 2634 | nb_reaction_4 = 0 |
---|
[2187] | 2635 | |
---|
| 2636 | !---------------------------------------------------------------------- |
---|
| 2637 | ! reactions avec ox |
---|
| 2638 | !---------------------------------------------------------------------- |
---|
| 2639 | |
---|
| 2640 | ! jpl 2003 |
---|
[2836] | 2641 | ! ------ BEFORE VCD 2.1 ------- |
---|
| 2642 | ! a001(:) = 2.5*6.0E-34*(t(:)/300.)**(-2.4)*conc(:) |
---|
| 2643 | ! ----------------------------- |
---|
[2187] | 2644 | |
---|
[2836] | 2645 | ! ! nist expression + take account of the N2 and CO2 factor |
---|
| 2646 | ! ------ VCD 2.1 update ------- |
---|
| 2647 | a001(:) = 6.0E-34*(t(:)/300.)**(-2.4) * & |
---|
| 2648 | ( 2.5 * c(:,i_co2) + & |
---|
| 2649 | 1.0 * (conc(:)-c(:,i_co2)) ) |
---|
[2851] | 2650 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2651 | v_4(:,nb_reaction_4) = a001(:) |
---|
[2187] | 2652 | |
---|
| 2653 | |
---|
| 2654 | ! Tsang and Hampson, J. Chem. Phys. Ref. Data, 15, 1087, 1986 |
---|
[2836] | 2655 | ! ------ BEFORE VCD 2.1 ------- |
---|
| 2656 | ! a002(:) = 2.5*9.46E-34*exp(485./t(:))*conc(:) ! nist expression |
---|
| 2657 | ! ----------------------------- |
---|
[2187] | 2658 | |
---|
[2836] | 2659 | ! ! nist expression + take account of the N2 and CO2 factor |
---|
| 2660 | ! a002(:) = 9.46E-34*exp(485./t(:)) * & |
---|
| 2661 | ! ( 2.5 * c(:,i_co2) + & |
---|
| 2662 | ! 1.0 * (conc(:)-c(:,i_co2)) ) |
---|
[2187] | 2663 | |
---|
[2836] | 2664 | ! Baulch et al., 1976 (confirmed by smith and robertson, 2008) |
---|
| 2665 | ! ------ VCD 2.1 update ------- |
---|
| 2666 | |
---|
| 2667 | a002(:) = 2.76E-34*exp(720./t(:)) * & |
---|
| 2668 | ( 2.5 * c(:,i_co2) + & |
---|
| 2669 | 1.0 * (conc(:)-c(:,i_co2)) ) |
---|
| 2670 | ! ----------------------------- |
---|
| 2671 | |
---|
[2187] | 2672 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 2673 | v_3(:,nb_reaction_3) = a002(:) |
---|
[2795] | 2674 | ind_orec = nb_reaction_3 |
---|
| 2675 | |
---|
[2851] | 2676 | ! a003: o + o3 -> o2 + o2 |
---|
[2187] | 2677 | |
---|
| 2678 | ! jpl 2003 |
---|
| 2679 | |
---|
| 2680 | a003(:) = 8.0E-12*exp(-2060./t(:)) |
---|
| 2681 | |
---|
| 2682 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2683 | v_4(:,nb_reaction_4) = a003(:) |
---|
| 2684 | |
---|
| 2685 | !---------------------------------------------------------------------- |
---|
| 2686 | ! reactions avec o(1d) |
---|
| 2687 | !---------------------------------------------------------------------- |
---|
| 2688 | |
---|
| 2689 | !--- b001: o(1d) + co2 -> o + co2 |
---|
| 2690 | |
---|
| 2691 | ! jpl 2006 |
---|
| 2692 | |
---|
| 2693 | b001(:) = 7.5E-11*exp(115./t(:)) |
---|
| 2694 | |
---|
| 2695 | nb_phot = nb_phot + 1 |
---|
| 2696 | v_phot(:,nb_phot) = b001(:)*c(:,i_co2) |
---|
| 2697 | |
---|
| 2698 | !--- b002: o(1d) + h2o -> oh + oh |
---|
| 2699 | |
---|
| 2700 | ! jpl 2006 |
---|
[2851] | 2701 | |
---|
[2187] | 2702 | b002(:) = 1.63E-10*exp(60./t(:)) |
---|
[2851] | 2703 | |
---|
[2187] | 2704 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2705 | v_4(:,nb_reaction_4) = b002(:) |
---|
| 2706 | |
---|
| 2707 | !--- b003: o(1d) + h2 -> oh + h |
---|
| 2708 | |
---|
[2843] | 2709 | ! jpl 2011 |
---|
[2187] | 2710 | |
---|
| 2711 | b003(:) = 1.2E-10 |
---|
| 2712 | |
---|
| 2713 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2714 | v_4(:,nb_reaction_4) = b003(:) |
---|
| 2715 | |
---|
| 2716 | !--- b004: o(1d) + o2 -> o + o2 |
---|
| 2717 | |
---|
| 2718 | ! jpl 2006 |
---|
| 2719 | |
---|
| 2720 | b004(:) = 3.3E-11*exp(55./t(:)) |
---|
| 2721 | |
---|
| 2722 | nb_phot = nb_phot + 1 |
---|
| 2723 | v_phot(:,nb_phot) = b004(:)*c(:,i_o2) |
---|
[2851] | 2724 | |
---|
[2187] | 2725 | !--- b005: o(1d) + o3 -> o2 + o2 |
---|
| 2726 | |
---|
| 2727 | ! jpl 2003 |
---|
| 2728 | |
---|
| 2729 | b005(:) = 1.2E-10 |
---|
| 2730 | |
---|
| 2731 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2732 | v_4(:,nb_reaction_4) = b005(:) |
---|
[2851] | 2733 | |
---|
[2187] | 2734 | !--- b006: o(1d) + o3 -> o2 + o + o |
---|
| 2735 | |
---|
| 2736 | ! jpl 2003 |
---|
| 2737 | |
---|
| 2738 | b006(:) = 1.2E-10 |
---|
| 2739 | |
---|
| 2740 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2741 | v_4(:,nb_reaction_4) = b006(:) |
---|
[2851] | 2742 | |
---|
[2187] | 2743 | !---------------------------------------------------------------------- |
---|
| 2744 | ! reactions des hox |
---|
| 2745 | !---------------------------------------------------------------------- |
---|
| 2746 | |
---|
| 2747 | !--- c001: o + ho2 -> oh + o2 |
---|
| 2748 | |
---|
| 2749 | ! jpl 2003 |
---|
| 2750 | |
---|
| 2751 | c001(:) = 3.0E-11*exp(200./t(:)) |
---|
| 2752 | |
---|
| 2753 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2754 | v_4(:,nb_reaction_4) = c001(:) |
---|
| 2755 | |
---|
| 2756 | !--- c002: o + oh -> o2 + h |
---|
| 2757 | |
---|
[2843] | 2758 | ! jpl 2011 |
---|
[2187] | 2759 | |
---|
| 2760 | c002(:) = 1.8E-11*exp(180./t(:)) |
---|
| 2761 | |
---|
| 2762 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2763 | v_4(:,nb_reaction_4) = c002(:) |
---|
| 2764 | |
---|
| 2765 | !--- c003: h + o3 -> oh + o2 |
---|
| 2766 | |
---|
| 2767 | ! jpl 2003 |
---|
| 2768 | |
---|
| 2769 | c003(:) = 1.4E-10*exp(-470./t(:)) |
---|
| 2770 | |
---|
| 2771 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2772 | v_4(:,nb_reaction_4) = c003(:) |
---|
| 2773 | |
---|
| 2774 | !--- c004: h + ho2 -> oh + oh |
---|
| 2775 | |
---|
| 2776 | ! jpl 2006 |
---|
| 2777 | |
---|
| 2778 | c004(:) = 7.2E-11 |
---|
| 2779 | |
---|
| 2780 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2781 | v_4(:,nb_reaction_4) = c004(:) |
---|
| 2782 | |
---|
| 2783 | !--- c005: h + ho2 -> h2 + o2 |
---|
| 2784 | |
---|
| 2785 | ! jpl 2006 |
---|
| 2786 | |
---|
| 2787 | c005(:) = 6.9E-12 |
---|
| 2788 | |
---|
| 2789 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2790 | v_4(:,nb_reaction_4) = c005(:) |
---|
| 2791 | |
---|
| 2792 | !--- c006: h + ho2 -> h2o + o |
---|
| 2793 | |
---|
| 2794 | ! jpl 2006 |
---|
| 2795 | |
---|
| 2796 | c006(:) = 1.6E-12 |
---|
| 2797 | |
---|
| 2798 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2799 | v_4(:,nb_reaction_4) = c006(:) |
---|
| 2800 | |
---|
| 2801 | !--- c007: oh + ho2 -> h2o + o2 |
---|
| 2802 | |
---|
| 2803 | ! jpl 2003 |
---|
| 2804 | |
---|
| 2805 | c007(:) = 4.8E-11*exp(250./t(:)) |
---|
| 2806 | |
---|
| 2807 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2808 | v_4(:,nb_reaction_4) = c007(:) |
---|
| 2809 | |
---|
| 2810 | !--- c008: ho2 + ho2 -> h2o2 + o2 |
---|
| 2811 | |
---|
[2843] | 2812 | ! jpl 2015 |
---|
[2187] | 2813 | |
---|
[2843] | 2814 | c008(:) = 3.0E-13*exp(460./t(:)) |
---|
[2187] | 2815 | |
---|
| 2816 | ! christensen et al., grl, 13, 2002 |
---|
| 2817 | |
---|
[2843] | 2818 | ! c008(:) = 1.5E-12*exp(19./t(:)) |
---|
[2187] | 2819 | |
---|
| 2820 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 2821 | v_3(:,nb_reaction_3) = c008(:) |
---|
| 2822 | |
---|
| 2823 | !--- c009: oh + h2o2 -> h2o + ho2 |
---|
| 2824 | |
---|
| 2825 | ! jpl 2006 |
---|
| 2826 | |
---|
| 2827 | c009(:) = 1.8E-12 |
---|
| 2828 | |
---|
| 2829 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2830 | v_4(:,nb_reaction_4) = c009(:) |
---|
| 2831 | |
---|
| 2832 | !--- c010: oh + h2 -> h2o + h |
---|
| 2833 | |
---|
| 2834 | ! jpl 2006 |
---|
| 2835 | |
---|
| 2836 | c010(:) = 2.8E-12*exp(-1800./t(:)) |
---|
| 2837 | |
---|
| 2838 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2839 | v_4(:,nb_reaction_4) = c010(:) |
---|
| 2840 | |
---|
| 2841 | !--- c011: h + o2 + co2 -> ho2 + co2 |
---|
| 2842 | |
---|
| 2843 | ! jpl 2006 |
---|
| 2844 | |
---|
[2851] | 2845 | ! do iz = 1,nz |
---|
| 2846 | ! ak0 = 2.5*4.4E-32*(t(iz)/300.)**(-1.3) |
---|
| 2847 | ! ak1 = 4.7E-11*(t(iz)/300.)**(-0.2) |
---|
| 2848 | |
---|
| 2849 | ! rate = (ak0*conc(iz))/(1. + ak0*conc(iz)/ak1) |
---|
| 2850 | ! xpo = 1./(1. + alog10((ak0*conc(iz))/ak1)**2) |
---|
| 2851 | ! c011(iz) = rate*0.6**xpo |
---|
| 2852 | ! end do |
---|
| 2853 | |
---|
| 2854 | ! jpl 2019 |
---|
| 2855 | |
---|
[2187] | 2856 | do iz = 1,nz |
---|
[2851] | 2857 | ak0 = 2.4*5.3e-32*(t(iz)/298.)**(-1.8) |
---|
| 2858 | ak1 = 9.5e-11*(t(iz)/298.)**(0.4) |
---|
[2187] | 2859 | |
---|
| 2860 | rate = (ak0*conc(iz))/(1. + ak0*conc(iz)/ak1) |
---|
| 2861 | xpo = 1./(1. + alog10((ak0*conc(iz))/ak1)**2) |
---|
| 2862 | c011(iz) = rate*0.6**xpo |
---|
| 2863 | end do |
---|
| 2864 | |
---|
| 2865 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2866 | v_4(:,nb_reaction_4) = c011(:) |
---|
| 2867 | |
---|
| 2868 | !--- c012: o + h2o2 -> oh + ho2 |
---|
| 2869 | |
---|
| 2870 | ! jpl 2003 |
---|
| 2871 | |
---|
| 2872 | c012(:) = 1.4E-12*exp(-2000./t(:)) |
---|
| 2873 | |
---|
| 2874 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2875 | v_4(:,nb_reaction_4) = c012(:) |
---|
| 2876 | |
---|
| 2877 | !--- c013: oh + oh -> h2o + o |
---|
| 2878 | |
---|
| 2879 | ! jpl 2006 |
---|
| 2880 | |
---|
| 2881 | c013(:) = 1.8E-12 |
---|
| 2882 | |
---|
| 2883 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 2884 | v_3(:,nb_reaction_3) = c013(:) |
---|
| 2885 | |
---|
| 2886 | !--- c014: oh + o3 -> ho2 + o2 |
---|
| 2887 | |
---|
| 2888 | ! jpl 2003 |
---|
| 2889 | |
---|
| 2890 | c014(:) = 1.7E-12*exp(-940./t(:)) |
---|
| 2891 | |
---|
| 2892 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2893 | v_4(:,nb_reaction_4) = c014(:) |
---|
| 2894 | |
---|
| 2895 | !--- c015: ho2 + o3 -> oh + o2 + o2 |
---|
| 2896 | |
---|
| 2897 | ! jpl 2003 |
---|
| 2898 | |
---|
| 2899 | c015(:) = 1.0E-14*exp(-490./t(:)) |
---|
| 2900 | |
---|
| 2901 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2902 | v_4(:,nb_reaction_4) = c015(:) |
---|
| 2903 | |
---|
| 2904 | !--- c016: ho2 + ho2 + co2 -> h2o2 + o2 + co2 |
---|
| 2905 | |
---|
[2843] | 2906 | ! jpl 2011 |
---|
[2187] | 2907 | |
---|
| 2908 | c016(:) = 2.5*2.1E-33*exp(920./t(:))*conc(:) |
---|
| 2909 | |
---|
| 2910 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 2911 | v_3(:,nb_reaction_3) = c016(:) |
---|
| 2912 | |
---|
| 2913 | !--- c017: oh + oh + co2 -> h2o2 + co2 |
---|
| 2914 | |
---|
| 2915 | ! jpl 2003 |
---|
| 2916 | |
---|
| 2917 | do iz = 1,nz |
---|
| 2918 | ak0 = 2.5*6.9E-31*(t(iz)/300.)**(-1.0) |
---|
| 2919 | ak1 = 2.6E-11*(t(iz)/300.)**(0.0) |
---|
| 2920 | |
---|
| 2921 | rate = (ak0*conc(iz))/(1. + ak0*conc(iz)/ak1) |
---|
| 2922 | xpo = 1./(1. + alog10((ak0*conc(iz))/ak1)**2) |
---|
| 2923 | c017(iz) = rate*0.6**xpo |
---|
| 2924 | end do |
---|
| 2925 | |
---|
| 2926 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 2927 | v_3(:,nb_reaction_3) = c017(:) |
---|
| 2928 | |
---|
| 2929 | !--- c018: h + h + co2 -> h2 + co2 |
---|
| 2930 | |
---|
| 2931 | ! baulch et al., 2005 |
---|
| 2932 | |
---|
| 2933 | c018(:) = 2.5*1.8E-30*(t(:)**(-1.0))*conc(:) |
---|
| 2934 | |
---|
| 2935 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 2936 | v_3(:,nb_reaction_3) = c018(:) |
---|
| 2937 | |
---|
| 2938 | !---------------------------------------------------------------------- |
---|
| 2939 | ! reactions des composes azotes |
---|
| 2940 | !---------------------------------------------------------------------- |
---|
| 2941 | |
---|
| 2942 | !--- d001: no2 + o -> no + o2 |
---|
| 2943 | |
---|
| 2944 | ! jpl 2006 |
---|
| 2945 | |
---|
[2851] | 2946 | ! d001(:) = 5.1e-12*exp(210./t(:)) |
---|
[2187] | 2947 | |
---|
[2851] | 2948 | ! jpl 2019 |
---|
| 2949 | |
---|
| 2950 | ! For the sake of simplicity, it is assumed that the association |
---|
| 2951 | ! yield (kf) gives the same product as the chemical activation yield |
---|
| 2952 | ! (kca). Thus the only products are no + o2. There is no production |
---|
| 2953 | ! of no3. |
---|
| 2954 | |
---|
| 2955 | do iz = 1,nz |
---|
| 2956 | |
---|
| 2957 | ! association |
---|
| 2958 | |
---|
| 2959 | k0 = 2.5*3.4e-31*(298./t(iz))**(1.6) |
---|
| 2960 | kinf = 2.3e-11*(298./t(iz))**(0.2) |
---|
| 2961 | |
---|
| 2962 | kf = (kinf*k0*conc(iz)/(kinf + k0*conc(iz))) & |
---|
| 2963 | *0.6**(1. + (log10(k0*conc(iz)/kinf))**2.)**(-1.0) |
---|
| 2964 | |
---|
| 2965 | ! chemical acitvation |
---|
| 2966 | |
---|
| 2967 | kint = 5.3e-12*exp(200./t(iz)) |
---|
| 2968 | |
---|
| 2969 | kca = kint*(1. - kf/kinf) |
---|
| 2970 | |
---|
| 2971 | ! total : association + chemical activation |
---|
| 2972 | |
---|
| 2973 | d001(iz) = kf + kca |
---|
| 2974 | |
---|
| 2975 | end do |
---|
| 2976 | |
---|
[2795] | 2977 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2978 | v_4(:,nb_reaction_4) = d001(:) |
---|
| 2979 | |
---|
[2187] | 2980 | !--- d002: no + o3 -> no2 + o2 |
---|
| 2981 | |
---|
| 2982 | ! jpl 2006 |
---|
| 2983 | |
---|
[2795] | 2984 | d002(:) = 3.0e-12*exp(-1500./t(:)) |
---|
[2187] | 2985 | |
---|
[2795] | 2986 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 2987 | v_4(:,nb_reaction_4) = d002(:) |
---|
| 2988 | |
---|
[2187] | 2989 | !--- d003: no + ho2 -> no2 + oh |
---|
| 2990 | |
---|
[2795] | 2991 | ! jpl 2011 |
---|
[2187] | 2992 | |
---|
[2851] | 2993 | ! d003(:) = 3.3e-12*exp(270./t(:)) |
---|
[2187] | 2994 | |
---|
[2851] | 2995 | ! jpl 2019 |
---|
| 2996 | |
---|
| 2997 | d003(:) = 3.44e-12*exp(270./t(:)) |
---|
| 2998 | |
---|
[2795] | 2999 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3000 | v_4(:,nb_reaction_4) = d003(:) |
---|
| 3001 | |
---|
| 3002 | |
---|
| 3003 | !--- d004: n + no -> n2 + o |
---|
| 3004 | |
---|
| 3005 | ! jpl 2011 |
---|
| 3006 | |
---|
| 3007 | d004(:) = 2.1e-11*exp(100./t(:)) |
---|
| 3008 | |
---|
| 3009 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3010 | v_4(:,nb_reaction_4) = d004(:) |
---|
| 3011 | |
---|
| 3012 | !--- d005: n + o2 -> no + o |
---|
| 3013 | |
---|
| 3014 | ! jpl 2011 |
---|
| 3015 | |
---|
[2851] | 3016 | ! d005(:) = 1.5e-11*exp(-3600./t(:)) |
---|
[2795] | 3017 | |
---|
[2851] | 3018 | ! jpl 2019 |
---|
| 3019 | |
---|
| 3020 | d005(:) = 3.3e-12*exp(-3150./t(:)) |
---|
| 3021 | |
---|
[2795] | 3022 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3023 | v_4(:,nb_reaction_4) = d005(:) |
---|
| 3024 | |
---|
| 3025 | !--- d006: no2 + h -> no + oh |
---|
| 3026 | |
---|
| 3027 | ! jpl 2011 |
---|
| 3028 | |
---|
[2851] | 3029 | ! d006(:) = 4.0e-10*exp(-340./t(:)) |
---|
[2795] | 3030 | |
---|
[2851] | 3031 | ! jpl 2019 |
---|
| 3032 | |
---|
| 3033 | d006(:) = 1.35e-10 |
---|
| 3034 | |
---|
[2795] | 3035 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3036 | v_4(:,nb_reaction_4) = d006(:) |
---|
| 3037 | |
---|
| 3038 | !--- d007: n + o -> no |
---|
| 3039 | |
---|
[2851] | 3040 | d007(:) = 1.9e-17*(300./t(:))**(0.5)*exp(1-(0.57/(t(:)**(0.5)))) |
---|
[2795] | 3041 | |
---|
| 3042 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3043 | v_4(:,nb_reaction_4) = d007(:) |
---|
| 3044 | |
---|
| 3045 | ind_norec = nb_reaction_4 |
---|
| 3046 | |
---|
| 3047 | !--- d008: n + ho2 -> no + oh |
---|
| 3048 | |
---|
| 3049 | ! brune et al., j. chem. phys., 87, 1983 |
---|
| 3050 | |
---|
| 3051 | d008(:) = 2.19e-11 |
---|
| 3052 | |
---|
| 3053 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3054 | v_4(:,nb_reaction_4) = d008(:) |
---|
| 3055 | |
---|
| 3056 | !--- d009: n + oh -> no + h |
---|
| 3057 | |
---|
| 3058 | ! atkinson et al., j. phys. chem. ref. data, 18, 881, 1989 |
---|
| 3059 | |
---|
| 3060 | d009(:) = 3.8e-11*exp(85./t(:)) |
---|
| 3061 | |
---|
| 3062 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3063 | v_4(:,nb_reaction_4) = d009(:) |
---|
| 3064 | |
---|
| 3065 | !--- d010: n2d + o -> n + o |
---|
| 3066 | |
---|
| 3067 | ! herron, j. phys. chem. ref. data, 1999 |
---|
| 3068 | |
---|
| 3069 | d010(:) = 3.3e-12*exp(-260./t(:)) |
---|
| 3070 | |
---|
| 3071 | nb_phot = nb_phot + 1 |
---|
| 3072 | v_phot(:,nb_phot) = d010(:)*c(:,i_o) |
---|
| 3073 | |
---|
| 3074 | !--- d011: n2d + n2 -> n + n2 |
---|
| 3075 | |
---|
| 3076 | ! herron, j. phys. chem. ref. data, 1999 |
---|
| 3077 | |
---|
| 3078 | d011(:) = 1.7e-14 |
---|
| 3079 | |
---|
| 3080 | nb_phot = nb_phot + 1 |
---|
| 3081 | v_phot(:,nb_phot) = d011(:)*c(:,i_n2) |
---|
| 3082 | |
---|
| 3083 | !--- d012: n2d + co2 -> no + co |
---|
| 3084 | |
---|
| 3085 | ! herron, j. phys. chem. ref. data, 1999 |
---|
| 3086 | |
---|
| 3087 | d012(:) = 3.6e-13 |
---|
| 3088 | |
---|
| 3089 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3090 | v_4(:,nb_reaction_4) = d012(:) |
---|
| 3091 | |
---|
| 3092 | !--- d013: n + o + co2 -> no + co2 |
---|
[2925] | 3093 | |
---|
| 3094 | ! Campbell & Trush, 1966 |
---|
| 3095 | |
---|
| 3096 | d013(:) = 2.5 * conc(:) * 1.83e-32 * (298./t(:))**0.5 |
---|
[2795] | 3097 | |
---|
| 3098 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3099 | v_4(:,nb_reaction_4) = d013(:) |
---|
| 3100 | |
---|
[2925] | 3101 | !--- d014: n2d + co -> n + co |
---|
| 3102 | |
---|
| 3103 | ! herron, j. phys. chem. ref. data, 1999 |
---|
| 3104 | |
---|
| 3105 | d014(:) = 1.9e-12 |
---|
| 3106 | |
---|
| 3107 | nb_phot = nb_phot + 1 |
---|
| 3108 | v_phot(:,nb_phot) = d014(:)*c(:,i_co) |
---|
[2187] | 3109 | !---------------------------------------------------------------------- |
---|
| 3110 | ! reactions des composes carbones |
---|
| 3111 | !---------------------------------------------------------------------- |
---|
| 3112 | |
---|
| 3113 | !--- e001: oh + co -> co2 + h |
---|
| 3114 | |
---|
[2795] | 3115 | ! jpl 2015 |
---|
[2187] | 3116 | |
---|
[2851] | 3117 | ! do iz = 1,nz |
---|
[2187] | 3118 | |
---|
[2795] | 3119 | ! branch 1 : oh + co -> h + co2 |
---|
[2187] | 3120 | |
---|
[2851] | 3121 | ! rate1 = 1.5e-13*(t(iz)/300.)**(0.0) |
---|
[2187] | 3122 | |
---|
[2795] | 3123 | ! branch 2 : oh + co + m -> hoco + m |
---|
[2187] | 3124 | |
---|
[2851] | 3125 | ! ak0 = 5.9e-33*(t(iz)/300.)**(-1.0) |
---|
| 3126 | ! ak1 = 1.1e-12*(t(iz)/300.)**(1.3) |
---|
| 3127 | ! rate2 = (ak0*conc(iz))/(1. + ak0*conc(iz)/ak1) |
---|
| 3128 | ! xpo = 1./(1. + alog10((ak0*conc(iz))/ak1)**2) |
---|
[2187] | 3129 | |
---|
[2851] | 3130 | ! e001(iz) = rate1 + rate2*0.6**xpo |
---|
| 3131 | ! end do |
---|
[2187] | 3132 | |
---|
| 3133 | ! joshi et al., 2006 |
---|
| 3134 | |
---|
[2795] | 3135 | ! do iz = 1,nz |
---|
| 3136 | ! k1a0 = 1.34*2.5*conc(iz) & |
---|
| 3137 | ! *1/(1/(3.62E-26*t(iz)**(-2.739)*exp(-20./t(iz))) & |
---|
| 3138 | ! + 1/(6.48E-33*t(iz)**(0.14)*exp(-57./t(iz)))) ! typo in paper corrected |
---|
| 3139 | ! k1b0 = 1.17E-19*t(iz)**(2.053)*exp(139./t(iz)) & |
---|
| 3140 | ! + 9.56E-12*t(iz)**(-0.664)*exp(-167./t(iz)) |
---|
| 3141 | ! k1ainf = 1.52E-17*t(iz)**(1.858)*exp(28.8/t(iz)) & |
---|
| 3142 | ! + 4.78E-8*t(iz)**(-1.851)*exp(-318./t(iz)) |
---|
| 3143 | ! x = k1a0/(k1ainf - k1b0) |
---|
| 3144 | ! y = k1b0/(k1ainf - k1b0) |
---|
| 3145 | ! fc = 0.628*exp(-1223./t(iz)) + (1. - 0.628)*exp(-39./t(iz)) & |
---|
| 3146 | ! + exp(-t(iz)/255.) |
---|
| 3147 | ! fx = fc**(1./(1. + (alog(x))**2)) ! typo in paper corrected |
---|
| 3148 | ! k1a = k1a0*((1. + y)/(1. + x))*fx |
---|
| 3149 | ! k1b = k1b0*(1./(1.+x))*fx |
---|
| 3150 | ! e001(iz) = k1a + k1b |
---|
| 3151 | ! end do |
---|
[2187] | 3152 | |
---|
[2851] | 3153 | ! jpl 2019 |
---|
| 3154 | |
---|
| 3155 | do iz = 1,nz |
---|
| 3156 | |
---|
| 3157 | ! association |
---|
| 3158 | |
---|
| 3159 | k0 = 2.5*6.9e-33*(398./t(iz))**(2.1) |
---|
| 3160 | kinf = 1.1e-12*(298./t(iz))**(-1.3) |
---|
| 3161 | |
---|
| 3162 | kf = (kinf*k0*conc(iz)/(kinf + k0*conc(iz))) & |
---|
| 3163 | *0.6**(1. + (log10(k0*conc(iz)/kinf))**2.)**(-1.0) |
---|
| 3164 | |
---|
| 3165 | ! chemical activation |
---|
| 3166 | |
---|
| 3167 | kint = 1.85e-13*exp(-65/t(iz)) |
---|
| 3168 | |
---|
| 3169 | kca = kint*(1. - kf/kinf) |
---|
| 3170 | |
---|
| 3171 | ! total : association + chemical activation |
---|
| 3172 | |
---|
| 3173 | e001(iz) = kf + kca |
---|
| 3174 | |
---|
| 3175 | end do |
---|
| 3176 | |
---|
[2187] | 3177 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3178 | v_4(:,nb_reaction_4) = e001(:) |
---|
| 3179 | |
---|
| 3180 | !--- e002: o + co + m -> co2 + m |
---|
| 3181 | |
---|
| 3182 | ! tsang and hampson, 1986. |
---|
| 3183 | |
---|
| 3184 | e002(:) = 2.5*6.5E-33*exp(-2184./t(:))*conc(:) |
---|
| 3185 | |
---|
| 3186 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3187 | v_4(:,nb_reaction_4) = e002(:) |
---|
| 3188 | |
---|
| 3189 | !---------------------------------------------------------------------- |
---|
| 3190 | ! reactions des composes chlores |
---|
| 3191 | !---------------------------------------------------------------------- |
---|
| 3192 | |
---|
| 3193 | !--- f001: hcl + o(1d) -> oh + cl |
---|
| 3194 | |
---|
| 3195 | ! jpl 2011 |
---|
| 3196 | |
---|
| 3197 | f001(:) = 1.0E-10 |
---|
| 3198 | |
---|
| 3199 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3200 | v_4(:,nb_reaction_4) = f001(:) |
---|
| 3201 | |
---|
| 3202 | !--- f002: hcl + o(1d) -> h + clo |
---|
| 3203 | |
---|
| 3204 | ! jpl 2011 |
---|
| 3205 | |
---|
| 3206 | f002(:) = 3.6E-11 |
---|
| 3207 | |
---|
| 3208 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3209 | v_4(:,nb_reaction_4) = f002(:) |
---|
| 3210 | |
---|
| 3211 | !--- f003: hcl + o -> oh + cl |
---|
| 3212 | |
---|
| 3213 | ! jpl 2006 |
---|
| 3214 | |
---|
| 3215 | f003(:) = 1.0E-11*exp(-3300./t(:)) |
---|
| 3216 | |
---|
| 3217 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3218 | v_4(:,nb_reaction_4) = f003(:) |
---|
| 3219 | |
---|
| 3220 | !--- f004: hcl + oh -> h2o + cl |
---|
| 3221 | |
---|
[2843] | 3222 | ! jpl 2009 |
---|
[2187] | 3223 | |
---|
| 3224 | f004(:) = 1.8E-12*exp(-250./t(:)) |
---|
| 3225 | |
---|
| 3226 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3227 | v_4(:,nb_reaction_4) = f004(:) |
---|
| 3228 | |
---|
| 3229 | !--- f005: clo + o -> cl + o2 |
---|
| 3230 | |
---|
| 3231 | ! jpl 2006 |
---|
| 3232 | |
---|
| 3233 | f005(:) = 2.8E-11*exp(85./t(:)) |
---|
| 3234 | |
---|
| 3235 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3236 | v_4(:,nb_reaction_4) = f005(:) |
---|
| 3237 | |
---|
| 3238 | !--- f006: clo + oh -> cl + ho2 |
---|
| 3239 | |
---|
| 3240 | ! jpl 2006 |
---|
| 3241 | |
---|
| 3242 | f006(:) = 7.4E-12*exp(270./t(:)) |
---|
| 3243 | |
---|
| 3244 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3245 | v_4(:,nb_reaction_4) = f006(:) |
---|
| 3246 | |
---|
| 3247 | !--- f007: clo + oh -> hcl + o2 |
---|
| 3248 | |
---|
| 3249 | ! jpl 2006 |
---|
| 3250 | |
---|
| 3251 | f007(:) = 6.0E-13*exp(230./t(:)) |
---|
| 3252 | |
---|
| 3253 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3254 | v_4(:,nb_reaction_4) = f007(:) |
---|
| 3255 | |
---|
| 3256 | !--- f008: cl + h2 -> hcl + h |
---|
| 3257 | |
---|
| 3258 | ! jpl 2006 |
---|
| 3259 | |
---|
| 3260 | f008(:) = 3.05E-11*exp(-2270./t(:)) |
---|
| 3261 | |
---|
| 3262 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3263 | v_4(:,nb_reaction_4) = f008(:) |
---|
| 3264 | |
---|
| 3265 | !--- f009: cl + o3 -> clo + o2 |
---|
| 3266 | |
---|
| 3267 | ! jpl 2006 |
---|
| 3268 | |
---|
| 3269 | f009(:) = 2.3E-11*exp(-200./t(:)) |
---|
| 3270 | |
---|
| 3271 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3272 | v_4(:,nb_reaction_4) = f009(:) |
---|
| 3273 | |
---|
| 3274 | !--- f010: cl + ho2 -> clo + oh |
---|
| 3275 | |
---|
[2843] | 3276 | ! jpl 2009 |
---|
[2187] | 3277 | |
---|
| 3278 | f010(:) = 3.6E-11*exp(-375./t(:)) |
---|
| 3279 | |
---|
| 3280 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3281 | v_4(:,nb_reaction_4) = f010(:) |
---|
| 3282 | |
---|
| 3283 | !--- f011: cl + ho2 -> hcl + o2 |
---|
| 3284 | |
---|
[2843] | 3285 | ! jpl 2009 |
---|
[2187] | 3286 | |
---|
| 3287 | f011(:) = 1.4E-11*exp(270./t(:)) |
---|
| 3288 | |
---|
| 3289 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3290 | v_4(:,nb_reaction_4) = f011(:) |
---|
| 3291 | |
---|
| 3292 | !--- f012: cl + h2o2 -> hcl + ho2 |
---|
| 3293 | |
---|
| 3294 | ! jpl 2006 |
---|
| 3295 | |
---|
| 3296 | f012(:) = 1.1E-11*exp(-980./t(:)) |
---|
| 3297 | |
---|
| 3298 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3299 | v_4(:,nb_reaction_4) = f012(:) |
---|
| 3300 | |
---|
| 3301 | !--- f013: cl + co + co2 -> clco + co2 |
---|
| 3302 | |
---|
| 3303 | ! jpl 2011 + nicovich et al., j. phys. chem., 1990 |
---|
| 3304 | |
---|
| 3305 | f013(:) = 3.2*1.3E-33*(t(:)/300.)**(-3.8)*conc(:) |
---|
| 3306 | |
---|
| 3307 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3308 | v_4(:,nb_reaction_4) = f013(:) |
---|
| 3309 | |
---|
| 3310 | !--- f014: clco + co2 -> cl + co + co2 |
---|
| 3311 | |
---|
| 3312 | ! jpl 2011 |
---|
| 3313 | |
---|
| 3314 | ! deq(:) = 3.2*3.5E-25*exp(3730./t(:)) |
---|
| 3315 | |
---|
| 3316 | ! mills, 1998 |
---|
| 3317 | |
---|
| 3318 | deq(:) = 1.6E-25*exp(4000./t(:)) |
---|
| 3319 | |
---|
| 3320 | f014(:) = f013(:)/(deq(:)*conc(:)) |
---|
| 3321 | |
---|
| 3322 | nb_phot = nb_phot + 1 |
---|
| 3323 | v_phot(:,nb_phot) = f014(:)*conc(:) |
---|
| 3324 | |
---|
| 3325 | ! do iz = 1, nz |
---|
| 3326 | ! print*, z(iz), t(iz), f013(iz), f014(iz), v_phot(iz,nb_phot) |
---|
| 3327 | ! end do |
---|
| 3328 | ! stop |
---|
| 3329 | |
---|
| 3330 | !--- f015: clco + o2 + m -> clco3 + m |
---|
| 3331 | |
---|
| 3332 | ! yung and demore, icarus, 51, 199-247, 1982. |
---|
| 3333 | |
---|
| 3334 | f015(:) = 5.7E-15*exp(500./t(:))*conc(:) & |
---|
| 3335 | /(1.e17 + 0.05*conc(:)) |
---|
| 3336 | |
---|
| 3337 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3338 | v_4(:,nb_reaction_4) = f015(:) |
---|
| 3339 | |
---|
| 3340 | !--- f016: clco3 + cl -> cl + clo + co2 |
---|
| 3341 | |
---|
| 3342 | ! yung and demore, icarus, 51, 199-247, 1982. |
---|
| 3343 | |
---|
| 3344 | ! decomposee en : |
---|
| 3345 | ! 0.5 clco3 + 0.5 cl -> cl + 0.5 co2 |
---|
| 3346 | ! 0.5 clco3 + 0.5 cl -> clo + 0.5 co2 |
---|
| 3347 | |
---|
| 3348 | f016(:) = 1.0E-11 |
---|
| 3349 | |
---|
| 3350 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3351 | v_4(:,nb_reaction_4) = f016(:) |
---|
| 3352 | |
---|
| 3353 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3354 | v_4(:,nb_reaction_4) = f016(:) |
---|
| 3355 | |
---|
| 3356 | !--- f017: clco3 + o -> cl + o2 + co2 |
---|
| 3357 | |
---|
| 3358 | ! yung and demore, icarus, 51, 199-247, 1982. |
---|
| 3359 | |
---|
| 3360 | ! decomposee en : |
---|
| 3361 | ! 0.5 clco3 + 0.5 o -> cl |
---|
| 3362 | ! 0.5 clco3 + 0.5 o -> o2 + co2 |
---|
| 3363 | |
---|
| 3364 | f017(:) = 1.0E-11 |
---|
| 3365 | |
---|
| 3366 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3367 | v_4(:,nb_reaction_4) = f017(:) |
---|
| 3368 | |
---|
| 3369 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3370 | v_4(:,nb_reaction_4) = f017(:) |
---|
| 3371 | |
---|
| 3372 | !--- f018: clo + ho2 -> hocl + o2 |
---|
| 3373 | |
---|
[2851] | 3374 | ! jpl 2019 |
---|
[2187] | 3375 | |
---|
[2851] | 3376 | f018(:) = 2.6E-12*exp(290./t(:)) |
---|
| 3377 | |
---|
[2187] | 3378 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3379 | v_4(:,nb_reaction_4) = f018(:) |
---|
| 3380 | |
---|
| 3381 | !--- f019: oh + hocl -> h2o + clo |
---|
| 3382 | |
---|
| 3383 | f019(:) = 3.0E-12*exp(-500./t(:)) |
---|
| 3384 | |
---|
| 3385 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3386 | v_4(:,nb_reaction_4) = f019(:) |
---|
| 3387 | |
---|
| 3388 | !--- f020: o + hocl -> oh + clo |
---|
| 3389 | |
---|
| 3390 | f020(:) = 1.7E-13 |
---|
| 3391 | |
---|
| 3392 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3393 | v_4(:,nb_reaction_4) = f020(:) |
---|
| 3394 | |
---|
| 3395 | !--- f021: cl + cl + co2 -> cl2 + co2 |
---|
| 3396 | |
---|
| 3397 | ! donohoue et al., j. phys. chem. a, 109, 7732-7741, 2005 |
---|
| 3398 | |
---|
| 3399 | ! f021(:) = 2.5*8.4E-33*exp(850.*(1./t(:) - 1./298.))*conc(:) |
---|
| 3400 | |
---|
| 3401 | ! valeur utilisee par Zhang et al., 2011: |
---|
| 3402 | |
---|
| 3403 | f021(:) = 2.6E-33*exp(900./t(:))*conc(:) |
---|
| 3404 | |
---|
| 3405 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 3406 | v_3(:,nb_reaction_3) = f021(:) |
---|
| 3407 | |
---|
| 3408 | !--- f022: clco + o -> cl + co2 |
---|
| 3409 | |
---|
| 3410 | ! yung et al., icarus, 1982 (estimated) |
---|
| 3411 | |
---|
| 3412 | f022(:) = 3.0E-11 |
---|
| 3413 | |
---|
| 3414 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3415 | v_4(:,nb_reaction_4) = f022(:) |
---|
| 3416 | |
---|
| 3417 | !--- f023: cl2 + o(1d) -> cl + clo |
---|
| 3418 | |
---|
| 3419 | ! jpl 2011 |
---|
| 3420 | |
---|
| 3421 | f023(:) = 2.0E-10 |
---|
| 3422 | |
---|
| 3423 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3424 | v_4(:,nb_reaction_4) = f023(:) |
---|
| 3425 | |
---|
| 3426 | !--- f024: cl2 + h -> hcl + cl |
---|
| 3427 | |
---|
| 3428 | ! baulch et al., j. phys. chem. ref. data, 1981 |
---|
| 3429 | |
---|
| 3430 | f024(:) = 1.43E-10*exp(-591./t(:)) |
---|
| 3431 | |
---|
| 3432 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3433 | v_4(:,nb_reaction_4) = f024(:) |
---|
| 3434 | |
---|
| 3435 | !--- f025: cl + clco -> cl2 + co |
---|
| 3436 | |
---|
| 3437 | ! baulch et al., j. phys. chem. ref. data, 1981 |
---|
| 3438 | |
---|
| 3439 | f025(:) = 2.16E-9*exp(-1670./t(:)) |
---|
| 3440 | |
---|
| 3441 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3442 | v_4(:,nb_reaction_4) = f025(:) |
---|
| 3443 | |
---|
| 3444 | !--- f026: clco + clco -> cocl2 + co |
---|
| 3445 | |
---|
| 3446 | ! zhang et al., icarus, 2011 (estimated) |
---|
| 3447 | |
---|
| 3448 | f026(:) = 5.0E-11 |
---|
| 3449 | |
---|
| 3450 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 3451 | v_3(:,nb_reaction_3) = f026(:) |
---|
| 3452 | |
---|
| 3453 | !--- f027: cl + so2 + co2 -> clso2 + co2 |
---|
| 3454 | |
---|
| 3455 | ! mills, phd, 1998 |
---|
| 3456 | |
---|
| 3457 | f027(:) = 1.3E-34*exp(940./t(:))*conc(:) |
---|
| 3458 | |
---|
| 3459 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3460 | v_4(:,nb_reaction_4) = f027(:) |
---|
| 3461 | |
---|
| 3462 | !--- f028: clso2 + o -> so2 + clo |
---|
| 3463 | |
---|
| 3464 | ! mills, phd, 1998 |
---|
| 3465 | |
---|
| 3466 | f028(:) = 1.0E-11 |
---|
| 3467 | |
---|
| 3468 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3469 | v_4(:,nb_reaction_4) = f028(:) |
---|
| 3470 | |
---|
| 3471 | !--- f029: clso2 + h -> so2 + hcl |
---|
| 3472 | |
---|
| 3473 | ! mills, phd, 1998 |
---|
| 3474 | |
---|
| 3475 | f029(:) = 1.0E-11 |
---|
| 3476 | |
---|
| 3477 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3478 | v_4(:,nb_reaction_4) = f029(:) |
---|
| 3479 | |
---|
| 3480 | !--- f030: clso2 + clso2 -> cl2 + so2 + so2 |
---|
| 3481 | |
---|
| 3482 | ! moses et al. 2002 |
---|
| 3483 | |
---|
| 3484 | f030(:) = 5.0E-13 |
---|
| 3485 | |
---|
| 3486 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 3487 | v_3(:,nb_reaction_3) = f030(:) |
---|
| 3488 | |
---|
| 3489 | !--- f031: cl + o + co2 -> clo + co2 |
---|
| 3490 | |
---|
| 3491 | ! yung and demore, 1999 (estimated) |
---|
| 3492 | |
---|
| 3493 | f031(:) = 5.0E-32*conc(:) |
---|
| 3494 | |
---|
| 3495 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3496 | v_4(:,nb_reaction_4) = f031(:) |
---|
| 3497 | |
---|
| 3498 | !--- f032: cl2 + o -> clo + cl |
---|
| 3499 | |
---|
| 3500 | ! mills, phd, 1998 |
---|
| 3501 | |
---|
| 3502 | f032(:) = 7.4E-12*exp(-1650./t(:)) |
---|
| 3503 | |
---|
| 3504 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3505 | v_4(:,nb_reaction_4) = f032(:) |
---|
| 3506 | |
---|
| 3507 | !--- f033: clco + oh -> hocl + co |
---|
| 3508 | |
---|
| 3509 | ! mills, phd, 1998 |
---|
| 3510 | |
---|
| 3511 | f033(:) = 1.5E-10 |
---|
| 3512 | |
---|
| 3513 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3514 | v_4(:,nb_reaction_4) = f033(:) |
---|
| 3515 | |
---|
| 3516 | !--- f034: cl2 + oh -> cl + hocl |
---|
| 3517 | |
---|
| 3518 | ! jpl 2011 |
---|
| 3519 | |
---|
| 3520 | f034(:) = 2.6E-12*exp(-1100./t(:)) |
---|
| 3521 | |
---|
| 3522 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3523 | v_4(:,nb_reaction_4) = f034(:) |
---|
| 3524 | |
---|
| 3525 | !--- f035: clco + o -> co + clo |
---|
| 3526 | |
---|
| 3527 | ! yung and demore, 1982 |
---|
| 3528 | |
---|
| 3529 | f035(:) = 3.0E-12 |
---|
| 3530 | |
---|
| 3531 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3532 | v_4(:,nb_reaction_4) = f035(:) |
---|
| 3533 | |
---|
| 3534 | !--- f036: clco + cl2 -> cocl2 + cl |
---|
| 3535 | |
---|
| 3536 | ! ohta, bull. chem. soc. jpn., 1983 |
---|
| 3537 | |
---|
| 3538 | f036(:) = 6.45E-2*f015(:) |
---|
| 3539 | |
---|
| 3540 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3541 | v_4(:,nb_reaction_4) = f036(:) |
---|
| 3542 | |
---|
| 3543 | !--- f037: hcl + h -> h2 + cl |
---|
| 3544 | |
---|
| 3545 | ! mills, phd, 1998 |
---|
| 3546 | |
---|
| 3547 | f037(:) = 1.5E-11*exp(-1750./t(:)) |
---|
| 3548 | |
---|
| 3549 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3550 | v_4(:,nb_reaction_4) = f037(:) |
---|
| 3551 | |
---|
| 3552 | !--- f038: clco + h -> hcl + co |
---|
| 3553 | |
---|
| 3554 | ! yung and demore, 1982 |
---|
| 3555 | |
---|
| 3556 | f038(:) = 1.0E-11 |
---|
| 3557 | |
---|
| 3558 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3559 | v_4(:,nb_reaction_4) = f038(:) |
---|
| 3560 | |
---|
| 3561 | !--- f039: cl + h + m -> hcl + m |
---|
| 3562 | |
---|
| 3563 | ! yung and demore, 1982 (estimate) |
---|
| 3564 | |
---|
| 3565 | f039(:) = 1.0E-32*conc(:) |
---|
| 3566 | |
---|
| 3567 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3568 | v_4(:,nb_reaction_4) = f039(:) |
---|
| 3569 | |
---|
| 3570 | !---------------------------------------------------------------------- |
---|
| 3571 | ! reactions des composes soufres |
---|
| 3572 | !---------------------------------------------------------------------- |
---|
| 3573 | |
---|
| 3574 | !--- g001: s + o2 -> so + o |
---|
| 3575 | |
---|
[2843] | 3576 | ! jpl 2015 |
---|
[2187] | 3577 | |
---|
| 3578 | g001(:) = 1.6E-12*exp(100./t(:)) |
---|
| 3579 | |
---|
| 3580 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3581 | v_4(:,nb_reaction_4) = g001(:) |
---|
| 3582 | |
---|
| 3583 | !--- g002: s + o3 -> so + o2 |
---|
| 3584 | |
---|
[2843] | 3585 | ! jpl 2015 |
---|
| 3586 | |
---|
[2187] | 3587 | g002(:) = 1.2E-11 |
---|
| 3588 | |
---|
| 3589 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3590 | v_4(:,nb_reaction_4) = g002(:) |
---|
| 3591 | |
---|
| 3592 | !--- g003: so + o2 -> so2 + o |
---|
| 3593 | |
---|
[2843] | 3594 | ! jpl 2015 |
---|
[2187] | 3595 | |
---|
[2843] | 3596 | g003(:) = 1.6E-13*exp(-2280./t(:)) |
---|
[2187] | 3597 | |
---|
| 3598 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3599 | v_4(:,nb_reaction_4) = g003(:) |
---|
| 3600 | |
---|
| 3601 | !--- g004: so + o3 -> so2 + o2 |
---|
| 3602 | |
---|
[2843] | 3603 | ! jpl 2015 |
---|
| 3604 | |
---|
[2187] | 3605 | g004(:) = 3.4E-12*exp(-1100./t(:)) |
---|
| 3606 | |
---|
| 3607 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3608 | v_4(:,nb_reaction_4) = g004(:) |
---|
| 3609 | |
---|
| 3610 | !--- g005: so + oh -> so2 + h |
---|
| 3611 | |
---|
[2851] | 3612 | ! jpl 2019 |
---|
[2843] | 3613 | |
---|
[2851] | 3614 | g005(:) = 2.6E-11*exp(330./t(:)) |
---|
[2187] | 3615 | |
---|
| 3616 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3617 | v_4(:,nb_reaction_4) = g005(:) |
---|
| 3618 | |
---|
| 3619 | !--- g006: s + oh -> so + h |
---|
| 3620 | |
---|
[2843] | 3621 | ! jpl 2015 |
---|
| 3622 | |
---|
[2187] | 3623 | g006(:) = 6.6E-11 |
---|
| 3624 | |
---|
| 3625 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3626 | v_4(:,nb_reaction_4) = g006(:) |
---|
| 3627 | |
---|
| 3628 | !--- g007: so + o + co2 -> so2 + co2 |
---|
| 3629 | |
---|
| 3630 | ! singleton and cvetanovic, j. phys. chem. ref. data, 1988 |
---|
| 3631 | ! measured with co2 as third body |
---|
| 3632 | |
---|
| 3633 | do iz = 1,nz |
---|
| 3634 | ak0 = 4.2E-30 |
---|
| 3635 | ak1 = 5.3E-11 |
---|
| 3636 | |
---|
| 3637 | rate = (ak0*conc(iz))/(1. + ak0*conc(iz)/ak1) |
---|
| 3638 | xpo = 1./(1. + alog10((ak0*conc(iz))/ak1)**2) |
---|
| 3639 | g007(iz) = rate*0.6**xpo |
---|
| 3640 | end do |
---|
| 3641 | |
---|
| 3642 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3643 | v_4(:,nb_reaction_4) = g007(:) |
---|
| 3644 | |
---|
| 3645 | !--- g008: so + ho2 -> so2 + oh |
---|
| 3646 | |
---|
| 3647 | g008(:) = 2.8E-11 |
---|
| 3648 | |
---|
| 3649 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3650 | v_4(:,nb_reaction_4) = g008(:) |
---|
| 3651 | |
---|
| 3652 | !--- g009: so2 + o + co2 -> so3 + co2 |
---|
| 3653 | |
---|
[2862] | 3654 | ! Naidoo et al., Proceedings of the Combustion Institute, |
---|
| 3655 | ! 30, 1219-1225, 2005 |
---|
| 3656 | ! Also recommended by jpl 2019 with a simpler expression (fc = 0.6) |
---|
| 3657 | ! |
---|
| 3658 | ! Factor of 5 for third-body efficiency of co2 to be confirmed! |
---|
[2187] | 3659 | |
---|
[2862] | 3660 | do iz = 1,nz |
---|
| 3661 | ak0 = 5.*9.5e-23*(t(iz)**(-3.0))*exp(-2400./t(iz)) |
---|
| 3662 | ak1 = 6.1e-13*exp(-850./t(iz)) |
---|
| 3663 | rate = (ak0*conc(iz))/(1. + ak0*conc(iz)/ak1) |
---|
| 3664 | xpo = 1./(1. + alog10((ak0*conc(iz))/ak1)**2) |
---|
| 3665 | fc = 0.558*exp(-t(iz)/316.) + 0.442*exp(-t(iz)/7442.) |
---|
| 3666 | g009(iz) = rate*fc**xpo |
---|
| 3667 | end do |
---|
[2851] | 3668 | |
---|
[2187] | 3669 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3670 | v_4(:,nb_reaction_4) = g009(:) |
---|
| 3671 | |
---|
| 3672 | !--- g010: s + o + co2 -> so + co2 |
---|
| 3673 | |
---|
| 3674 | ! zhang et al., icarus, 2011 |
---|
| 3675 | |
---|
| 3676 | g010(:) = 1.5E-34*exp(900./t(:))*conc(:) |
---|
| 3677 | |
---|
| 3678 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3679 | v_4(:,nb_reaction_4) = g010(:) |
---|
| 3680 | |
---|
| 3681 | !--- g011: so3 + h2o + M -> h2so4 + M |
---|
| 3682 | !--- avec M = h2o |
---|
| 3683 | |
---|
| 3684 | DO iz=1,nz |
---|
| 3685 | ! jpl 2011 |
---|
| 3686 | ! g011(:) = 8.5E-21*exp(6540./t(:))*c(:,i_h2o) |
---|
| 3687 | g011(iz) = 2.26E-23*MAX(t(iz),100.)*exp(6540./MAX(t(iz),100.)) & |
---|
| 3688 | *c(iz,i_h2o) |
---|
| 3689 | g011(iz) = g011(iz)*1.0E-20 |
---|
| 3690 | ! g011(:) = 0. ! SANS H2SO4 |
---|
| 3691 | ENDDO |
---|
| 3692 | |
---|
| 3693 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3694 | v_4(:,nb_reaction_4) = g011(:) |
---|
| 3695 | |
---|
| 3696 | !--- g012: so + clo -> so2 + cl |
---|
| 3697 | |
---|
| 3698 | ! jpl 2011 |
---|
| 3699 | |
---|
| 3700 | g012(:) = 2.8E-11 |
---|
| 3701 | |
---|
| 3702 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3703 | v_4(:,nb_reaction_4) = g012(:) |
---|
| 3704 | |
---|
| 3705 | !--- g013: so + so3 -> so2 + so2 |
---|
| 3706 | |
---|
| 3707 | ! chung et al., int. j. chem. kinet., 1975 |
---|
| 3708 | |
---|
| 3709 | g013(:) = 2.0E-15 |
---|
| 3710 | |
---|
| 3711 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3712 | v_4(:,nb_reaction_4) = g013(:) |
---|
| 3713 | |
---|
| 3714 | !--- g014: so3 + o -> so2 + o2 |
---|
| 3715 | |
---|
| 3716 | ! jacob and winkler, j. chem. soc. faraday trans. 1, 1972 |
---|
| 3717 | |
---|
| 3718 | g014(:) = 2.32E-16*exp(-487./t(:)) |
---|
| 3719 | |
---|
| 3720 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3721 | v_4(:,nb_reaction_4) = g014(:) |
---|
| 3722 | |
---|
| 3723 | !--- g015: so + so + co2 -> s2o2 + co2 |
---|
| 3724 | |
---|
| 3725 | ! herron and huie, chem. phys. lett., 1980. |
---|
| 3726 | |
---|
| 3727 | do iz = 1,nz |
---|
| 3728 | ak0 = 2.5*4.4E-31 |
---|
| 3729 | ak1 = 1.0E-11 |
---|
| 3730 | |
---|
| 3731 | rate = (ak0*conc(iz))/(1. + ak0*conc(iz)/ak1) |
---|
| 3732 | xpo = 1./(1. + alog10((ak0*conc(iz))/ak1)**2) |
---|
| 3733 | g015(iz) = rate*0.6**xpo |
---|
| 3734 | end do |
---|
| 3735 | |
---|
| 3736 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 3737 | v_3(:,nb_reaction_3) = g015(:) |
---|
| 3738 | |
---|
| 3739 | !--- g016: s2o2 + co2 -> so + so + co2 |
---|
| 3740 | |
---|
| 3741 | ! mills, phd, 1998 |
---|
| 3742 | |
---|
| 3743 | deq(:) = 2.5*1.0E-28*exp(6000./t(:)) |
---|
| 3744 | |
---|
| 3745 | g016(:) = g015(:)/(deq(:)*conc(:)) |
---|
| 3746 | |
---|
| 3747 | nb_phot = nb_phot + 1 |
---|
| 3748 | v_phot(:,nb_phot) = g016(:)*conc(:) |
---|
| 3749 | |
---|
| 3750 | !--- g017: clco3 + so -> cl + so2 + co2 |
---|
| 3751 | |
---|
| 3752 | ! mills, phd, 1998 |
---|
| 3753 | |
---|
| 3754 | ! decomposee en : |
---|
| 3755 | ! 0.5 clco3 + 0.5 so -> cl |
---|
| 3756 | ! 0.5 clco3 + 0.5 so -> so2 + co2 |
---|
| 3757 | |
---|
| 3758 | g017(:) = 1.0E-11 |
---|
| 3759 | |
---|
| 3760 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3761 | v_4(:,nb_reaction_4) = g017(:) |
---|
| 3762 | |
---|
| 3763 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3764 | v_4(:,nb_reaction_4) = g017(:) |
---|
| 3765 | |
---|
| 3766 | !--- g018: s + co + co2 -> ocs + co2 |
---|
| 3767 | |
---|
| 3768 | ! zhang et al., icarus, 2011 (estimate?) |
---|
| 3769 | |
---|
| 3770 | g018(:) = 2.5*4.0E-33*exp(-1940./t(:))*conc(:) |
---|
| 3771 | |
---|
| 3772 | ! g018(:) = 0.0E+0 |
---|
| 3773 | |
---|
| 3774 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3775 | v_4(:,nb_reaction_4) = g018(:) |
---|
| 3776 | |
---|
| 3777 | !--- g019: clco + s -> ocs + cl |
---|
| 3778 | |
---|
| 3779 | ! zhang et al., icarus, 2011 |
---|
| 3780 | |
---|
| 3781 | g019(:) = 3.0E-12 |
---|
| 3782 | |
---|
| 3783 | ! g019(:) = 0.0E+0 |
---|
| 3784 | |
---|
| 3785 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3786 | v_4(:,nb_reaction_4) = g019(:) |
---|
| 3787 | |
---|
| 3788 | !--- g020: so2 + oh + co2 -> hso3 + co2 |
---|
| 3789 | |
---|
| 3790 | ! jpl 2011 |
---|
| 3791 | |
---|
| 3792 | do iz = 1,nz |
---|
| 3793 | ak0 = 2.5*3.3E-31*(t(iz)/300.)**(-4.3) |
---|
| 3794 | ak1 = 1.6E-12 |
---|
| 3795 | |
---|
| 3796 | rate = (ak0*conc(iz))/(1. + ak0*conc(iz)/ak1) |
---|
| 3797 | xpo = 1./(1. + alog10((ak0*conc(iz))/ak1)**2) |
---|
| 3798 | g020(iz) = rate*0.6**xpo |
---|
| 3799 | end do |
---|
| 3800 | |
---|
| 3801 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3802 | v_4(:,nb_reaction_4) = g020(:) |
---|
| 3803 | |
---|
| 3804 | !--- g021: hso3 + o2 -> ho2 + so3 |
---|
| 3805 | |
---|
| 3806 | ! jpl 2011 |
---|
| 3807 | |
---|
| 3808 | g021(:) = 1.3E-12*exp(-330./t(:)) |
---|
| 3809 | |
---|
| 3810 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 3811 | v_4(:,nb_reaction_4) = g021(:) |
---|
| 3812 | |
---|
| 3813 | !--- g022: s + s + co2 -> s2 + co2 |
---|
| 3814 | |
---|
| 3815 | ! nicholas et al., j. chem. soc. faraday trans. 1, 1979 |
---|
| 3816 | |
---|
| 3817 | do iz = 1,nz |
---|
| 3818 | ak0 = 1.19E-29 |
---|
| 3819 | ak1 = 1.0E-10 |
---|
| 3820 | |
---|
| 3821 | rate = (ak0*conc(iz))/(1. + ak0*conc(iz)/ak1) |
---|
| 3822 | xpo = 1./(1. + alog10((ak0*conc(iz))/ak1)**2) |
---|
| 3823 | g022(iz) = rate*0.6**xpo |
---|
| 3824 | end do |
---|
| 3825 | |
---|
| 3826 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
| 3827 | v_3(:,nb_reaction_3) = g022(:) |
---|
| 3828 | |
---|
| 3829 | |
---|
[2925] | 3830 | !--- g023: s2 + o -> so + s |
---|
[2187] | 3831 | |
---|
| 3832 | ! zhang et al., icarus, 2011 |
---|
| 3833 | |
---|
[2925] | 3834 | g023(:) = 2.2E-11*exp(-84./t(:)) |
---|
[2187] | 3835 | |
---|
| 3836 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2949] | 3837 | v_4(:,nb_reaction_4) = g023(:) |
---|
[2187] | 3838 | |
---|
[2925] | 3839 | !--- g024: s + ocs -> s2 + co |
---|
[2187] | 3840 | |
---|
| 3841 | ! lu et al., j. chem. phys., 2006 |
---|
| 3842 | |
---|
[2925] | 3843 | g024(:) = 6.63E-20*(t(:)**2.57)*exp(-1180./t(:)) |
---|
[2187] | 3844 | |
---|
| 3845 | ! g025(:) = 0.0E+0 |
---|
| 3846 | |
---|
| 3847 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2925] | 3848 | v_4(:,nb_reaction_4) = g024(:) |
---|
[2187] | 3849 | |
---|
[2925] | 3850 | !--- g025: ocs + o -> so + co |
---|
[2187] | 3851 | |
---|
| 3852 | ! atkinson et al., 2004 |
---|
| 3853 | |
---|
[2925] | 3854 | g025(:) = 1.60E-11*exp(-2150./t(:)) |
---|
[2187] | 3855 | |
---|
| 3856 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2925] | 3857 | v_4(:,nb_reaction_4) = g025(:) |
---|
[2187] | 3858 | |
---|
[2925] | 3859 | !--- g026: s + so3 -> so2 + so |
---|
[2187] | 3860 | |
---|
| 3861 | ! moses et al., 2002 |
---|
| 3862 | |
---|
[2925] | 3863 | g026(:) = 1.0E-16 |
---|
[2187] | 3864 | |
---|
| 3865 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2925] | 3866 | v_4(:,nb_reaction_4) = g026(:) |
---|
[2187] | 3867 | |
---|
[2925] | 3868 | !--- g027: s + ho2 -> so + oh |
---|
[2187] | 3869 | |
---|
| 3870 | ! yung and demore, 1982 |
---|
| 3871 | |
---|
[2925] | 3872 | g027(:) = 3.0E-11*exp(200./t(:)) |
---|
[2187] | 3873 | |
---|
| 3874 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2925] | 3875 | v_4(:,nb_reaction_4) = g027(:) |
---|
[2187] | 3876 | |
---|
[2925] | 3877 | !--- g028: s + clo -> so + cl |
---|
[2187] | 3878 | |
---|
| 3879 | ! moses et al., 2002 |
---|
| 3880 | |
---|
[2925] | 3881 | g028(:) = 4.0E-11 |
---|
[2187] | 3882 | |
---|
| 3883 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2925] | 3884 | v_4(:,nb_reaction_4) = g028(:) |
---|
[2187] | 3885 | |
---|
[2925] | 3886 | !--- g029: h2so4 + h2o -> so3 + h2o + h2o |
---|
[2187] | 3887 | |
---|
| 3888 | ! krasnopolsky , 2007 |
---|
| 3889 | |
---|
[2925] | 3890 | g029(:) = 7.0E-14*exp(-5170./t(:)) |
---|
[2187] | 3891 | |
---|
| 3892 | ! g030(:) = g011(:)/(deq(:)*c(:,i_h2o)) |
---|
| 3893 | ! g030(:) = 0.0E+0 |
---|
| 3894 | |
---|
| 3895 | nb_phot = nb_phot + 1 |
---|
[2925] | 3896 | v_phot(:,nb_phot) = g029(:)*c(:,i_h2o) |
---|
[2187] | 3897 | ! v_phot(:,nb_phot) = 0.0E+0 |
---|
| 3898 | |
---|
[2925] | 3899 | !--- g030: so3 + ocs -> s2o2 + co2 |
---|
[2187] | 3900 | |
---|
| 3901 | ! krasnopolsky , 2007 |
---|
| 3902 | |
---|
[2925] | 3903 | g030(:) = 1.0E-11*exp(-10000./t(:)) |
---|
[2187] | 3904 | ! g031(:) = 0.0E+0 |
---|
| 3905 | |
---|
| 3906 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2925] | 3907 | v_4(:,nb_reaction_4) = g030(:) |
---|
[2187] | 3908 | |
---|
[2925] | 3909 | !--- g031: s2o2 + ocs -> co + so2 + s2 |
---|
[2187] | 3910 | |
---|
| 3911 | ! decomposee en |
---|
| 3912 | ! 0.5 s2o2 + 0.5 ocs -> co |
---|
| 3913 | ! 0.5 s2o2 + 0.5 ocs -> so2 + s2 |
---|
| 3914 | |
---|
| 3915 | ! krasnopolsky , 2007 |
---|
| 3916 | |
---|
[2925] | 3917 | g031(:) = 1.0E-20 |
---|
[2187] | 3918 | ! g032(:) = 0.0E+0 |
---|
| 3919 | |
---|
| 3920 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2925] | 3921 | v_4(:,nb_reaction_4) = g031(:) |
---|
[2187] | 3922 | |
---|
| 3923 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2925] | 3924 | v_4(:,nb_reaction_4) = g031(:) |
---|
[2187] | 3925 | |
---|
[2925] | 3926 | ! g032: so + so -> so2 + s |
---|
[2187] | 3927 | ! Krasnopolsky 2012 from Martinez & Heron 1983 or Moses et al 2002 |
---|
| 3928 | |
---|
[2925] | 3929 | ! g032(:) = 3.5E-15 |
---|
| 3930 | g032(:) =1.0E-12*exp(-1700.0/t(:)) |
---|
[2187] | 3931 | |
---|
| 3932 | nb_reaction_3 = nb_reaction_3 + 1 |
---|
[2925] | 3933 | v_3(:,nb_reaction_3) = g032(:) |
---|
[2187] | 3934 | |
---|
| 3935 | !---------------------------------------------------------------------- |
---|
| 3936 | ! heterogeneous chemistry |
---|
| 3937 | !---------------------------------------------------------------------- |
---|
| 3938 | |
---|
| 3939 | if (hetero_ice) then |
---|
| 3940 | |
---|
| 3941 | ! k = (surface*v*gamma)/4 (s-1) |
---|
| 3942 | ! v = 100*sqrt(8rt/(pi*m)) (cm s-1) |
---|
| 3943 | |
---|
| 3944 | !--- h001: ho2 + ice -> products |
---|
| 3945 | |
---|
| 3946 | ! cooper and abbatt, 1996: gamma = 0.025 |
---|
| 3947 | |
---|
| 3948 | gam = 0.025 |
---|
| 3949 | h001(:) = surfice1d(:)*1.E-8 & |
---|
| 3950 | *100.*sqrt(8.*8.31*t(:)/(33.E-3*pi))*gam/4. |
---|
| 3951 | |
---|
| 3952 | ! h002: oh + ice -> products |
---|
| 3953 | |
---|
| 3954 | ! cooper and abbatt, 1996: gamma = 0.03 |
---|
| 3955 | |
---|
| 3956 | gam = 0.03 |
---|
| 3957 | h002(:) = surfice1d(:)*1.E-8 & |
---|
| 3958 | *100.*sqrt(8.*8.31*t(:)/(17.E-3*pi))*gam/4. |
---|
| 3959 | |
---|
| 3960 | !--- h003: h2o2 + ice -> products |
---|
| 3961 | |
---|
| 3962 | ! gamma = 0. test value |
---|
| 3963 | |
---|
| 3964 | gam = 0. |
---|
| 3965 | h003(:) = surfice1d(:)*1.E-8 & |
---|
| 3966 | *100.*sqrt(8.*8.31*t(:)/(34.E-3*pi))*gam/4. |
---|
| 3967 | else |
---|
| 3968 | h001(:) = 0. |
---|
| 3969 | h002(:) = 0. |
---|
| 3970 | h003(:) = 0. |
---|
| 3971 | end if |
---|
| 3972 | |
---|
| 3973 | nb_phot = nb_phot + 1 |
---|
| 3974 | v_phot(:,nb_phot) = h001(:) |
---|
| 3975 | |
---|
| 3976 | nb_phot = nb_phot + 1 |
---|
| 3977 | v_phot(:,nb_phot) = h002(:) |
---|
| 3978 | |
---|
| 3979 | nb_phot = nb_phot + 1 |
---|
| 3980 | v_phot(:,nb_phot) = h003(:) |
---|
| 3981 | |
---|
| 3982 | ! do iz = 1,nz |
---|
| 3983 | ! print*, z(iz), surfice1d(iz), h001(iz), h002(iz) |
---|
| 3984 | ! end do |
---|
| 3985 | ! stop |
---|
| 3986 | |
---|
| 3987 | ! print*, 'krates : nb_phot = ', nb_phot |
---|
| 3988 | ! print*, 'krates : nb_reaction_4 = ', nb_reaction_4 |
---|
| 3989 | ! print*, 'krates : nb_reaction_3 = ', nb_reaction_3 |
---|
| 3990 | ! stop |
---|
| 3991 | |
---|
| 3992 | !---------------------------------------------------------------------- |
---|
[2836] | 3993 | ! ionospheric reactions |
---|
| 3994 | ! only if ok_ionchem=true |
---|
| 3995 | !---------------------------------------------------------------------- |
---|
| 3996 | |
---|
| 3997 | if (ok_ionchem) then |
---|
| 3998 | |
---|
| 3999 | !--- i001: co2+ + o2 -> o2+ + co2 |
---|
| 4000 | |
---|
| 4001 | ! aninich, j. phys. chem. ref. data 1993 |
---|
| 4002 | |
---|
| 4003 | i001(:) = 5.5e-11*(300./t_elect(:))**0.5 |
---|
| 4004 | |
---|
| 4005 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4006 | v_4(:,nb_reaction_4) = i001(:) |
---|
| 4007 | |
---|
| 4008 | !--- i002: co2+ + o -> o+ + co2 |
---|
| 4009 | |
---|
| 4010 | ! UMIST database |
---|
| 4011 | |
---|
| 4012 | i002(:) = 9.6e-11 |
---|
| 4013 | |
---|
| 4014 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4015 | v_4(:,nb_reaction_4) = i002(:) |
---|
| 4016 | |
---|
| 4017 | !--- i003: co2+ + o -> o2+ + co |
---|
| 4018 | |
---|
| 4019 | ! UMIST database |
---|
| 4020 | |
---|
| 4021 | i003(:) = 1.64e-10 |
---|
| 4022 | |
---|
| 4023 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4024 | v_4(:,nb_reaction_4) = i003(:) |
---|
| 4025 | |
---|
| 4026 | !--- i004: o2+ + e- -> o + o |
---|
| 4027 | |
---|
| 4028 | ! Alge et al., J. Phys. B, At. Mol. Phys. 1983 |
---|
| 4029 | !i004(:) = 2.0e-7*(300./t_elect(:))**0.7 |
---|
| 4030 | |
---|
| 4031 | do iz = 1,nz |
---|
| 4032 | if (t_elect(iz)<1200.) then |
---|
| 4033 | i004(iz) = 2.0e-7*(300./t_elect(iz))**0.7 |
---|
| 4034 | else |
---|
| 4035 | i004(iz) = 7.4e-8*(1200./t_elect(iz))**0.56 |
---|
| 4036 | end if |
---|
| 4037 | end do |
---|
| 4038 | |
---|
| 4039 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4040 | v_4(:,nb_reaction_4) = i004(:) |
---|
| 4041 | |
---|
| 4042 | !--- i005: o+ + co2 -> o2+ + co |
---|
| 4043 | |
---|
| 4044 | ! UMIST database |
---|
| 4045 | |
---|
| 4046 | i005(:) = 9.4e-10 |
---|
| 4047 | |
---|
| 4048 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4049 | v_4(:,nb_reaction_4) = i005(:) |
---|
| 4050 | |
---|
| 4051 | |
---|
| 4052 | !--- i006: co2+ + e- -> co + o |
---|
| 4053 | |
---|
| 4054 | ! UMIST database |
---|
| 4055 | |
---|
| 4056 | i006(:) = 3.8e-7*(300./t_elect(:))**0.5 |
---|
| 4057 | |
---|
| 4058 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4059 | v_4(:,nb_reaction_4) = i006(:) |
---|
| 4060 | |
---|
| 4061 | |
---|
| 4062 | !--- i007: co2+ + no -> no+ + co2 |
---|
| 4063 | |
---|
| 4064 | ! UMIST database |
---|
| 4065 | |
---|
| 4066 | i007(:) = 1.2e-10 |
---|
| 4067 | |
---|
| 4068 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4069 | v_4(:,nb_reaction_4) = i007(:) |
---|
| 4070 | |
---|
| 4071 | !--- i008: o2+ + no -> no+ + o2 |
---|
| 4072 | |
---|
| 4073 | ! UMIST database |
---|
| 4074 | |
---|
| 4075 | i008(:) = 4.6e-10 |
---|
| 4076 | |
---|
| 4077 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4078 | v_4(:,nb_reaction_4) = i008(:) |
---|
| 4079 | |
---|
| 4080 | !--- i009: o2+ + n2 -> no+ + no |
---|
| 4081 | |
---|
| 4082 | ! Fox & Sung 2001 |
---|
| 4083 | |
---|
| 4084 | i009(:) = 1.0e-15 |
---|
| 4085 | |
---|
| 4086 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4087 | v_4(:,nb_reaction_4) = i009(:) |
---|
| 4088 | |
---|
| 4089 | !--- i010: o2+ + n -> no+ + o |
---|
| 4090 | |
---|
| 4091 | ! Fox & Sung 2001 |
---|
| 4092 | |
---|
| 4093 | i010(:) = 1.0e-10 |
---|
| 4094 | |
---|
| 4095 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4096 | v_4(:,nb_reaction_4) = i010(:) |
---|
| 4097 | |
---|
| 4098 | !--- i011: o+ + n2 -> no+ + n |
---|
| 4099 | |
---|
| 4100 | ! Fox & Sung 2001 |
---|
| 4101 | |
---|
| 4102 | i011(:) = 1.2e-12 * (300./t_elect(:))**0.45 |
---|
| 4103 | |
---|
| 4104 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4105 | v_4(:,nb_reaction_4) = i011(:) |
---|
| 4106 | |
---|
| 4107 | !--- i012: no+ + e -> n + o |
---|
| 4108 | |
---|
| 4109 | ! UMIST database |
---|
| 4110 | |
---|
| 4111 | i012(:) = 4.3e-7*(300./t_elect(:))**0.37 |
---|
| 4112 | |
---|
| 4113 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4114 | v_4(:,nb_reaction_4) = i012(:) |
---|
| 4115 | |
---|
| 4116 | |
---|
| 4117 | !--- i013: co+ + co2 -> co2+ + co |
---|
| 4118 | |
---|
| 4119 | ! UMIST database |
---|
| 4120 | |
---|
| 4121 | i013(:) = 1.0e-9 |
---|
| 4122 | |
---|
| 4123 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4124 | v_4(:,nb_reaction_4) = i013(:) |
---|
| 4125 | |
---|
| 4126 | |
---|
| 4127 | !--- i014: co+ + o -> o+ + co |
---|
| 4128 | |
---|
| 4129 | ! UMIST database |
---|
| 4130 | |
---|
| 4131 | i014(:) = 1.4e-10 |
---|
| 4132 | |
---|
| 4133 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4134 | v_4(:,nb_reaction_4) = i014(:) |
---|
| 4135 | |
---|
| 4136 | !--- i015: c+ + co2 -> co+ + co |
---|
| 4137 | |
---|
| 4138 | ! UMIST database |
---|
| 4139 | |
---|
| 4140 | i015(:) = 1.1e-9 |
---|
| 4141 | |
---|
| 4142 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4143 | v_4(:,nb_reaction_4) = i015(:) |
---|
| 4144 | |
---|
| 4145 | |
---|
| 4146 | !--- i016: N2+ + co2 -> co2+ + N2 |
---|
| 4147 | |
---|
| 4148 | ! Fox & Song 2001 |
---|
| 4149 | |
---|
| 4150 | i016(:) = 9.0e-10*(300./t_elect(:))**0.23 |
---|
| 4151 | |
---|
| 4152 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4153 | v_4(:,nb_reaction_4) = i016(:) |
---|
| 4154 | |
---|
| 4155 | |
---|
| 4156 | !--- i017: N2+ + o -> no+ + N |
---|
| 4157 | |
---|
| 4158 | ! Fox & Song 2001 |
---|
| 4159 | |
---|
| 4160 | i017(:) = 1.33e-10*(300./t_elect(:))**0.44 |
---|
| 4161 | |
---|
| 4162 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4163 | v_4(:,nb_reaction_4) = i017(:) |
---|
| 4164 | |
---|
| 4165 | !--- i018: N2+ + co -> co+ + N2 |
---|
| 4166 | |
---|
| 4167 | ! UMIST |
---|
| 4168 | |
---|
| 4169 | i018(:) = 7.4e-11 |
---|
| 4170 | |
---|
| 4171 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4172 | v_4(:,nb_reaction_4) = i018(:) |
---|
| 4173 | |
---|
| 4174 | !--- i019: N2+ + e -> N + N |
---|
| 4175 | |
---|
| 4176 | ! UMIST |
---|
| 4177 | |
---|
[2927] | 4178 | i019(:) = 1.7e-7*(300./t_elect(:))**0.3 |
---|
[2836] | 4179 | |
---|
| 4180 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
[2928] | 4181 | v_4(:,nb_reaction_4) = i019(:) |
---|
[2836] | 4182 | |
---|
| 4183 | !--- i020: N2+ + o -> o+ + N2 |
---|
| 4184 | |
---|
| 4185 | ! Fox & Song 2001 |
---|
| 4186 | |
---|
| 4187 | i020(:) = 7.0e-12*(300./t_elect(:))**0.23 |
---|
| 4188 | |
---|
| 4189 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4190 | v_4(:,nb_reaction_4) = i020(:) |
---|
| 4191 | |
---|
| 4192 | !--- i021: N+ + co2 -> co2+ + N |
---|
| 4193 | |
---|
| 4194 | ! UMIST |
---|
| 4195 | |
---|
| 4196 | i021(:) = 7.5e-10 |
---|
| 4197 | |
---|
| 4198 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4199 | v_4(:,nb_reaction_4) = i021(:) |
---|
| 4200 | |
---|
| 4201 | !--- i022: CO+ + H -> H+ + CO |
---|
| 4202 | |
---|
| 4203 | ! Fox & Sung 2001 |
---|
| 4204 | |
---|
| 4205 | i022(:) = 4.0e-10 |
---|
| 4206 | |
---|
| 4207 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4208 | v_4(:,nb_reaction_4) = i022(:) |
---|
| 4209 | |
---|
| 4210 | !--- i023: O+ + H -> H+ + O |
---|
| 4211 | |
---|
| 4212 | ! UMIST |
---|
| 4213 | |
---|
| 4214 | i023(:) = 5.66e-10*((t_elect(:)/300.)**0.36)*exp(8.6/t_elect(:)) |
---|
| 4215 | |
---|
| 4216 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4217 | v_4(:,nb_reaction_4) = i023(:) |
---|
| 4218 | |
---|
| 4219 | !--- i024: H+ + O -> O+ + H |
---|
| 4220 | |
---|
| 4221 | ! UMIST |
---|
| 4222 | |
---|
| 4223 | i024(:) = 6.86e-10*((t_elect(:)/300.)**0.26)*exp(-224.3/t_elect(:)) |
---|
| 4224 | |
---|
| 4225 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4226 | v_4(:,nb_reaction_4) = i024(:) |
---|
| 4227 | |
---|
| 4228 | !--- i025: CO+ + H2 -> HCO2+ + H |
---|
| 4229 | |
---|
| 4230 | ! UMIST |
---|
| 4231 | |
---|
| 4232 | i025(:) = 9.5e-10 |
---|
| 4233 | |
---|
| 4234 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4235 | v_4(:,nb_reaction_4) = i025(:) |
---|
| 4236 | |
---|
| 4237 | !--- i026: HCO2+ + e -> H + CO2 |
---|
| 4238 | |
---|
| 4239 | ! UMIST |
---|
| 4240 | |
---|
| 4241 | i026(:) = 1.75e-8*((300./t_elect(:))**0.5) |
---|
| 4242 | |
---|
| 4243 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4244 | v_4(:,nb_reaction_4) = i026(:) |
---|
| 4245 | |
---|
| 4246 | !--- i027+i028: HCO2+ + e -> H + O + CO |
---|
| 4247 | |
---|
| 4248 | ! UMIST |
---|
| 4249 | !Reaction splitted in 2: i027: 0.5 (HCO2+ + e-) -> H |
---|
| 4250 | !i028: 0.5 (HCO2+ + e-) -> O + CO |
---|
| 4251 | |
---|
| 4252 | i027(:) = 8.1e-7*((300./t_elect(:))**0.64) |
---|
| 4253 | |
---|
| 4254 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4255 | v_4(:,nb_reaction_4) = i027(:) |
---|
| 4256 | |
---|
| 4257 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4258 | v_4(:,nb_reaction_4) = i027(:) |
---|
| 4259 | |
---|
| 4260 | !--- i029: HCO2+ + e -> OH + CO |
---|
| 4261 | |
---|
| 4262 | ! UMIST |
---|
| 4263 | |
---|
| 4264 | i029(:) = 3.2e-7*((300./t_elect(:))**0.64) |
---|
| 4265 | |
---|
| 4266 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4267 | v_4(:,nb_reaction_4) = i029(:) |
---|
| 4268 | |
---|
| 4269 | !--- i030: HCO2+ + e -> H + CO2 |
---|
| 4270 | |
---|
| 4271 | i030(:) = 6.0e-8*((300./t_elect(:))**0.64) |
---|
| 4272 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4273 | v_4(:,nb_reaction_4) = i030(:) |
---|
| 4274 | |
---|
| 4275 | !--- i031: HCO2+ + O -> HCO+ + O2 |
---|
| 4276 | |
---|
| 4277 | ! UMIST |
---|
| 4278 | |
---|
| 4279 | i031(:) = 1.e-9 |
---|
| 4280 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4281 | v_4(:,nb_reaction_4) = i031(:) |
---|
| 4282 | |
---|
| 4283 | !--- i032: HCO2+ + CO -> HCO+ + CO2 |
---|
| 4284 | |
---|
| 4285 | ! UMIST, from Prassad & Huntress 1980 |
---|
| 4286 | |
---|
| 4287 | i032(:) = 7.8e-10 |
---|
| 4288 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4289 | v_4(:,nb_reaction_4) = i032(:) |
---|
| 4290 | |
---|
| 4291 | !--- i033: H+ + CO2 -> HCO+ + O |
---|
| 4292 | |
---|
| 4293 | ! UMIST, from Smith et al., Int. J. Mass Spectrom. Ion Proc., 117, 457-473(1992) |
---|
| 4294 | |
---|
| 4295 | i033(:) = 3.5e-9 |
---|
| 4296 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4297 | v_4(:,nb_reaction_4) = i033(:) |
---|
| 4298 | |
---|
| 4299 | |
---|
| 4300 | !--- i034: CO2+ + H -> HCO+ + O |
---|
| 4301 | |
---|
| 4302 | ! Seen in Fox 2015, from Borodi et al., Int. J. Mass Spectrom. 280, 218-225, 2009 |
---|
| 4303 | |
---|
| 4304 | i034(:) = 4.5e-10 |
---|
| 4305 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4306 | v_4(:,nb_reaction_4) = i034(:) |
---|
| 4307 | |
---|
| 4308 | !--- i035: CO+ + H2 -> HCO+ + H |
---|
| 4309 | |
---|
| 4310 | !UMIST, from Scott et al., J. Chem. Phys., 106, 3982-3987(1997) |
---|
| 4311 | |
---|
| 4312 | i035(:) = 7.5e-10 |
---|
| 4313 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4314 | v_4(:,nb_reaction_4) = i035(:) |
---|
| 4315 | |
---|
| 4316 | !--- i036: HCO+ + e- -> CO + H |
---|
| 4317 | |
---|
| 4318 | !UMIST, from Mitchell, Phys. Rep., 186, 215 (1990) |
---|
| 4319 | |
---|
| 4320 | i036(:) = 2.4e-7 *((300./t_elect(:))**0.69) |
---|
| 4321 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4322 | v_4(:,nb_reaction_4) = i036(:) |
---|
| 4323 | |
---|
| 4324 | !--- i037: CO2+ + H2O -> H2O+ + CO2 |
---|
| 4325 | |
---|
| 4326 | !UMIST, from Karpas, Z., Anicich, V.G., and Huntress, W.T., Chem. Phys. Lett., 59, 84 (1978) |
---|
| 4327 | |
---|
| 4328 | i037(:) = 2.04e-9 *((300./t_elect(:))**0.5) |
---|
| 4329 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4330 | v_4(:,nb_reaction_4) = i037(:) |
---|
| 4331 | |
---|
| 4332 | !--- i038: CO+ + H2O -> H2O+ + CO |
---|
| 4333 | |
---|
| 4334 | !UMIST, from Huntress, W.T., McEwan, M.J., Karpas, Z., and Anicich, V.G., Astrophys. J. Supp. Series, 44, 481 (1980) |
---|
| 4335 | |
---|
| 4336 | i038(:) = 1.72e-9*((300./t_elect(:))**0.5) |
---|
| 4337 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4338 | v_4(:,nb_reaction_4) = i038(:) |
---|
| 4339 | |
---|
| 4340 | !--- i039: O+ + H2O -> H2O+ + O |
---|
| 4341 | |
---|
| 4342 | !UMIST, from Adams, N.G., Smith, D., and Paulson, J.F., J. Chem. Phys., 72, 288 (1980); Smith, D., Adams, N.G., and Miller, T.M., J. Chem. Phys.., 69, 308 (1978) |
---|
| 4343 | |
---|
| 4344 | i039(:) = 3.2e-9*((300./t_elect(:))**0.5) |
---|
| 4345 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4346 | v_4(:,nb_reaction_4) = i039(:) |
---|
| 4347 | |
---|
| 4348 | !--- i040: N2+ + H2O -> H2O+ + N2 |
---|
| 4349 | |
---|
| 4350 | !UMIST, from Adams, N.G., Smith, D., and Paulson, J.F., J. Chem. Phys., 72, 288 (1980); Smith, D., Adams, N.G., and Miller, T.M., J. Chem. Phys.., 69, 308 (1978) |
---|
| 4351 | |
---|
| 4352 | i040(:) = 2.3e-9*((300./t_elect(:))**0.5) |
---|
| 4353 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4354 | v_4(:,nb_reaction_4) = i040(:) |
---|
| 4355 | |
---|
| 4356 | !--- i041: N+ + H2O -> H2O+ + N |
---|
| 4357 | |
---|
| 4358 | !UMIST, from Adams, N.G., Smith, D., and Paulson, J.F., J. Chem. Phys., 72, 288 (1980); Smith, D., Adams, N.G., and Miller, T.M., J. Chem. Phys.., 69, 308 (1978) |
---|
| 4359 | |
---|
| 4360 | i041(:) = 2.8e-9*((300./t_elect(:))**0.5) |
---|
| 4361 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4362 | v_4(:,nb_reaction_4) = i041(:) |
---|
| 4363 | |
---|
| 4364 | |
---|
| 4365 | !--- i042: H+ + H2O -> H2O+ + H |
---|
| 4366 | |
---|
| 4367 | !UMIST, from D. Smith, P. Spanel and C. A. Mayhew, Int. J. Mass Spectrom. Ion Proc., 117, 457-473(1992) |
---|
| 4368 | |
---|
| 4369 | i042(:) = 6.9e-9*((300./t_elect(:))**0.5) |
---|
| 4370 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4371 | v_4(:,nb_reaction_4) = i042(:) |
---|
| 4372 | |
---|
| 4373 | !--- i043: H2O+ + O2 -> O2+ + H2O |
---|
| 4374 | |
---|
| 4375 | !UMIST, from A. B. Raksit and P. Warneck, J. Chem. Soc. Faraday Trans., 76, 1084-1092(1980) |
---|
| 4376 | |
---|
| 4377 | i043(:) = 4.6e-10 |
---|
| 4378 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4379 | v_4(:,nb_reaction_4) = i043(:) |
---|
| 4380 | |
---|
| 4381 | !--- i044: H2O+ + CO -> HCO+ + OH |
---|
| 4382 | |
---|
| 4383 | !UMIST, from Jones, J.D.C., Birkinshaw, K., and Twiddy, N.D., Chem. Phys. Lett., 77, 484 (1981) |
---|
| 4384 | |
---|
| 4385 | i044(:) = 5.0e-10 |
---|
| 4386 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4387 | v_4(:,nb_reaction_4) = i044(:) |
---|
| 4388 | |
---|
| 4389 | !--- i045: H2O+ + O -> O2+ + H2 |
---|
| 4390 | |
---|
| 4391 | !UMIST, from Viggiano, A.A, Howarka, F., Albritton, D.L., Fehsenfeld, F.C., Adams, N.G., and Smith, D., Astrophys. J., 236, 492 (1980) |
---|
| 4392 | |
---|
| 4393 | i045(:) = 4.0e-11 |
---|
| 4394 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4395 | v_4(:,nb_reaction_4) = i045(:) |
---|
| 4396 | |
---|
| 4397 | !--- i046: H2O+ + NO -> NO+ + H2O |
---|
| 4398 | |
---|
| 4399 | !UMIST, from A. B. Raksit and P. Warneck, J. Chem. Soc. Faraday Trans., 76, 1084-1092(1980) |
---|
| 4400 | |
---|
| 4401 | i046(:) = 2.7e-10 |
---|
| 4402 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4403 | v_4(:,nb_reaction_4) = i046(:) |
---|
| 4404 | |
---|
| 4405 | !--- i047: H2O+ + e- -> H + H + O |
---|
| 4406 | |
---|
| 4407 | !UMIST, from Rosen, S., Derkatch, A., Semaniak, J., et al., 2000, Far. Disc., 115, 295 |
---|
| 4408 | |
---|
| 4409 | i047(:) = 3.05e-7*((300./t_elect(:))**0.5) |
---|
| 4410 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4411 | v_4(:,nb_reaction_4) = i047(:) |
---|
| 4412 | |
---|
| 4413 | !--- i048: H2O+ + e- -> H + OH |
---|
| 4414 | |
---|
| 4415 | !UMIST, from Rosen, S., Derkatch, A., Semaniak, J., et al., 2000, Far. Disc., 115, 295 |
---|
| 4416 | |
---|
| 4417 | i048(:) = 8.6e-8*((300./t_elect(:))**0.5) |
---|
| 4418 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4419 | v_4(:,nb_reaction_4) = i048(:) |
---|
| 4420 | |
---|
| 4421 | !--- i049: H2O+ + e- -> O + H2 |
---|
| 4422 | |
---|
| 4423 | !UMIST, from Rosen, S., Derkatch, A., Semaniak, J., et al., 2000, Far. Disc., 115, 295 |
---|
| 4424 | |
---|
| 4425 | i049(:) = 3.9e-8*((300./t_elect(:))**0.5) |
---|
| 4426 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4427 | v_4(:,nb_reaction_4) = i049(:) |
---|
| 4428 | |
---|
| 4429 | !--- i050: H2O+ + H2O -> H3O+ + OH |
---|
| 4430 | |
---|
| 4431 | !UMIST, from Huntress, W.T. and Pinizzotto, R.F., J. Chem. Phys., 59, 4742 (1973) |
---|
| 4432 | |
---|
| 4433 | i050(:) = 2.1e-9*((300./t_elect(:))**0.5) |
---|
| 4434 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4435 | v_4(:,nb_reaction_4) = i050(:) |
---|
| 4436 | |
---|
| 4437 | |
---|
| 4438 | !--- i051: H2O+ + H2 -> H3O+ + H |
---|
| 4439 | |
---|
| 4440 | !UMIST, from A. B. Raksit and P. Warneck, J. Chem. Soc. Faraday Trans., 76, 1084-1092(1980) |
---|
| 4441 | |
---|
| 4442 | i051(:) = 6.4e-10 |
---|
| 4443 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4444 | v_4(:,nb_reaction_4) = i051(:) |
---|
| 4445 | |
---|
| 4446 | !--- i052: HCO+ + H2O -> H3O+ + CO |
---|
| 4447 | |
---|
| 4448 | !UMIST, from Adams, N.G., Smith, D., and Grief, D., Int. J. Mass Spectrom. Ion Phys., 26, 405 (1978) |
---|
| 4449 | |
---|
| 4450 | i052(:) = 2.5e-9*((300./t_elect(:))**0.5) |
---|
| 4451 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4452 | v_4(:,nb_reaction_4) = i052(:) |
---|
| 4453 | |
---|
| 4454 | !--- i053: H3O+ + e -> OH + H + H |
---|
| 4455 | |
---|
| 4456 | !UMIST, from Novotny, O. et al., J. Phys. Chem. A 2010, 114, 14, 4870-4874 |
---|
| 4457 | |
---|
| 4458 | i053(:) = 3.05e-7*((300./t_elect(:))**0.5) |
---|
| 4459 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4460 | v_4(:,nb_reaction_4) = i053(:) |
---|
| 4461 | |
---|
| 4462 | !--- i054: H3O+ + e -> H2O + H |
---|
| 4463 | |
---|
| 4464 | !UMIST, from Novotny, O. et al., J. Phys. Chem. A 2010, 114, 14, 4870-4874 |
---|
| 4465 | |
---|
| 4466 | i054(:) = 7.09e-8*((300./t_elect(:))**0.5) |
---|
| 4467 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4468 | v_4(:,nb_reaction_4) = i054(:) |
---|
| 4469 | |
---|
| 4470 | !--- i055: H3O+ + e -> OH + H2 |
---|
| 4471 | |
---|
| 4472 | !UMIST, from Novotny, O. et al., J. Phys. Chem. A 2010, 114, 14, 4870-4874 |
---|
| 4473 | |
---|
| 4474 | i055(:) = 5.37e-8*((300./t_elect(:))**0.5) |
---|
| 4475 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4476 | v_4(:,nb_reaction_4) = i055(:) |
---|
| 4477 | |
---|
| 4478 | !--- i056: H3O+ + e -> O + H2 + H |
---|
| 4479 | |
---|
| 4480 | !UMIST, from Novotny, O. et al., J. Phys. Chem. A 2010, 114, 14, 4870-4874 |
---|
| 4481 | |
---|
| 4482 | i056(:) = 5.6e-9*((300./t_elect(:))**0.5) |
---|
| 4483 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4484 | v_4(:,nb_reaction_4) = i056(:) |
---|
| 4485 | |
---|
| 4486 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4487 | v_4(:,nb_reaction_4) = i056(:) |
---|
| 4488 | |
---|
| 4489 | !--- i057: O+ + H2 -> OH+ + H |
---|
| 4490 | |
---|
| 4491 | !UMIST, from Adams, N.G., Smith, D., and Paulson, J.F., J. Chem. Phys., 72, 288 (1980); Smith, D., Adams, N.G., and Miller, T.M., J. Chem. Phys.., 69, 308 (1978) |
---|
| 4492 | |
---|
| 4493 | i057(:) = 1.7e-9 |
---|
| 4494 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4495 | v_4(:,nb_reaction_4) = i057(:) |
---|
| 4496 | |
---|
| 4497 | !--- i058: OH+ + O -> O2+ + H |
---|
| 4498 | |
---|
| 4499 | !UMIST, from Prasad & Huntress, 1980, ApJS, 43, 1 |
---|
| 4500 | |
---|
| 4501 | i058(:) = 7.1e-10 |
---|
| 4502 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4503 | v_4(:,nb_reaction_4) = i058(:) |
---|
| 4504 | |
---|
| 4505 | !--- i059: OH+ + CO2 -> HCO2+ + O |
---|
| 4506 | |
---|
| 4507 | !UMIST, from Jones, J.D.C., Birkinshaw, K., and Twiddy, N.D., Chem. Phys. Lett., 77, 484 (1981) |
---|
| 4508 | |
---|
| 4509 | i059(:) = 1.44e-9 |
---|
| 4510 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4511 | v_4(:,nb_reaction_4) = i059(:) |
---|
| 4512 | |
---|
| 4513 | !--- i060: OH+ + CO -> HCO+ + O |
---|
| 4514 | |
---|
| 4515 | !UMIST, from Jones, J.D.C., Birkinshaw, K., and Twiddy, N.D., Chem. Phys. Lett., 77, 484 (1981) |
---|
| 4516 | |
---|
| 4517 | i060(:) = 1.05e-9 |
---|
| 4518 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4519 | v_4(:,nb_reaction_4) = i060(:) |
---|
| 4520 | |
---|
| 4521 | !--- i061: OH+ + NO -> NO+ + OH (tasa de reacción UMIST 3.59e-10) |
---|
| 4522 | |
---|
| 4523 | !UMIST, from Jones, J.D.C., Birkinshaw, K., and Twiddy, N.D., Chem. Phys. Lett., 77, 484 (1981) |
---|
| 4524 | |
---|
| 4525 | i061(:) = 3.59e-10 |
---|
| 4526 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4527 | v_4(:,nb_reaction_4) = i061(:) |
---|
| 4528 | |
---|
| 4529 | !--- i062: OH+ + H2 -> H2O+ + H (tasa de reacción UMIST 1.01e-9, |
---|
| 4530 | |
---|
| 4531 | !UMIST, from Jones, J.D.C., Birkinshaw, K., and Twiddy, N.D., Chem. Phys. Lett., 77, 484 (1981) |
---|
| 4532 | |
---|
| 4533 | i062(:) = 1.01e-9 |
---|
| 4534 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4535 | v_4(:,nb_reaction_4) = i062(:) |
---|
| 4536 | |
---|
| 4537 | !--- i063: OH+ + O2 -> O2+ + OH (tasa de reacción UMIST 5.9e-10 |
---|
| 4538 | |
---|
| 4539 | !UMIST, from Jones, J.D.C., Birkinshaw, K., and Twiddy, N.D., Chem. Phys. Lett., 77, 484 (1981) |
---|
| 4540 | |
---|
| 4541 | i063(:) = 5.9e-10 |
---|
| 4542 | nb_reaction_4 = nb_reaction_4 + 1 |
---|
| 4543 | v_4(:,nb_reaction_4) = i063(:) |
---|
| 4544 | |
---|
| 4545 | end if ! ok_ionchem |
---|
| 4546 | |
---|
| 4547 | !---------------------------------------------------------------------- |
---|
[2187] | 4548 | ! reactions avec 02(Dg) |
---|
| 4549 | !---------------------------------------------------------------------- |
---|
| 4550 | |
---|
[2836] | 4551 | !--- j001: O2(Dg) + (CO2 and O) -> O2 + (CO2 and O) + hv |
---|
[2187] | 4552 | |
---|
[2836] | 4553 | ! Krasnopolsky (2010a) for CO2 & Clark and Wayne, 1969 for O (JPL) |
---|
[2187] | 4554 | |
---|
[2836] | 4555 | j001(:) = 1.E-20 * c(:,i_co2) !+ 2.E-16 * c(:,i_o) |
---|
[2187] | 4556 | |
---|
| 4557 | nb_phot = nb_phot + 1 |
---|
[2836] | 4558 | v_phot(:,nb_phot) = j001(:) |
---|
[2187] | 4559 | |
---|
[2836] | 4560 | !--- j002: O2(Dg) -> O2 + hv |
---|
[2187] | 4561 | |
---|
| 4562 | ! Lafferty et al; (1998) |
---|
| 4563 | |
---|
[2836] | 4564 | j002(:) = 2.2E-4 |
---|
[2187] | 4565 | |
---|
| 4566 | nb_phot = nb_phot + 1 |
---|
[2836] | 4567 | v_phot(:,nb_phot) = j002(:) |
---|
[2187] | 4568 | |
---|
[2836] | 4569 | !!! TEST: artificial increase of CO2 photodissociation |
---|
| 4570 | if (tuneupperatm) then |
---|
| 4571 | !-- TuneA |
---|
| 4572 | ! v_phot(65:78,4) = v_phot(65:78,4)*10. |
---|
| 4573 | ! v_phot(60:64,4) = v_phot(60:64,4)*3. |
---|
| 4574 | ! v_phot(55:59,3) = v_phot(55:59,3)*2. |
---|
| 4575 | !-- |
---|
| 4576 | !-- TuneB |
---|
| 4577 | ! v_phot(65:78,4) = v_phot(65:78,4)*10. |
---|
| 4578 | ! v_phot(55:59,3) = v_phot(55:59,3)*5. |
---|
| 4579 | !-- |
---|
| 4580 | !-- TuneC |
---|
| 4581 | ! VCD 1.1 tuning |
---|
| 4582 | ! v_phot(65:78,4) = v_phot(65:78,4)*10. |
---|
| 4583 | ! v_phot(52:59,3) = v_phot(52:59,3)*5. |
---|
| 4584 | !-- |
---|
| 4585 | !-- TuneE |
---|
| 4586 | ! VCD 2.0 tuning |
---|
[2920] | 4587 | ! v_phot(65:nz,4) = v_phot(65:nz,4)*10. ! CO2 + hv ==> O(1D) + CO |
---|
[2836] | 4588 | !-- |
---|
| 4589 | ! VCD 2.1 tuning |
---|
[2920] | 4590 | v_phot(65:nz,4) = v_phot(65:nz,4)*8. ! CO2 + hv ==> O(1D) + CO |
---|
[2836] | 4591 | !-- |
---|
[3035] | 4592 | ! TEST TUNEH |
---|
| 4593 | ! v_phot(62:74,4) = v_phot(62:74,4)*6.5 ! CO2 + hv ==> O(1D) + CO |
---|
| 4594 | !-- |
---|
[2836] | 4595 | ! v_phot(:,4) = v_phot(:,4)*10. |
---|
| 4596 | !do ij=3,4 |
---|
| 4597 | ! v_phot(:,ij) = v_phot(:,ij)*10. |
---|
| 4598 | !end do |
---|
[2920] | 4599 | end if |
---|
[2187] | 4600 | return |
---|
| 4601 | end subroutine krates |
---|
| 4602 | |
---|
| 4603 | !====================================================================== |
---|
| 4604 | |
---|
[2580] | 4605 | subroutine fill_matrix(ilev, mat, prod, loss, lossconc, c, nesp, nlayer, & |
---|
[2187] | 4606 | nb_reaction_3_max, nb_reaction_4_max, nb_phot_max, & |
---|
| 4607 | v_phot, v_3, v_4) |
---|
| 4608 | |
---|
| 4609 | !====================================================================== |
---|
| 4610 | ! filling of the jacobian matrix |
---|
| 4611 | !====================================================================== |
---|
| 4612 | |
---|
| 4613 | use types_asis |
---|
| 4614 | |
---|
| 4615 | implicit none |
---|
| 4616 | |
---|
| 4617 | ! input |
---|
| 4618 | |
---|
| 4619 | integer :: ilev ! level index |
---|
| 4620 | integer :: nesp ! number of species in the chemistry |
---|
| 4621 | integer, intent(in) :: nlayer ! number of atmospheric layers |
---|
| 4622 | integer, intent(in) :: nb_reaction_3_max |
---|
| 4623 | ! number of quadratic reactions |
---|
| 4624 | integer, intent(in) :: nb_reaction_4_max |
---|
| 4625 | ! number of bimolecular reactions |
---|
| 4626 | integer, intent(in) :: nb_phot_max |
---|
| 4627 | ! number of processes treated numerically as photodissociations |
---|
| 4628 | |
---|
[2836] | 4629 | real (kind = 8), dimension(nlayer,nesp) :: c ! number densities |
---|
| 4630 | real (kind = 8), dimension(nlayer, nb_phot_max) :: v_phot |
---|
| 4631 | real (kind = 8), dimension(nlayer,nb_reaction_3_max) :: v_3 |
---|
| 4632 | real (kind = 8), dimension(nlayer,nb_reaction_4_max) :: v_4 |
---|
[2187] | 4633 | |
---|
| 4634 | ! output |
---|
| 4635 | |
---|
[2836] | 4636 | real (kind = 8), dimension(nesp,nesp), intent(out) :: mat ! matrix |
---|
| 4637 | real (kind = 8), dimension(nesp), intent(out) :: prod, loss, lossconc |
---|
[2187] | 4638 | |
---|
| 4639 | ! local |
---|
| 4640 | |
---|
| 4641 | integer :: iesp |
---|
| 4642 | integer :: ind_phot_2,ind_phot_4,ind_phot_6 |
---|
| 4643 | integer :: ind_3_2,ind_3_4,ind_3_6 |
---|
| 4644 | integer :: ind_4_2,ind_4_4,ind_4_6,ind_4_8 |
---|
| 4645 | integer :: iphot,i3,i4 |
---|
| 4646 | |
---|
[2836] | 4647 | real(kind = 8) :: eps, eps_4 ! implicit/explicit coefficient |
---|
[2187] | 4648 | |
---|
| 4649 | ! initialisations |
---|
| 4650 | |
---|
| 4651 | mat(:,:) = 0. |
---|
| 4652 | prod(:) = 0. |
---|
| 4653 | loss(:) = 0. |
---|
[2580] | 4654 | lossconc(:) = 0. |
---|
[2187] | 4655 | |
---|
| 4656 | ! photodissociations |
---|
| 4657 | ! or reactions a + c -> b + c |
---|
| 4658 | ! or reactions a + ice -> b + c |
---|
| 4659 | do iphot = 1,nb_phot_max |
---|
| 4660 | |
---|
| 4661 | ind_phot_2 = indice_phot(iphot)%z2 |
---|
| 4662 | ind_phot_4 = indice_phot(iphot)%z4 |
---|
| 4663 | ind_phot_6 = indice_phot(iphot)%z6 |
---|
| 4664 | |
---|
| 4665 | mat(ind_phot_2,ind_phot_2) = mat(ind_phot_2,ind_phot_2) + indice_phot(iphot)%z1*v_phot(ilev,iphot) |
---|
| 4666 | mat(ind_phot_4,ind_phot_2) = mat(ind_phot_4,ind_phot_2) - indice_phot(iphot)%z3*v_phot(ilev,iphot) |
---|
| 4667 | mat(ind_phot_6,ind_phot_2) = mat(ind_phot_6,ind_phot_2) - indice_phot(iphot)%z5*v_phot(ilev,iphot) |
---|
| 4668 | |
---|
[2580] | 4669 | loss(ind_phot_2) = loss(ind_phot_2) + indice_phot(iphot)%z1*v_phot(ilev,iphot) |
---|
| 4670 | lossconc(ind_phot_2) = lossconc(ind_phot_2) + indice_phot(iphot)%z1*v_phot(ilev,iphot)*c(ilev,ind_phot_2) |
---|
| 4671 | |
---|
| 4672 | prod(ind_phot_4) = prod(ind_phot_4) + indice_phot(iphot)%z3*v_phot(ilev,iphot)*c(ilev,ind_phot_2) |
---|
| 4673 | prod(ind_phot_6) = prod(ind_phot_6) + indice_phot(iphot)%z5*v_phot(ilev,iphot)*c(ilev,ind_phot_2) |
---|
[2187] | 4674 | |
---|
| 4675 | end do |
---|
| 4676 | |
---|
| 4677 | ! reactions a + a -> b + c |
---|
| 4678 | |
---|
| 4679 | do i3 = 1,nb_reaction_3_max |
---|
| 4680 | |
---|
| 4681 | ind_3_2 = indice_3(i3)%z2 |
---|
| 4682 | ind_3_4 = indice_3(i3)%z4 |
---|
| 4683 | ind_3_6 = indice_3(i3)%z6 |
---|
| 4684 | |
---|
| 4685 | mat(ind_3_2,ind_3_2) = mat(ind_3_2,ind_3_2) + indice_3(i3)%z1*v_3(ilev,i3)*c(ilev,ind_3_2) |
---|
| 4686 | mat(ind_3_4,ind_3_2) = mat(ind_3_4,ind_3_2) - indice_3(i3)%z3*v_3(ilev,i3)*c(ilev,ind_3_2) |
---|
| 4687 | mat(ind_3_6,ind_3_2) = mat(ind_3_6,ind_3_2) - indice_3(i3)%z5*v_3(ilev,i3)*c(ilev,ind_3_2) |
---|
| 4688 | |
---|
[2580] | 4689 | loss(ind_3_2) = loss(ind_3_2) + indice_3(i3)%z1*v_3(ilev,i3)*c(ilev,ind_3_2) |
---|
| 4690 | lossconc(ind_3_2) = lossconc(ind_3_2) + indice_3(i3)%z1*v_3(ilev,i3)*c(ilev,ind_3_2)*c(ilev,ind_3_2) |
---|
| 4691 | |
---|
| 4692 | prod(ind_3_4) = prod(ind_3_4) + indice_3(i3)%z3*v_3(ilev,i3)*c(ilev,ind_3_2)*c(ilev,ind_3_2) |
---|
| 4693 | prod(ind_3_6) = prod(ind_3_6) + indice_3(i3)%z5*v_3(ilev,i3)*c(ilev,ind_3_2)*c(ilev,ind_3_2) |
---|
[2187] | 4694 | |
---|
| 4695 | end do |
---|
| 4696 | |
---|
| 4697 | ! reactions a + b -> c + d |
---|
| 4698 | |
---|
| 4699 | eps = 1.d-10 |
---|
| 4700 | |
---|
| 4701 | do i4 = 1,nb_reaction_4_max |
---|
| 4702 | |
---|
| 4703 | ind_4_2 = indice_4(i4)%z2 |
---|
| 4704 | ind_4_4 = indice_4(i4)%z4 |
---|
| 4705 | ind_4_6 = indice_4(i4)%z6 |
---|
| 4706 | ind_4_8 = indice_4(i4)%z8 |
---|
| 4707 | |
---|
| 4708 | eps_4 = abs(c(ilev,ind_4_2))/(abs(c(ilev,ind_4_2)) + abs(c(ilev,ind_4_4)) + eps) |
---|
| 4709 | eps_4 = min(eps_4,1.0) |
---|
| 4710 | |
---|
| 4711 | mat(ind_4_2,ind_4_2) = mat(ind_4_2,ind_4_2) + indice_4(i4)%z1*v_4(ilev,i4)*(1. - eps_4)*c(ilev,ind_4_4) |
---|
| 4712 | mat(ind_4_2,ind_4_4) = mat(ind_4_2,ind_4_4) + indice_4(i4)%z1*v_4(ilev,i4)*eps_4*c(ilev,ind_4_2) |
---|
| 4713 | mat(ind_4_4,ind_4_2) = mat(ind_4_4,ind_4_2) + indice_4(i4)%z3*v_4(ilev,i4)*(1. - eps_4)*c(ilev,ind_4_4) |
---|
| 4714 | mat(ind_4_4,ind_4_4) = mat(ind_4_4,ind_4_4) + indice_4(i4)%z3*v_4(ilev,i4)*eps_4*c(ilev,ind_4_2) |
---|
| 4715 | mat(ind_4_6,ind_4_2) = mat(ind_4_6,ind_4_2) - indice_4(i4)%z5*v_4(ilev,i4)*(1. - eps_4)*c(ilev,ind_4_4) |
---|
| 4716 | mat(ind_4_6,ind_4_4) = mat(ind_4_6,ind_4_4) - indice_4(i4)%z5*v_4(ilev,i4)*eps_4*c(ilev,ind_4_2) |
---|
| 4717 | mat(ind_4_8,ind_4_2) = mat(ind_4_8,ind_4_2) - indice_4(i4)%z7*v_4(ilev,i4)*(1. - eps_4)*c(ilev,ind_4_4) |
---|
| 4718 | mat(ind_4_8,ind_4_4) = mat(ind_4_8,ind_4_4) - indice_4(i4)%z7*v_4(ilev,i4)*eps_4*c(ilev,ind_4_2) |
---|
| 4719 | |
---|
| 4720 | |
---|
[2580] | 4721 | loss(ind_4_2) = loss(ind_4_2) + indice_4(i4)%z1*v_4(ilev,i4)*c(ilev,ind_4_4) |
---|
| 4722 | lossconc(ind_4_2) = lossconc(ind_4_2) + indice_4(i4)%z1*v_4(ilev,i4)*c(ilev,ind_4_4)*c(ilev,ind_4_2) |
---|
| 4723 | loss(ind_4_4) = loss(ind_4_4) + indice_4(i4)%z3*v_4(ilev,i4)*c(ilev,ind_4_2) |
---|
| 4724 | lossconc(ind_4_4) = lossconc(ind_4_4) + indice_4(i4)%z3*v_4(ilev,i4)*c(ilev,ind_4_2)*c(ilev,ind_4_4) |
---|
| 4725 | |
---|
| 4726 | prod(ind_4_6) = prod(ind_4_6) + indice_4(i4)%z5*v_4(ilev,i4)*c(ilev,ind_4_2)*c(ilev,ind_4_4) |
---|
| 4727 | prod(ind_4_8) = prod(ind_4_8) + indice_4(i4)%z7*v_4(ilev,i4)*c(ilev,ind_4_2)*c(ilev,ind_4_4) |
---|
[2187] | 4728 | |
---|
| 4729 | end do |
---|
| 4730 | |
---|
| 4731 | end subroutine fill_matrix |
---|
| 4732 | |
---|
| 4733 | !================================================================ |
---|
| 4734 | |
---|
| 4735 | subroutine define_dt(nesp, dtnew, dtold, ctimestep, cold, ccur, mat1, & |
---|
[2320] | 4736 | prod, loss, dens, lon, lat) |
---|
[2187] | 4737 | |
---|
| 4738 | !================================================================ |
---|
| 4739 | ! iterative evaluation of the appropriate time step dtnew |
---|
| 4740 | ! according to curvature criterion based on |
---|
| 4741 | ! e = 2 Rtol [r Cn+1 -(1-r) Cn + Cn-1 ]/[(1+r) Cn] |
---|
| 4742 | ! with r = (tn - tn-1)/(tn+1 - tn) |
---|
| 4743 | !================================================================ |
---|
| 4744 | |
---|
| 4745 | implicit none |
---|
| 4746 | |
---|
| 4747 | ! input |
---|
| 4748 | |
---|
| 4749 | integer :: nesp ! number of species in the chemistry |
---|
| 4750 | |
---|
| 4751 | real :: dtold, ctimestep |
---|
[2836] | 4752 | real (kind = 8), dimension(nesp) :: cold, ccur |
---|
| 4753 | real (kind = 8), dimension(nesp,nesp) :: mat1 |
---|
| 4754 | real (kind = 8), dimension(nesp) :: prod, loss |
---|
[2187] | 4755 | real :: dens |
---|
[2320] | 4756 | real :: lon, lat |
---|
[2187] | 4757 | |
---|
| 4758 | ! output |
---|
| 4759 | |
---|
| 4760 | real :: dtnew |
---|
| 4761 | |
---|
| 4762 | ! local |
---|
| 4763 | |
---|
[2836] | 4764 | real (kind = 8), dimension(nesp) :: cnew |
---|
| 4765 | real (kind = 8), dimension(nesp,nesp) :: mat |
---|
| 4766 | real (kind = 8) :: atol, ratio, e, es, coef |
---|
[2187] | 4767 | |
---|
| 4768 | integer :: code, iesp, iter |
---|
| 4769 | integer, dimension(nesp) :: indx |
---|
| 4770 | integer :: imax |
---|
| 4771 | |
---|
| 4772 | real :: dttest |
---|
| 4773 | |
---|
| 4774 | ! parameters |
---|
| 4775 | |
---|
[2836] | 4776 | real (kind = 8), parameter :: dtmin = 10. ! minimum time step (s) |
---|
| 4777 | real (kind = 8), parameter :: vmrtol = 1.e-11 ! absolute tolerance on vmr |
---|
| 4778 | real (kind = 8), parameter :: rtol = 0.05 ! rtol recommended value : 0.1-0.02 |
---|
| 4779 | integer, parameter :: niter = 3 ! number of iterations |
---|
| 4780 | real (kind = 8), parameter :: coefmax = 2. |
---|
| 4781 | real (kind = 8), parameter :: coefmin = 0.1 |
---|
| 4782 | logical :: fast_guess = .true. |
---|
[2187] | 4783 | |
---|
[2836] | 4784 | |
---|
[2187] | 4785 | dttest = dtold ! dttest = dtold = dt_guess |
---|
| 4786 | |
---|
| 4787 | atol = vmrtol*dens ! absolute tolerance in molecule.cm-3 |
---|
| 4788 | |
---|
| 4789 | do iter = 1,niter |
---|
| 4790 | |
---|
| 4791 | if (fast_guess) then |
---|
| 4792 | |
---|
| 4793 | ! first guess : fast semi-implicit method |
---|
| 4794 | |
---|
| 4795 | do iesp = 1, nesp |
---|
| 4796 | cnew(iesp) = (ccur(iesp) + prod(iesp)*dttest)/(1. + loss(iesp)*dttest) |
---|
| 4797 | end do |
---|
| 4798 | |
---|
| 4799 | else |
---|
| 4800 | |
---|
| 4801 | ! first guess : form the matrix identity + mat*dt_guess |
---|
| 4802 | |
---|
| 4803 | mat(:,:) = mat1(:,:)*dttest |
---|
| 4804 | do iesp = 1,nesp |
---|
| 4805 | mat(iesp,iesp) = 1. + mat(iesp,iesp) |
---|
| 4806 | end do |
---|
| 4807 | |
---|
| 4808 | ! form right-hand side (RHS) of the system |
---|
| 4809 | |
---|
| 4810 | cnew(:) = ccur(:) |
---|
| 4811 | |
---|
| 4812 | ! solve the linear system M*Cn+1 = Cn (RHS in cnew, then replaced by solution) |
---|
| 4813 | |
---|
| 4814 | #ifdef LAPACK |
---|
| 4815 | call dgesv(nesp,1,mat,nesp,indx,cnew,nesp,code) |
---|
| 4816 | #else |
---|
| 4817 | write(*,*) "photochemistry error, missing LAPACK routine dgesv" |
---|
| 4818 | stop |
---|
| 4819 | #endif |
---|
| 4820 | |
---|
| 4821 | end if |
---|
| 4822 | |
---|
| 4823 | ! ratio old/new subtimestep |
---|
| 4824 | |
---|
| 4825 | ratio = dtold/dttest |
---|
| 4826 | |
---|
| 4827 | ! e : local error indicator |
---|
| 4828 | |
---|
| 4829 | e = 0. |
---|
| 4830 | |
---|
| 4831 | do iesp = 1,nesp |
---|
| 4832 | es = 2.*abs((ratio*cnew(iesp) - (1. + ratio)*ccur(iesp) + cold(iesp)) & |
---|
| 4833 | /(1. + ratio)/max(ccur(iesp)*rtol,atol)) |
---|
| 4834 | |
---|
| 4835 | if (es > e) then |
---|
| 4836 | e = es |
---|
| 4837 | imax = iesp |
---|
| 4838 | end if |
---|
| 4839 | end do |
---|
| 4840 | |
---|
| 4841 | ! timestep correction |
---|
| 4842 | |
---|
| 4843 | coef = max(coefmin, min(coefmax,0.8/sqrt(e))) |
---|
| 4844 | |
---|
| 4845 | dttest = max(dtmin,dttest*coef) |
---|
| 4846 | dttest = min(ctimestep,dttest) |
---|
| 4847 | |
---|
| 4848 | end do ! iter |
---|
| 4849 | |
---|
| 4850 | ! new timestep |
---|
| 4851 | |
---|
| 4852 | dtnew = dttest |
---|
| 4853 | |
---|
| 4854 | end subroutine define_dt |
---|
| 4855 | |
---|
| 4856 | !====================================================================== |
---|
[2836] | 4857 | !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! |
---|
| 4858 | !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! |
---|
| 4859 | ! CE CODE EST OBSOLETE !! A NE PAS UTILISER !!!!!!!!!!!!!!!!!!!!!!!!!!! |
---|
| 4860 | !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! |
---|
| 4861 | !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! |
---|
[2187] | 4862 | |
---|
| 4863 | SUBROUTINE rate_save( & |
---|
| 4864 | n_lev, & |
---|
| 4865 | pres, & |
---|
| 4866 | temperature, & |
---|
| 4867 | traceur, & |
---|
| 4868 | nq_max, & |
---|
| 4869 | vphot, & |
---|
| 4870 | v3, & |
---|
| 4871 | v4) |
---|
| 4872 | !================== |
---|
| 4873 | !!!!! MODEL 1D !!!! ==> n_lon = 1 !!!! |
---|
| 4874 | !================== |
---|
| 4875 | ! Ici on a les variables pour le modele 1D, surtout pour la sauvegarde des taux de prod/consom |
---|
| 4876 | !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! |
---|
| 4877 | !PENSER a changer les conditions de time_tot |
---|
| 4878 | !time_tot=nbr_pdt*(nbr_jour-1) |
---|
| 4879 | !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! |
---|
| 4880 | |
---|
| 4881 | USE chemparam_mod |
---|
| 4882 | IMPLICIT none |
---|
| 4883 | |
---|
| 4884 | |
---|
| 4885 | !INTEGER, PARAMETER :: time_tot=6000*1 |
---|
| 4886 | |
---|
| 4887 | INTEGER :: unit_loc, ierr_loc ! unite de lecture de "rcm1d.def" |
---|
| 4888 | |
---|
| 4889 | INTEGER, SAVE :: time_tot,nbr_pdt,nbr_jour |
---|
| 4890 | INTEGER, SAVE :: cpt_time, cpt_time_rate |
---|
| 4891 | DOUBLE PRECISION, DIMENSION(n_lev,126) :: rate_day |
---|
| 4892 | DOUBLE PRECISION, DIMENSION(n_lev,126) :: rate_night |
---|
| 4893 | DOUBLE PRECISION :: rate_local |
---|
| 4894 | DOUBLE PRECISION :: concentration(n_lev) |
---|
| 4895 | DOUBLE PRECISION :: pres(n_lev) |
---|
| 4896 | DOUBLE PRECISION :: temperature(n_lev) |
---|
| 4897 | DOUBLE PRECISION :: traceur(n_lev,nq_max) |
---|
| 4898 | |
---|
| 4899 | INTEGER :: n_lev, nq_max |
---|
| 4900 | INTEGER :: i_lev, i_react, i_v |
---|
| 4901 | |
---|
| 4902 | INTEGER :: i |
---|
| 4903 | |
---|
| 4904 | LOGICAL, SAVE :: f_call = .true. |
---|
| 4905 | |
---|
[2780] | 4906 | integer, parameter :: nb_phot_max = 30 |
---|
| 4907 | integer, parameter :: nb_reaction_3_max = 12 |
---|
| 4908 | integer, parameter :: nb_reaction_4_max = 87 |
---|
[2187] | 4909 | |
---|
| 4910 | real, dimension(n_lev,nb_phot_max) :: vphot |
---|
| 4911 | real, dimension(n_lev,nb_reaction_3_max) :: v3 |
---|
| 4912 | real, dimension(n_lev,nb_reaction_4_max) :: v4 |
---|
| 4913 | |
---|
| 4914 | !PRINT*,"DEBUT subroutine rate_save" |
---|
| 4915 | |
---|
| 4916 | |
---|
| 4917 | IF (f_call) THEN |
---|
| 4918 | ! ------------------------------------------------------ |
---|
| 4919 | ! Lecture des parametres dans "rcm1d.def" |
---|
| 4920 | ! ------------------------------------------------------ |
---|
| 4921 | |
---|
| 4922 | ! Opening parameters file "rcm1d.def" |
---|
| 4923 | ! --------------------------------------- |
---|
| 4924 | unit_loc =98 |
---|
| 4925 | OPEN(unit_loc,file='rcm1d.def',status='old',form='formatted' & |
---|
| 4926 | ,iostat=ierr_loc) |
---|
| 4927 | |
---|
| 4928 | IF(ierr_loc.ne.0) THEN |
---|
| 4929 | write(*,*) 'Problem to open "rcm1d.def' |
---|
| 4930 | write(*,*) 'Is it there ?' |
---|
| 4931 | stop |
---|
| 4932 | ELSE |
---|
| 4933 | write(*,*) 'open rcm1d.def success ' |
---|
| 4934 | END IF |
---|
| 4935 | |
---|
| 4936 | do i=1, 2 |
---|
| 4937 | read (unit_loc, *) |
---|
| 4938 | end do |
---|
| 4939 | |
---|
| 4940 | PRINT *,'nombre de pas de temps par jour ?' |
---|
| 4941 | READ(unit_loc,*) nbr_pdt |
---|
| 4942 | print*,nbr_pdt |
---|
| 4943 | |
---|
| 4944 | PRINT *,'nombre de jours simules ?' |
---|
| 4945 | READ(unit_loc,*) nbr_jour |
---|
| 4946 | print*,nbr_jour |
---|
| 4947 | |
---|
| 4948 | |
---|
| 4949 | |
---|
| 4950 | time_tot = nbr_pdt*(nbr_jour-1) |
---|
| 4951 | PRINT *,'nombre de PdT avant calcul des taux production/consommation ?' |
---|
| 4952 | PRINT*,time_tot |
---|
| 4953 | |
---|
| 4954 | PRINT*,'nlev',n_lev |
---|
| 4955 | |
---|
| 4956 | cpt_time = 1 |
---|
| 4957 | cpt_time_rate = 1 |
---|
| 4958 | f_call = .false. |
---|
| 4959 | PRINT*,"f_call: ",f_call |
---|
| 4960 | rate_night(:,:)=0. |
---|
| 4961 | rate_day(:,:)=0. |
---|
| 4962 | |
---|
| 4963 | END IF |
---|
| 4964 | |
---|
| 4965 | ! PRINT*,"P T" |
---|
| 4966 | ! PRINT*,pres,temperature |
---|
| 4967 | |
---|
| 4968 | IF (cpt_time .GE. time_tot) THEN |
---|
| 4969 | |
---|
| 4970 | ! PRINT*,'cpt_time',cpt_time |
---|
| 4971 | |
---|
| 4972 | DO i_lev=1, n_lev |
---|
| 4973 | concentration(i_lev) = pres(i_lev)/(1.3806488E-19 * temperature(i_lev)) |
---|
| 4974 | END DO |
---|
| 4975 | |
---|
| 4976 | IF (((cpt_time_rate .GE. 1).AND.(cpt_time_rate .LE. (nbr_pdt/4))).OR. & |
---|
| 4977 | (cpt_time_rate .GT. (3*(nbr_pdt/4)))) THEN |
---|
| 4978 | |
---|
| 4979 | !=============================== |
---|
| 4980 | ! !!!! NUIT !!!! |
---|
| 4981 | !=============================== |
---|
| 4982 | ! PRINT*,'NUIT' |
---|
| 4983 | |
---|
| 4984 | DO i_lev=1, n_lev |
---|
| 4985 | i_react=1 |
---|
| 4986 | i_v=1 |
---|
| 4987 | !=============================== |
---|
| 4988 | ! 1 o2 + hv -> o + o |
---|
| 4989 | !=============================== |
---|
| 4990 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) |
---|
| 4991 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 4992 | i_react=i_react+1 |
---|
| 4993 | i_v=i_v+1 |
---|
| 4994 | !=============================== |
---|
| 4995 | ! 2 o2 + hv -> o + o(1d) |
---|
| 4996 | !=============================== |
---|
| 4997 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) |
---|
| 4998 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 4999 | i_react=i_react+1 |
---|
| 5000 | i_v=i_v+1 |
---|
| 5001 | !=============================== |
---|
| 5002 | ! 3 co2 + hv -> co + o |
---|
| 5003 | !=============================== |
---|
| 5004 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_co2)*concentration(i_lev) |
---|
| 5005 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5006 | i_react=i_react+1 |
---|
| 5007 | i_v=i_v+1 |
---|
| 5008 | !=============================== |
---|
| 5009 | ! 4 co2 + hv -> co + o(1d) |
---|
| 5010 | !=============================== |
---|
| 5011 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_co2)*concentration(i_lev) |
---|
| 5012 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5013 | i_react=i_react+1 |
---|
| 5014 | i_v=i_v+1 |
---|
| 5015 | !=============================== |
---|
| 5016 | ! 5 o3 + hv -> o2(Dg) + o(1d) |
---|
| 5017 | !=============================== |
---|
| 5018 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5019 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5020 | i_react=i_react+1 |
---|
| 5021 | i_v=i_v+1 |
---|
| 5022 | !=============================== |
---|
| 5023 | ! 6 o3 + hv -> o2 + o |
---|
| 5024 | !=============================== |
---|
| 5025 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5026 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5027 | i_react=i_react+1 |
---|
| 5028 | i_v=i_v+1 |
---|
| 5029 | !=============================== |
---|
| 5030 | ! 7 h2o + hv -> h + oh |
---|
| 5031 | !=============================== |
---|
| 5032 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_h2o)*concentration(i_lev) |
---|
| 5033 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5034 | i_react=i_react+1 |
---|
| 5035 | i_v=i_v+1 |
---|
| 5036 | !=============================== |
---|
| 5037 | ! 8 ho2 + hv -> oh + o |
---|
| 5038 | !=============================== |
---|
| 5039 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5040 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5041 | i_react=i_react+1 |
---|
| 5042 | i_v=i_v+1 |
---|
| 5043 | !=============================== |
---|
| 5044 | ! 9 h2o2 + hv -> oh + oh |
---|
| 5045 | !=============================== |
---|
| 5046 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_h2o2)*concentration(i_lev) |
---|
| 5047 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5048 | i_react=i_react+1 |
---|
| 5049 | i_v=i_v+1 |
---|
| 5050 | !=============================== |
---|
| 5051 | ! 10 hcl + hv -> h + cl |
---|
| 5052 | !=============================== |
---|
| 5053 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) |
---|
| 5054 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5055 | i_react=i_react+1 |
---|
| 5056 | i_v=i_v+1 |
---|
| 5057 | !=============================== |
---|
| 5058 | ! 11 cl2 + hv -> cl + cl |
---|
| 5059 | !=============================== |
---|
| 5060 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) |
---|
| 5061 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5062 | i_react=i_react+1 |
---|
| 5063 | i_v=i_v+1 |
---|
| 5064 | !=============================== |
---|
| 5065 | ! 12 hocl + hv -> oh + cl |
---|
| 5066 | !=============================== |
---|
| 5067 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_hocl)*concentration(i_lev) |
---|
| 5068 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5069 | i_react=i_react+1 |
---|
| 5070 | i_v=i_v+1 |
---|
| 5071 | !=============================== |
---|
| 5072 | ! 13 so2 + hv -> so + o |
---|
| 5073 | !=============================== |
---|
| 5074 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_so2)*concentration(i_lev) |
---|
| 5075 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5076 | i_react=i_react+1 |
---|
| 5077 | i_v=i_v+1 |
---|
| 5078 | !=============================== |
---|
| 5079 | ! 14 so + hv -> s + o |
---|
| 5080 | !=============================== |
---|
| 5081 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) |
---|
| 5082 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5083 | i_react=i_react+1 |
---|
| 5084 | i_v=i_v+1 |
---|
| 5085 | !=============================== |
---|
| 5086 | ! 15 so3 + hv -> so2 + o |
---|
| 5087 | !=============================== |
---|
| 5088 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_so3)*concentration(i_lev) |
---|
| 5089 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5090 | i_react=i_react+1 |
---|
| 5091 | i_v=i_v+1 |
---|
| 5092 | !=============================== |
---|
| 5093 | ! 16 clo + hv -> cl + o |
---|
| 5094 | !=============================== |
---|
| 5095 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) |
---|
| 5096 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5097 | i_react=i_react+1 |
---|
| 5098 | i_v=i_v+1 |
---|
| 5099 | !=============================== |
---|
| 5100 | ! 17 ocs + hv -> co + s |
---|
| 5101 | !=============================== |
---|
| 5102 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_ocs)*concentration(i_lev) |
---|
| 5103 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5104 | i_react=i_react+1 |
---|
| 5105 | i_v=i_v+1 |
---|
| 5106 | !=============================== |
---|
| 5107 | ! 18 cocl2 + hv -> cl + cl + co |
---|
| 5108 | !=============================== |
---|
| 5109 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_cocl2)*concentration(i_lev) |
---|
| 5110 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5111 | i_react=i_react+1 |
---|
| 5112 | i_v=i_v+1 |
---|
| 5113 | !=============================== |
---|
| 5114 | ! 19 h2so4 + hv -> so3 + h2o |
---|
| 5115 | !=============================== |
---|
| 5116 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_h2so4)*concentration(i_lev) |
---|
| 5117 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5118 | i_react=i_react+1 |
---|
| 5119 | i_v=i_v+1 |
---|
| 5120 | !=============================== |
---|
| 5121 | !--- 20 b001 o(1d) + co2 -> o + co2 |
---|
| 5122 | !=============================== |
---|
| 5123 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 5124 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5125 | i_react=i_react+1 |
---|
| 5126 | i_v=i_v+1 |
---|
| 5127 | !=============================== |
---|
| 5128 | !--- 21 b004 o(1d) + o2 -> o + o2 |
---|
| 5129 | !=============================== |
---|
| 5130 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 5131 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5132 | i_react=i_react+1 |
---|
| 5133 | i_v=i_v+1 |
---|
| 5134 | !=============================== |
---|
| 5135 | !--- 22 f014 clco + co2 -> cl + co + co2 |
---|
| 5136 | !=============================== |
---|
| 5137 | rate_local = vphot(i_lev,22)*traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 5138 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5139 | i_react=i_react+1 |
---|
| 5140 | i_v=i_v+1 |
---|
| 5141 | !=============================== |
---|
| 5142 | !--- 23 g016 s2o2 + co2 -> 2so + co2 |
---|
| 5143 | !=============================== |
---|
| 5144 | rate_local = vphot(i_lev,23)*traceur(i_lev,i_s2o2)*concentration(i_lev) |
---|
| 5145 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5146 | i_react=i_react+1 |
---|
| 5147 | i_v=i_v+1 |
---|
| 5148 | !=============================== |
---|
| 5149 | !--- 24 g023 s2 + co2 -> 2s + co2 |
---|
| 5150 | !=============================== |
---|
| 5151 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) |
---|
| 5152 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5153 | i_react=i_react+1 |
---|
| 5154 | i_v=i_v+1 |
---|
| 5155 | !=============================== |
---|
| 5156 | !--- 25 h001 ICE |
---|
| 5157 | !=============================== |
---|
| 5158 | i_react=i_react+1 |
---|
| 5159 | i_v=i_v+1 |
---|
| 5160 | !=============================== |
---|
| 5161 | !--- 26 h002 ICE |
---|
| 5162 | !=============================== |
---|
| 5163 | i_react=i_react+1 |
---|
| 5164 | i_v=i_v+1 |
---|
| 5165 | !=============================== |
---|
| 5166 | !--- 27 h003 ICE |
---|
| 5167 | !=============================== |
---|
| 5168 | i_react=i_react+1 |
---|
| 5169 | i_v=i_v+1 |
---|
| 5170 | !=============================== |
---|
| 5171 | !--- 30 i001 o2(Dg) + CO2 -> O2 + CO2 + hv |
---|
| 5172 | !=============================== |
---|
| 5173 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o2dg)*concentration(i_lev) |
---|
| 5174 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5175 | i_react=i_react+1 |
---|
| 5176 | i_v=i_v+1 |
---|
| 5177 | !=============================== |
---|
| 5178 | !--- 31 i002 o2(Dg) -> O2 + hv |
---|
| 5179 | !=============================== |
---|
| 5180 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o2dg)*concentration(i_lev) |
---|
| 5181 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5182 | i_react=i_react+1 |
---|
| 5183 | i_v=i_v+1 |
---|
| 5184 | |
---|
| 5185 | ! DEBUT DES REACTION V3 |
---|
| 5186 | i_v = i_v - nb_phot_max |
---|
| 5187 | !=============================== |
---|
| 5188 | !--- 32 a002: o + o + co2 -> o2 + co2 |
---|
| 5189 | !=============================== |
---|
| 5190 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 5191 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5192 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5193 | i_react=i_react+1 |
---|
| 5194 | i_v=i_v+1 |
---|
| 5195 | !=============================== |
---|
| 5196 | !--- 33 c008: ho2 + ho2 -> h2o2 + o2 |
---|
| 5197 | !=============================== |
---|
| 5198 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_ho2)*concentration(i_lev) & |
---|
| 5199 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5200 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5201 | i_react=i_react+1 |
---|
| 5202 | i_v=i_v+1 |
---|
| 5203 | !=============================== |
---|
| 5204 | !--- 34 c013: oh + oh -> h2o + o |
---|
| 5205 | !=============================== |
---|
| 5206 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 5207 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5208 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5209 | i_react=i_react+1 |
---|
| 5210 | i_v=i_v+1 |
---|
| 5211 | !=============================== |
---|
| 5212 | !--- 35 c016: ho2 + ho2 + co2 -> h2o2 + o2 + co2 |
---|
| 5213 | !=============================== |
---|
| 5214 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_ho2)*concentration(i_lev) & |
---|
| 5215 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5216 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5217 | i_react=i_react+1 |
---|
| 5218 | i_v=i_v+1 |
---|
| 5219 | !=============================== |
---|
| 5220 | !--- 36 c017: oh + oh + co2 -> h2o2 + co2 |
---|
| 5221 | !=============================== |
---|
| 5222 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 5223 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5224 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5225 | i_react=i_react+1 |
---|
| 5226 | i_v=i_v+1 |
---|
| 5227 | !=============================== |
---|
| 5228 | !--- 37 c018: h + h + co2 -> h2 + co2 |
---|
| 5229 | !=============================== |
---|
| 5230 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 5231 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 5232 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5233 | i_react=i_react+1 |
---|
| 5234 | i_v=i_v+1 |
---|
| 5235 | !=============================== |
---|
| 5236 | !--- 38 f021: cl + cl + co2 -> cl2 + co2 |
---|
| 5237 | !=============================== |
---|
| 5238 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5239 | *traceur(i_lev,i_cl)*concentration(i_lev) |
---|
| 5240 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5241 | i_react=i_react+1 |
---|
| 5242 | i_v=i_v+1 |
---|
| 5243 | !=============================== |
---|
| 5244 | !--- 39 f026: clco + clco -> cocl2 + co |
---|
| 5245 | !=============================== |
---|
| 5246 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 5247 | *traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 5248 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5249 | i_react=i_react+1 |
---|
| 5250 | i_v=i_v+1 |
---|
| 5251 | !=============================== |
---|
| 5252 | !--- 40 f030: clso2 + clso2 -> cl2 + so2 + so2 |
---|
| 5253 | !=============================== |
---|
| 5254 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_clso2)*concentration(i_lev) & |
---|
| 5255 | *traceur(i_lev,i_clso2)*concentration(i_lev) |
---|
| 5256 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5257 | i_react=i_react+1 |
---|
| 5258 | i_v=i_v+1 |
---|
| 5259 | !=============================== |
---|
| 5260 | !--- 41 g015: so + so + co2 -> s2o2 + co2 |
---|
| 5261 | !=============================== |
---|
| 5262 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 5263 | *traceur(i_lev,i_so)*concentration(i_lev) |
---|
| 5264 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5265 | i_react=i_react+1 |
---|
| 5266 | i_v=i_v+1 |
---|
| 5267 | !=============================== |
---|
| 5268 | !--- 42 g022: s + s + co2 -> s2 + co2 |
---|
| 5269 | !=============================== |
---|
| 5270 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5271 | *traceur(i_lev,i_s)*concentration(i_lev) |
---|
| 5272 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5273 | i_react=i_react+1 |
---|
| 5274 | i_v=i_v+1 |
---|
| 5275 | |
---|
| 5276 | ! DEBUT DES REACTION V4 |
---|
| 5277 | |
---|
| 5278 | i_v = i_v - nb_reaction_3_max |
---|
| 5279 | |
---|
| 5280 | !=============================== |
---|
| 5281 | !--- 43 a001: o + o2 + co2 -> o3 + co2 |
---|
| 5282 | !=============================== |
---|
| 5283 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) & |
---|
| 5284 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5285 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5286 | i_react=i_react+1 |
---|
| 5287 | i_v=i_v+1 |
---|
| 5288 | !=============================== |
---|
| 5289 | !--- 44 a003: o + o3 -> o2 + o2 |
---|
| 5290 | !=============================== |
---|
| 5291 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o3)*concentration(i_lev) & |
---|
| 5292 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5293 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5294 | i_react=i_react+1 |
---|
| 5295 | i_v=i_v+1 |
---|
| 5296 | !=============================== |
---|
| 5297 | !--- 45 b002: o(1d) + h2o -> oh + oh |
---|
| 5298 | !=============================== |
---|
| 5299 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) & |
---|
| 5300 | *traceur(i_lev,i_h2o)*concentration(i_lev) |
---|
| 5301 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5302 | i_react=i_react+1 |
---|
| 5303 | i_v=i_v+1 |
---|
| 5304 | !=============================== |
---|
| 5305 | !--- 46 b003: o(1d) + h2 -> oh + h |
---|
| 5306 | !=============================== |
---|
| 5307 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) & |
---|
| 5308 | *traceur(i_lev,i_h2)*concentration(i_lev) |
---|
| 5309 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5310 | i_react=i_react+1 |
---|
| 5311 | i_v=i_v+1 |
---|
| 5312 | !=============================== |
---|
| 5313 | !--- 47 b005: o(1d) + o3 -> o2 + o2 |
---|
| 5314 | !=============================== |
---|
| 5315 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) & |
---|
| 5316 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5317 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5318 | i_react=i_react+1 |
---|
| 5319 | i_v=i_v+1 |
---|
| 5320 | !=============================== |
---|
| 5321 | !--- 48 b006: o(1d) + o3 -> o2 + o + o |
---|
| 5322 | !=============================== |
---|
| 5323 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) & |
---|
| 5324 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5325 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5326 | i_react=i_react+1 |
---|
| 5327 | i_v=i_v+1 |
---|
| 5328 | !=============================== |
---|
| 5329 | !--- 49 c001: o + ho2 -> oh + o2 |
---|
| 5330 | !=============================== |
---|
| 5331 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 5332 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5333 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5334 | i_react=i_react+1 |
---|
| 5335 | i_v=i_v+1 |
---|
| 5336 | !=============================== |
---|
| 5337 | !--- 50 c002: o + oh -> o2 + h |
---|
| 5338 | !=============================== |
---|
| 5339 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) |
---|
| 5340 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5341 | i_react=i_react+1 |
---|
| 5342 | i_v=i_v+1 |
---|
| 5343 | !=============================== |
---|
| 5344 | !--- 51 c003: h + o3 -> oh + o2 |
---|
| 5345 | !=============================== |
---|
| 5346 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 5347 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5348 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5349 | i_react=i_react+1 |
---|
| 5350 | i_v=i_v+1 |
---|
| 5351 | !=============================== |
---|
| 5352 | !--- 52 c004: h + ho2 -> oh + oh |
---|
| 5353 | !=============================== |
---|
| 5354 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 5355 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5356 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5357 | i_react=i_react+1 |
---|
| 5358 | i_v=i_v+1 |
---|
| 5359 | !=============================== |
---|
| 5360 | !--- 53 c005: h + ho2 -> h2 + o2 |
---|
| 5361 | !=============================== |
---|
| 5362 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 5363 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5364 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5365 | i_react=i_react+1 |
---|
| 5366 | i_v=i_v+1 |
---|
| 5367 | !=============================== |
---|
| 5368 | !--- 54 c006: h + ho2 -> h2o + o |
---|
| 5369 | !=============================== |
---|
| 5370 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 5371 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5372 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5373 | i_react=i_react+1 |
---|
| 5374 | i_v=i_v+1 |
---|
| 5375 | !=============================== |
---|
| 5376 | !--- 55 c007: oh + ho2 -> h2o + o2 |
---|
| 5377 | !=============================== |
---|
| 5378 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 5379 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5380 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5381 | i_react=i_react+1 |
---|
| 5382 | i_v=i_v+1 |
---|
| 5383 | !=============================== |
---|
| 5384 | !--- 56 c009: oh + h2o2 -> h2o + ho2 |
---|
| 5385 | !=============================== |
---|
| 5386 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 5387 | *traceur(i_lev,i_h2o2)*concentration(i_lev) |
---|
| 5388 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5389 | i_react=i_react+1 |
---|
| 5390 | i_v=i_v+1 |
---|
| 5391 | !=============================== |
---|
| 5392 | !--- 57 c010: oh + h2 -> h2o + h |
---|
| 5393 | !=============================== |
---|
| 5394 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 5395 | *traceur(i_lev,i_h2)*concentration(i_lev) |
---|
| 5396 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5397 | i_react=i_react+1 |
---|
| 5398 | i_v=i_v+1 |
---|
| 5399 | !=============================== |
---|
| 5400 | !--- 58 c011: h + o2 + co2 -> ho2 + co2 |
---|
| 5401 | !=============================== |
---|
| 5402 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) & |
---|
| 5403 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 5404 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5405 | i_react=i_react+1 |
---|
| 5406 | i_v=i_v+1 |
---|
| 5407 | !=============================== |
---|
| 5408 | !--- 59 c012: o + h2o2 -> oh + ho2 |
---|
| 5409 | !=============================== |
---|
| 5410 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 5411 | *traceur(i_lev,i_h2o2)*concentration(i_lev) |
---|
| 5412 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5413 | i_react=i_react+1 |
---|
| 5414 | i_v=i_v+1 |
---|
| 5415 | !=============================== |
---|
| 5416 | !--- 60 c014: oh + o3 -> ho2 + o2 |
---|
| 5417 | !=============================== |
---|
| 5418 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 5419 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5420 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5421 | i_react=i_react+1 |
---|
| 5422 | i_v=i_v+1 |
---|
| 5423 | !=============================== |
---|
| 5424 | !--- 61 c015: ho2 + o3 -> oh + o2 + o2 |
---|
| 5425 | !=============================== |
---|
| 5426 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o3)*concentration(i_lev) & |
---|
| 5427 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5428 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5429 | i_react=i_react+1 |
---|
| 5430 | i_v=i_v+1 |
---|
| 5431 | !=============================== |
---|
| 5432 | !--- 62 e001: oh + co -> co2 + h |
---|
| 5433 | !=============================== |
---|
| 5434 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) |
---|
| 5435 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5436 | i_react=i_react+1 |
---|
| 5437 | i_v=i_v+1 |
---|
| 5438 | !=============================== |
---|
| 5439 | !--- 63 e002: o + co + m -> co2 + m |
---|
| 5440 | !=============================== |
---|
| 5441 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 5442 | *traceur(i_lev,i_co)*concentration(i_lev) |
---|
| 5443 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5444 | i_react=i_react+1 |
---|
| 5445 | i_v=i_v+1 |
---|
| 5446 | !=============================== |
---|
| 5447 | !--- 64 f001: hcl + o(1d) -> oh + cl |
---|
| 5448 | !=============================== |
---|
| 5449 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 5450 | *traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 5451 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5452 | i_react=i_react+1 |
---|
| 5453 | i_v=i_v+1 |
---|
| 5454 | !=============================== |
---|
| 5455 | !--- 65 f002: hcl + o(1d) -> h + clo |
---|
| 5456 | !=============================== |
---|
| 5457 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 5458 | *traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 5459 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5460 | i_react=i_react+1 |
---|
| 5461 | i_v=i_v+1 |
---|
| 5462 | !=============================== |
---|
| 5463 | !--- 66 f003: hcl + o -> oh + cl |
---|
| 5464 | !=============================== |
---|
| 5465 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 5466 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5467 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5468 | i_react=i_react+1 |
---|
| 5469 | i_v=i_v+1 |
---|
| 5470 | !=============================== |
---|
| 5471 | !--- 67 f004: hcl + oh -> h2o + cl |
---|
| 5472 | !=============================== |
---|
| 5473 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 5474 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5475 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5476 | i_react=i_react+1 |
---|
| 5477 | i_v=i_v+1 |
---|
| 5478 | !=============================== |
---|
| 5479 | !--- 68 f005: clo + o -> cl + o2 |
---|
| 5480 | !=============================== |
---|
| 5481 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) & |
---|
| 5482 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5483 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5484 | i_react=i_react+1 |
---|
| 5485 | i_v=i_v+1 |
---|
| 5486 | !=============================== |
---|
| 5487 | !--- 69 f006: clo + oh -> cl + ho2 |
---|
| 5488 | !=============================== |
---|
| 5489 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) & |
---|
| 5490 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5491 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5492 | i_react=i_react+1 |
---|
| 5493 | i_v=i_v+1 |
---|
| 5494 | !=============================== |
---|
| 5495 | !--- 70 f007: clo + oh -> hcl + o2 |
---|
| 5496 | !=============================== |
---|
| 5497 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) & |
---|
| 5498 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5499 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5500 | i_react=i_react+1 |
---|
| 5501 | i_v=i_v+1 |
---|
| 5502 | !=============================== |
---|
| 5503 | !--- 71 f008: cl + h2 -> hcl + h |
---|
| 5504 | !=============================== |
---|
| 5505 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5506 | *traceur(i_lev,i_h2)*concentration(i_lev) |
---|
| 5507 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5508 | i_react=i_react+1 |
---|
| 5509 | i_v=i_v+1 |
---|
| 5510 | !=============================== |
---|
| 5511 | !--- 72 f009: cl + o3 -> clo + o2 |
---|
| 5512 | !=============================== |
---|
| 5513 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5514 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5515 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5516 | i_react=i_react+1 |
---|
| 5517 | i_v=i_v+1 |
---|
| 5518 | !=============================== |
---|
| 5519 | !--- 73 f010: cl + ho2 -> clo + oh |
---|
| 5520 | !=============================== |
---|
| 5521 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5522 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5523 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5524 | i_react=i_react+1 |
---|
| 5525 | i_v=i_v+1 |
---|
| 5526 | !=============================== |
---|
| 5527 | !--- 74 f011: cl + ho2 -> hcl + o2 |
---|
| 5528 | !=============================== |
---|
| 5529 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5530 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5531 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5532 | i_react=i_react+1 |
---|
| 5533 | i_v=i_v+1 |
---|
| 5534 | !=============================== |
---|
| 5535 | !--- 75 f012: cl + h2o2 -> hcl + ho2 |
---|
| 5536 | !=============================== |
---|
| 5537 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5538 | *traceur(i_lev,i_h2o2)*concentration(i_lev) |
---|
| 5539 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5540 | i_react=i_react+1 |
---|
| 5541 | i_v=i_v+1 |
---|
| 5542 | !=============================== |
---|
| 5543 | !--- 76 f013: cl + co + co2 -> clco + co2 |
---|
| 5544 | !=============================== |
---|
| 5545 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5546 | *traceur(i_lev,i_co)*concentration(i_lev) |
---|
| 5547 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5548 | i_react=i_react+1 |
---|
| 5549 | i_v=i_v+1 |
---|
| 5550 | !=============================== |
---|
| 5551 | !--- 77 f015: clco + o2 + m -> clco3 + m |
---|
| 5552 | !=============================== |
---|
| 5553 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) & |
---|
| 5554 | *traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 5555 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5556 | i_react=i_react+1 |
---|
| 5557 | i_v=i_v+1 |
---|
| 5558 | !=============================== |
---|
| 5559 | !--- 78 & 79 f016: clco3 + cl -> cl + clo + co2 |
---|
| 5560 | !=============================== |
---|
| 5561 | ! decomposee en : |
---|
| 5562 | ! 0.5 clco3 + 0.5 cl -> cl + 0.5 co2 |
---|
| 5563 | ! 0.5 clco3 + 0.5 cl -> clo + 0.5 co2 |
---|
| 5564 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 5565 | *traceur(i_lev,i_cl)*concentration(i_lev) |
---|
| 5566 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5567 | i_react=i_react+1 |
---|
| 5568 | i_v=i_v+1 |
---|
| 5569 | |
---|
| 5570 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 5571 | *traceur(i_lev,i_cl)*concentration(i_lev) |
---|
| 5572 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5573 | i_react=i_react+1 |
---|
| 5574 | i_v=i_v+1 |
---|
| 5575 | !=============================== |
---|
| 5576 | !--- 80 & 81 f017: clco3 + o -> cl + o2 + co2 |
---|
| 5577 | !=============================== |
---|
| 5578 | ! decomposee en : |
---|
| 5579 | ! 0.5 clco3 + 0.5 o -> cl |
---|
| 5580 | ! 0.5 clco3 + 0.5 o -> o2 + co2 |
---|
| 5581 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 5582 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5583 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5584 | i_react=i_react+1 |
---|
| 5585 | i_v=i_v+1 |
---|
| 5586 | |
---|
| 5587 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 5588 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5589 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5590 | i_react=i_react+1 |
---|
| 5591 | i_v=i_v+1 |
---|
| 5592 | !=============================== |
---|
| 5593 | !--- 82 f018: clo + ho2 -> hocl + o2 |
---|
| 5594 | !=============================== |
---|
| 5595 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) & |
---|
| 5596 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5597 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5598 | i_react=i_react+1 |
---|
| 5599 | i_v=i_v+1 |
---|
| 5600 | !=============================== |
---|
| 5601 | !--- 83 f019: oh + hocl -> h2o + clo |
---|
| 5602 | !=============================== |
---|
| 5603 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 5604 | *traceur(i_lev,i_hocl)*concentration(i_lev) |
---|
| 5605 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5606 | i_react=i_react+1 |
---|
| 5607 | i_v=i_v+1 |
---|
| 5608 | !=============================== |
---|
| 5609 | !--- 84 f020: o + hocl -> oh + clo |
---|
| 5610 | !=============================== |
---|
| 5611 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hocl)*concentration(i_lev) & |
---|
| 5612 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5613 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5614 | i_react=i_react+1 |
---|
| 5615 | i_v=i_v+1 |
---|
| 5616 | !=============================== |
---|
| 5617 | !--- 85 f022: clco + o -> cl + co2 |
---|
| 5618 | !=============================== |
---|
| 5619 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 5620 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5621 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5622 | i_react=i_react+1 |
---|
| 5623 | i_v=i_v+1 |
---|
| 5624 | !=============================== |
---|
| 5625 | !--- 86 f023: cl2 + o(1d) -> cl + clo |
---|
| 5626 | !=============================== |
---|
| 5627 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 5628 | *traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 5629 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5630 | i_react=i_react+1 |
---|
| 5631 | i_v=i_v+1 |
---|
| 5632 | !=============================== |
---|
| 5633 | !--- 87 f024: cl2 + h -> hcl + cl |
---|
| 5634 | !============================== |
---|
| 5635 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 5636 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 5637 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5638 | i_react=i_react+1 |
---|
| 5639 | i_v=i_v+1 |
---|
| 5640 | !=============================== |
---|
| 5641 | !--- 88 f025: cl + clco -> cl2 + co |
---|
| 5642 | !=============================== |
---|
| 5643 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5644 | *traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 5645 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5646 | i_react=i_react+1 |
---|
| 5647 | i_v=i_v+1 |
---|
| 5648 | !=============================== |
---|
| 5649 | !--- 89 f027: cl + so2 + co2 -> clso2 + co2 |
---|
| 5650 | !=============================== |
---|
| 5651 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so2)*concentration(i_lev) & |
---|
| 5652 | *traceur(i_lev,i_cl)*concentration(i_lev) |
---|
| 5653 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5654 | i_react=i_react+1 |
---|
| 5655 | i_v=i_v+1 |
---|
| 5656 | !=============================== |
---|
| 5657 | !--- 90 f028: clso2 + o -> so2 + clo |
---|
| 5658 | !=============================== |
---|
| 5659 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clso2)*concentration(i_lev) & |
---|
| 5660 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5661 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5662 | i_react=i_react+1 |
---|
| 5663 | i_v=i_v+1 |
---|
| 5664 | !=============================== |
---|
| 5665 | !--- 91 f029: clso2 + h -> so2 + hcl |
---|
| 5666 | !=============================== |
---|
| 5667 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clso2)*concentration(i_lev) & |
---|
| 5668 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 5669 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5670 | i_react=i_react+1 |
---|
| 5671 | i_v=i_v+1 |
---|
| 5672 | !=============================== |
---|
| 5673 | !--- 92 f031: cl + o + co2 -> clo + co2 |
---|
| 5674 | !=============================== |
---|
| 5675 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5676 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5677 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5678 | i_react=i_react+1 |
---|
| 5679 | i_v=i_v+1 |
---|
| 5680 | !=============================== |
---|
| 5681 | !--- 93 f032: cl2 + o -> clo + cl |
---|
| 5682 | !=============================== |
---|
| 5683 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 5684 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5685 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5686 | i_react=i_react+1 |
---|
| 5687 | i_v=i_v+1 |
---|
| 5688 | !=============================== |
---|
| 5689 | !--- 94 f033: clco + oh -> hocl + co |
---|
| 5690 | !=============================== |
---|
| 5691 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 5692 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5693 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5694 | i_react=i_react+1 |
---|
| 5695 | i_v=i_v+1 |
---|
| 5696 | !=============================== |
---|
| 5697 | !--- 95 f034: cl2 + oh -> cl + hocl |
---|
| 5698 | !=============================== |
---|
| 5699 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 5700 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5701 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5702 | i_react=i_react+1 |
---|
| 5703 | i_v=i_v+1 |
---|
| 5704 | !=============================== |
---|
| 5705 | !--- 96 f035: clco + o -> co + clo |
---|
| 5706 | !=============================== |
---|
| 5707 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 5708 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5709 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5710 | i_react=i_react+1 |
---|
| 5711 | i_v=i_v+1 |
---|
| 5712 | !=============================== |
---|
| 5713 | !--- 97 f036: clco + cl2 -> cocl2 + cl |
---|
| 5714 | !=============================== |
---|
| 5715 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 5716 | *traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 5717 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5718 | i_react=i_react+1 |
---|
| 5719 | i_v=i_v+1 |
---|
| 5720 | !=============================== |
---|
| 5721 | !--- 98 f037: hcl + h -> h2 + cl |
---|
| 5722 | !=============================== |
---|
| 5723 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 5724 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 5725 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5726 | i_react=i_react+1 |
---|
| 5727 | i_v=i_v+1 |
---|
| 5728 | !=============================== |
---|
| 5729 | !--- 99 f038: clco + h -> hcl + co |
---|
| 5730 | !=============================== |
---|
| 5731 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) |
---|
| 5732 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5733 | i_react=i_react+1 |
---|
| 5734 | i_v=i_v+1 |
---|
| 5735 | !=============================== |
---|
| 5736 | !--- 100 f039: cl + h + m -> hcl + m |
---|
| 5737 | !=============================== |
---|
| 5738 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 5739 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 5740 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5741 | i_react=i_react+1 |
---|
| 5742 | i_v=i_v+1 |
---|
| 5743 | !=============================== |
---|
| 5744 | !--- 101 g001: s + o2 -> so + o |
---|
| 5745 | !=============================== |
---|
| 5746 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5747 | *traceur(i_lev,i_o2)*concentration(i_lev) |
---|
| 5748 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5749 | i_react=i_react+1 |
---|
| 5750 | i_v=i_v+1 |
---|
| 5751 | !=============================== |
---|
| 5752 | !--- 102 g002: s + o3 -> so + o2 |
---|
| 5753 | !=============================== |
---|
| 5754 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5755 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5756 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5757 | i_react=i_react+1 |
---|
| 5758 | i_v=i_v+1 |
---|
| 5759 | !=============================== |
---|
| 5760 | !--- 103 g003: so + o2 -> so2 + o |
---|
| 5761 | !=============================== |
---|
| 5762 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 5763 | *traceur(i_lev,i_o2)*concentration(i_lev) |
---|
| 5764 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5765 | i_react=i_react+1 |
---|
| 5766 | i_v=i_v+1 |
---|
| 5767 | !=============================== |
---|
| 5768 | !--- 104 g004: so + o3 -> so2 + o2 |
---|
| 5769 | !=============================== |
---|
| 5770 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 5771 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5772 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5773 | i_react=i_react+1 |
---|
| 5774 | i_v=i_v+1 |
---|
| 5775 | !=============================== |
---|
| 5776 | !--- 105 g005: so + oh -> so2 + h |
---|
| 5777 | !=============================== |
---|
| 5778 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 5779 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5780 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5781 | i_react=i_react+1 |
---|
| 5782 | i_v=i_v+1 |
---|
| 5783 | !=============================== |
---|
| 5784 | !--- 106 g006: s + oh -> so + h |
---|
| 5785 | !=============================== |
---|
| 5786 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5787 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5788 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5789 | i_react=i_react+1 |
---|
| 5790 | i_v=i_v+1 |
---|
| 5791 | !=============================== |
---|
| 5792 | !--- 107 g007: so + o + co2 -> so2 + co2 |
---|
| 5793 | !=============================== |
---|
| 5794 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 5795 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5796 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5797 | i_react=i_react+1 |
---|
| 5798 | i_v=i_v+1 |
---|
| 5799 | !=============================== |
---|
| 5800 | !--- 108 g008: so + ho2 -> so2 + oh |
---|
| 5801 | !=============================== |
---|
| 5802 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 5803 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5804 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5805 | i_react=i_react+1 |
---|
| 5806 | i_v=i_v+1 |
---|
| 5807 | !=============================== |
---|
| 5808 | !--- 109 g009: so2 + o + co2 -> so3 + co2 |
---|
| 5809 | !=============================== |
---|
| 5810 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so2)*concentration(i_lev) & |
---|
| 5811 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5812 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5813 | i_react=i_react+1 |
---|
| 5814 | i_v=i_v+1 |
---|
| 5815 | !=============================== |
---|
| 5816 | !--- 110 g010: s + o + co2 -> so + co2 |
---|
| 5817 | !=============================== |
---|
| 5818 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5819 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5820 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5821 | i_react=i_react+1 |
---|
| 5822 | i_v=i_v+1 |
---|
| 5823 | !=============================== |
---|
| 5824 | !--- 111 g011: so3 + h2o -> h2so4 |
---|
| 5825 | !=============================== |
---|
| 5826 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so3)*concentration(i_lev) & |
---|
| 5827 | *traceur(i_lev,i_h2o)*concentration(i_lev) |
---|
| 5828 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5829 | i_react=i_react+1 |
---|
| 5830 | i_v=i_v+1 |
---|
| 5831 | !=============================== |
---|
| 5832 | !--- 112 g012: so + clo -> so2 + cl |
---|
| 5833 | !=============================== |
---|
| 5834 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 5835 | *traceur(i_lev,i_clo)*concentration(i_lev) |
---|
| 5836 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5837 | i_react=i_react+1 |
---|
| 5838 | i_v=i_v+1 |
---|
| 5839 | !=============================== |
---|
| 5840 | !--- 113 g013: so + so3 -> so2 + so2 |
---|
| 5841 | !=============================== |
---|
| 5842 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 5843 | *traceur(i_lev,i_so3)*concentration(i_lev) |
---|
| 5844 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5845 | i_react=i_react+1 |
---|
| 5846 | i_v=i_v+1 |
---|
| 5847 | !=============================== |
---|
| 5848 | !--- 114 g014: so3 + o -> so2 + o2 |
---|
| 5849 | !=============================== |
---|
| 5850 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so3)*concentration(i_lev) & |
---|
| 5851 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5852 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5853 | i_react=i_react+1 |
---|
| 5854 | i_v=i_v+1 |
---|
| 5855 | !=============================== |
---|
| 5856 | !--- 115 & 116 g017: clco3 + so -> cl + so2 + co2 |
---|
| 5857 | !=============================== |
---|
| 5858 | ! decomposee en : |
---|
| 5859 | ! 0.5 clco3 + 0.5 so -> cl |
---|
| 5860 | ! 0.5 clco3 + 0.5 so -> so2 + co2 |
---|
| 5861 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 5862 | *traceur(i_lev,i_so)*concentration(i_lev) |
---|
| 5863 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5864 | i_react=i_react+1 |
---|
| 5865 | i_v=i_v+1 |
---|
| 5866 | |
---|
| 5867 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 5868 | *traceur(i_lev,i_so)*concentration(i_lev) |
---|
| 5869 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5870 | i_react=i_react+1 |
---|
| 5871 | i_v=i_v+1 |
---|
| 5872 | !=============================== |
---|
| 5873 | !--- 117 g018: s + co + co2 -> ocs + co2 |
---|
| 5874 | !=============================== |
---|
| 5875 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5876 | *traceur(i_lev,i_co)*concentration(i_lev) |
---|
| 5877 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5878 | i_react=i_react+1 |
---|
| 5879 | i_v=i_v+1 |
---|
| 5880 | !=============================== |
---|
| 5881 | !--- 118 g019: clco + s -> ocs + cl |
---|
| 5882 | !=============================== |
---|
| 5883 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 5884 | *traceur(i_lev,i_s)*concentration(i_lev) |
---|
| 5885 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5886 | i_react=i_react+1 |
---|
| 5887 | i_v=i_v+1 |
---|
| 5888 | !=============================== |
---|
| 5889 | !--- 119 g020: so2 + oh + co2 -> hso3 + co2 |
---|
| 5890 | !=============================== |
---|
| 5891 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so2)*concentration(i_lev) & |
---|
| 5892 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 5893 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5894 | i_react=i_react+1 |
---|
| 5895 | i_v=i_v+1 |
---|
| 5896 | !=============================== |
---|
| 5897 | !--- 120 g021: hso3 + o2 -> ho2 + so3 |
---|
| 5898 | !=============================== |
---|
| 5899 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) & |
---|
| 5900 | *traceur(i_lev,i_hso3)*concentration(i_lev) |
---|
| 5901 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5902 | i_react=i_react+1 |
---|
| 5903 | i_v=i_v+1 |
---|
| 5904 | !=============================== |
---|
| 5905 | !--- 121 g024: s2 + o -> so + s |
---|
| 5906 | !=============================== |
---|
| 5907 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) & |
---|
| 5908 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 5909 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5910 | i_react=i_react+1 |
---|
| 5911 | i_v=i_v+1 |
---|
| 5912 | !=============================== |
---|
| 5913 | !--- 122 g025: s + ocs -> s2 + co |
---|
| 5914 | !=============================== |
---|
| 5915 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5916 | *traceur(i_lev,i_ocs)*concentration(i_lev) |
---|
| 5917 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5918 | i_react=i_react+1 |
---|
| 5919 | i_v=i_v+1 |
---|
| 5920 | !=============================== |
---|
| 5921 | !--- 123 g026: ocs + o -> so + co |
---|
| 5922 | !=============================== |
---|
| 5923 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 5924 | *traceur(i_lev,i_ocs)*concentration(i_lev) |
---|
| 5925 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5926 | i_react=i_react+1 |
---|
| 5927 | i_v=i_v+1 |
---|
| 5928 | !=============================== |
---|
| 5929 | !--- 124 g027: s + so3 -> so2 + so |
---|
| 5930 | !=============================== |
---|
| 5931 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5932 | *traceur(i_lev,i_so3)*concentration(i_lev) |
---|
| 5933 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5934 | i_react=i_react+1 |
---|
| 5935 | i_v=i_v+1 |
---|
| 5936 | !=============================== |
---|
| 5937 | !--- 125 g028: s + ho2 -> so + oh |
---|
| 5938 | !=============================== |
---|
| 5939 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5940 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 5941 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5942 | i_react=i_react+1 |
---|
| 5943 | i_v=i_v+1 |
---|
| 5944 | !=============================== |
---|
| 5945 | !--- 126 g029: s + clo -> so + cl |
---|
| 5946 | !=============================== |
---|
| 5947 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 5948 | *traceur(i_lev,i_clo)*concentration(i_lev) |
---|
| 5949 | rate_night(i_lev,i_react) = rate_night(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5950 | i_react=i_react+1 |
---|
| 5951 | i_v=i_v+1 |
---|
| 5952 | END DO |
---|
| 5953 | ELSE |
---|
| 5954 | !=============================== |
---|
| 5955 | ! !!!! JOUR !!!! |
---|
| 5956 | !=============================== |
---|
| 5957 | ! PRINT*,'JOUR' |
---|
| 5958 | |
---|
| 5959 | DO i_lev=1, n_lev |
---|
| 5960 | i_react=1 |
---|
| 5961 | i_v=1 |
---|
| 5962 | !=============================== |
---|
| 5963 | ! 1 o2 + hv -> o + o |
---|
| 5964 | !=============================== |
---|
| 5965 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) |
---|
| 5966 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5967 | i_react=i_react+1 |
---|
| 5968 | i_v=i_v+1 |
---|
| 5969 | !=============================== |
---|
| 5970 | ! 2 o2 + hv -> o + o(1d) |
---|
| 5971 | !=============================== |
---|
| 5972 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) |
---|
| 5973 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5974 | i_react=i_react+1 |
---|
| 5975 | i_v=i_v+1 |
---|
| 5976 | !=============================== |
---|
| 5977 | ! 3 co2 + hv -> co + o |
---|
| 5978 | !=============================== |
---|
| 5979 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_co2)*concentration(i_lev) |
---|
| 5980 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5981 | i_react=i_react+1 |
---|
| 5982 | i_v=i_v+1 |
---|
| 5983 | !=============================== |
---|
| 5984 | ! 4 co2 + hv -> co + o(1d) |
---|
| 5985 | !=============================== |
---|
| 5986 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_co2)*concentration(i_lev) |
---|
| 5987 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5988 | i_react=i_react+1 |
---|
| 5989 | i_v=i_v+1 |
---|
| 5990 | !=============================== |
---|
| 5991 | ! 5 o3 + hv -> o2(Dg) + o(1d) |
---|
| 5992 | !=============================== |
---|
| 5993 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 5994 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 5995 | i_react=i_react+1 |
---|
| 5996 | i_v=i_v+1 |
---|
| 5997 | !=============================== |
---|
| 5998 | ! 6 o3 + hv -> o2 + o |
---|
| 5999 | !=============================== |
---|
| 6000 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 6001 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6002 | i_react=i_react+1 |
---|
| 6003 | i_v=i_v+1 |
---|
| 6004 | !=============================== |
---|
| 6005 | ! 7 h2o + hv -> h + oh |
---|
| 6006 | !=============================== |
---|
| 6007 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_h2o)*concentration(i_lev) |
---|
| 6008 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6009 | i_react=i_react+1 |
---|
| 6010 | i_v=i_v+1 |
---|
| 6011 | !=============================== |
---|
| 6012 | ! 8 ho2 + hv -> oh + o |
---|
| 6013 | !=============================== |
---|
| 6014 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6015 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6016 | i_react=i_react+1 |
---|
| 6017 | i_v=i_v+1 |
---|
| 6018 | !=============================== |
---|
| 6019 | ! 9 h2o2 + hv -> oh + oh |
---|
| 6020 | !=============================== |
---|
| 6021 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_h2o2)*concentration(i_lev) |
---|
| 6022 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6023 | i_react=i_react+1 |
---|
| 6024 | i_v=i_v+1 |
---|
| 6025 | !=============================== |
---|
| 6026 | ! 10 hcl + hv -> h + cl |
---|
| 6027 | !=============================== |
---|
| 6028 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) |
---|
| 6029 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6030 | i_react=i_react+1 |
---|
| 6031 | i_v=i_v+1 |
---|
| 6032 | !=============================== |
---|
| 6033 | ! 11 cl2 + hv -> cl + cl |
---|
| 6034 | !=============================== |
---|
| 6035 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) |
---|
| 6036 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6037 | i_react=i_react+1 |
---|
| 6038 | i_v=i_v+1 |
---|
| 6039 | !=============================== |
---|
| 6040 | ! 12 hocl + hv -> oh + cl |
---|
| 6041 | !=============================== |
---|
| 6042 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_hocl)*concentration(i_lev) |
---|
| 6043 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6044 | i_react=i_react+1 |
---|
| 6045 | i_v=i_v+1 |
---|
| 6046 | !=============================== |
---|
| 6047 | ! 13 so2 + hv -> so + o |
---|
| 6048 | !=============================== |
---|
| 6049 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_so2)*concentration(i_lev) |
---|
| 6050 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6051 | i_react=i_react+1 |
---|
| 6052 | i_v=i_v+1 |
---|
| 6053 | !=============================== |
---|
| 6054 | ! 14 so + hv -> s + o |
---|
| 6055 | !=============================== |
---|
| 6056 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) |
---|
| 6057 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6058 | i_react=i_react+1 |
---|
| 6059 | i_v=i_v+1 |
---|
| 6060 | !=============================== |
---|
| 6061 | ! 15 so3 + hv -> so2 + o |
---|
| 6062 | !=============================== |
---|
| 6063 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_so3)*concentration(i_lev) |
---|
| 6064 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6065 | i_react=i_react+1 |
---|
| 6066 | i_v=i_v+1 |
---|
| 6067 | !=============================== |
---|
| 6068 | ! 16 clo + hv -> cl + o |
---|
| 6069 | !=============================== |
---|
| 6070 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) |
---|
| 6071 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6072 | i_react=i_react+1 |
---|
| 6073 | i_v=i_v+1 |
---|
| 6074 | !=============================== |
---|
| 6075 | ! 17 ocs + hv -> co + s |
---|
| 6076 | !=============================== |
---|
| 6077 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_ocs)*concentration(i_lev) |
---|
| 6078 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6079 | i_react=i_react+1 |
---|
| 6080 | i_v=i_v+1 |
---|
| 6081 | !=============================== |
---|
| 6082 | ! 18 cocl2 + hv -> cl + cl + co |
---|
| 6083 | !=============================== |
---|
| 6084 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_cocl2)*concentration(i_lev) |
---|
| 6085 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6086 | i_react=i_react+1 |
---|
| 6087 | i_v=i_v+1 |
---|
| 6088 | !=============================== |
---|
| 6089 | ! 19 h2so4 + hv -> so3 + h2o |
---|
| 6090 | !=============================== |
---|
| 6091 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_h2so4)*concentration(i_lev) |
---|
| 6092 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6093 | i_react=i_react+1 |
---|
| 6094 | i_v=i_v+1 |
---|
| 6095 | !=============================== |
---|
| 6096 | ! 20 o(1d) + co2 -> o + co2 |
---|
| 6097 | !=============================== |
---|
| 6098 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 6099 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6100 | i_react=i_react+1 |
---|
| 6101 | i_v=i_v+1 |
---|
| 6102 | !=============================== |
---|
| 6103 | ! 21 o(1d) + o2 -> o + o2 |
---|
| 6104 | !=============================== |
---|
| 6105 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 6106 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6107 | i_react=i_react+1 |
---|
| 6108 | i_v=i_v+1 |
---|
| 6109 | !=============================== |
---|
| 6110 | ! 22 clco + co2 -> cl + co + co2 |
---|
| 6111 | !=============================== |
---|
| 6112 | rate_local = vphot(i_lev,22)*traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 6113 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6114 | i_react=i_react+1 |
---|
| 6115 | i_v=i_v+1 |
---|
| 6116 | !=============================== |
---|
| 6117 | ! 23 s2o2 + co2 -> 2so + co2 |
---|
| 6118 | !=============================== |
---|
| 6119 | rate_local = vphot(i_lev,23)*traceur(i_lev,i_s2o2)*concentration(i_lev) |
---|
| 6120 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6121 | i_react=i_react+1 |
---|
| 6122 | i_v=i_v+1 |
---|
| 6123 | !=============================== |
---|
| 6124 | ! 24 s2 + co2 -> 2s + co2 |
---|
| 6125 | !=============================== |
---|
| 6126 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) |
---|
| 6127 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6128 | i_react=i_react+1 |
---|
| 6129 | i_v=i_v+1 |
---|
| 6130 | !=============================== |
---|
| 6131 | ! 25 ICE |
---|
| 6132 | !=============================== |
---|
| 6133 | i_react=i_react+1 |
---|
| 6134 | i_v=i_v+1 |
---|
| 6135 | !=============================== |
---|
| 6136 | ! 26 ICE |
---|
| 6137 | !=============================== |
---|
| 6138 | i_react=i_react+1 |
---|
| 6139 | i_v=i_v+1 |
---|
| 6140 | !=============================== |
---|
| 6141 | ! 27 ICE |
---|
| 6142 | !=============================== |
---|
| 6143 | i_react=i_react+1 |
---|
| 6144 | i_v=i_v+1 |
---|
| 6145 | !=============================== |
---|
| 6146 | ! 28 ICE |
---|
| 6147 | !=============================== |
---|
| 6148 | i_react=i_react+1 |
---|
| 6149 | i_v=i_v+1 |
---|
| 6150 | !=============================== |
---|
| 6151 | ! 29 ICE |
---|
| 6152 | !=============================== |
---|
| 6153 | i_react=i_react+1 |
---|
| 6154 | i_v=i_v+1 |
---|
| 6155 | !=============================== |
---|
[2795] | 6156 | ! 30 o2(Dg) + CO2 -> O2 + CO2 |
---|
[2187] | 6157 | !=============================== |
---|
| 6158 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o2dg)*concentration(i_lev) |
---|
| 6159 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6160 | i_react=i_react+1 |
---|
| 6161 | i_v=i_v+1 |
---|
| 6162 | !=============================== |
---|
| 6163 | ! 31 o2(Dg) -> O2 + hv |
---|
| 6164 | !=============================== |
---|
| 6165 | rate_local = vphot(i_lev,i_v)*traceur(i_lev,i_o2dg)*concentration(i_lev) |
---|
| 6166 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6167 | i_react=i_react+1 |
---|
| 6168 | i_v=i_v+1 |
---|
| 6169 | |
---|
| 6170 | ! DEBUT DES REACTION V3 |
---|
| 6171 | i_v = i_v - nb_phot_max |
---|
| 6172 | !=============================== |
---|
| 6173 | !--- 32 a002: o + o + co2 -> o2 + co2 |
---|
| 6174 | !=============================== |
---|
| 6175 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 6176 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6177 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6178 | i_react=i_react+1 |
---|
| 6179 | i_v=i_v+1 |
---|
| 6180 | !=============================== |
---|
| 6181 | !--- 33 c008: ho2 + ho2 -> h2o2 + o2 |
---|
| 6182 | !=============================== |
---|
| 6183 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_ho2)*concentration(i_lev) & |
---|
| 6184 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6185 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6186 | i_react=i_react+1 |
---|
| 6187 | i_v=i_v+1 |
---|
| 6188 | !=============================== |
---|
| 6189 | !--- 34 c013: oh + oh -> h2o + o |
---|
| 6190 | !=============================== |
---|
| 6191 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 6192 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6193 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6194 | i_react=i_react+1 |
---|
| 6195 | i_v=i_v+1 |
---|
| 6196 | !=============================== |
---|
| 6197 | !--- 35 c016: ho2 + ho2 + co2 -> h2o2 + o2 + co2 |
---|
| 6198 | !=============================== |
---|
| 6199 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_ho2)*concentration(i_lev) & |
---|
| 6200 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6201 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6202 | i_react=i_react+1 |
---|
| 6203 | i_v=i_v+1 |
---|
| 6204 | !=============================== |
---|
| 6205 | !--- 36 c017: oh + oh + co2 -> h2o2 + co2 |
---|
| 6206 | !=============================== |
---|
| 6207 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 6208 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6209 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6210 | i_react=i_react+1 |
---|
| 6211 | i_v=i_v+1 |
---|
| 6212 | !=============================== |
---|
| 6213 | !--- 37 c018: h + h + co2 -> h2 + co2 |
---|
| 6214 | !=============================== |
---|
| 6215 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 6216 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 6217 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6218 | i_react=i_react+1 |
---|
| 6219 | i_v=i_v+1 |
---|
| 6220 | !=============================== |
---|
| 6221 | !--- 38 f021: cl + cl + co2 -> cl2 + co2 |
---|
| 6222 | !=============================== |
---|
| 6223 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6224 | *traceur(i_lev,i_cl)*concentration(i_lev) |
---|
| 6225 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6226 | i_react=i_react+1 |
---|
| 6227 | i_v=i_v+1 |
---|
| 6228 | !=============================== |
---|
| 6229 | !--- 39 f026: clco + clco -> cocl2 + co |
---|
| 6230 | !=============================== |
---|
| 6231 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 6232 | *traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 6233 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6234 | i_react=i_react+1 |
---|
| 6235 | i_v=i_v+1 |
---|
| 6236 | !=============================== |
---|
| 6237 | !--- 40 f030: clso2 + clso2 -> cl2 + so2 + so2 |
---|
| 6238 | !=============================== |
---|
| 6239 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_clso2)*concentration(i_lev) & |
---|
| 6240 | *traceur(i_lev,i_clso2)*concentration(i_lev) |
---|
| 6241 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6242 | i_react=i_react+1 |
---|
| 6243 | i_v=i_v+1 |
---|
| 6244 | !=============================== |
---|
| 6245 | !--- 41 g015: so + so + co2 -> s2o2 + co2 |
---|
| 6246 | !=============================== |
---|
| 6247 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 6248 | *traceur(i_lev,i_so)*concentration(i_lev) |
---|
| 6249 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6250 | i_react=i_react+1 |
---|
| 6251 | i_v=i_v+1 |
---|
| 6252 | !=============================== |
---|
| 6253 | !--- 42 g022: s + s + co2 -> s2 + co2 |
---|
| 6254 | !=============================== |
---|
| 6255 | rate_local = v3(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6256 | *traceur(i_lev,i_s)*concentration(i_lev) |
---|
| 6257 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6258 | i_react=i_react+1 |
---|
| 6259 | i_v=i_v+1 |
---|
| 6260 | |
---|
| 6261 | ! DEBUT DES REACTION V4 |
---|
| 6262 | |
---|
| 6263 | i_v = i_v - nb_reaction_3_max |
---|
| 6264 | |
---|
| 6265 | !=============================== |
---|
| 6266 | !--- 43 a001: o + o2 + co2 -> o3 + co2 |
---|
| 6267 | !=============================== |
---|
| 6268 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) & |
---|
| 6269 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6270 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6271 | i_react=i_react+1 |
---|
| 6272 | i_v=i_v+1 |
---|
| 6273 | !=============================== |
---|
| 6274 | !--- 44 a003: o + o3 -> o2 + o2 |
---|
| 6275 | !=============================== |
---|
| 6276 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o3)*concentration(i_lev) & |
---|
| 6277 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6278 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6279 | i_react=i_react+1 |
---|
| 6280 | i_v=i_v+1 |
---|
| 6281 | !=============================== |
---|
| 6282 | !--- 45 b002: o(1d) + h2o -> oh + oh |
---|
| 6283 | !=============================== |
---|
| 6284 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) & |
---|
| 6285 | *traceur(i_lev,i_h2o)*concentration(i_lev) |
---|
| 6286 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6287 | i_react=i_react+1 |
---|
| 6288 | i_v=i_v+1 |
---|
| 6289 | !=============================== |
---|
| 6290 | !--- 46 b003: o(1d) + h2 -> oh + h |
---|
| 6291 | !=============================== |
---|
| 6292 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) & |
---|
| 6293 | *traceur(i_lev,i_h2)*concentration(i_lev) |
---|
| 6294 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6295 | i_react=i_react+1 |
---|
| 6296 | i_v=i_v+1 |
---|
| 6297 | !=============================== |
---|
| 6298 | !--- 47 b005: o(1d) + o3 -> o2 + o2 |
---|
| 6299 | !=============================== |
---|
| 6300 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) & |
---|
| 6301 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 6302 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6303 | i_react=i_react+1 |
---|
| 6304 | i_v=i_v+1 |
---|
| 6305 | !=============================== |
---|
| 6306 | !--- 48 b006: o(1d) + o3 -> o2 + o + o |
---|
| 6307 | !=============================== |
---|
| 6308 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o1d)*concentration(i_lev) & |
---|
| 6309 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 6310 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6311 | i_react=i_react+1 |
---|
| 6312 | i_v=i_v+1 |
---|
| 6313 | !=============================== |
---|
| 6314 | !--- 49 c001: o + ho2 -> oh + o2 |
---|
| 6315 | !=============================== |
---|
| 6316 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 6317 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6318 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6319 | i_react=i_react+1 |
---|
| 6320 | i_v=i_v+1 |
---|
| 6321 | !=============================== |
---|
| 6322 | !--- 50 c002: o + oh -> o2 + h |
---|
| 6323 | !=============================== |
---|
| 6324 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) |
---|
| 6325 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6326 | i_react=i_react+1 |
---|
| 6327 | i_v=i_v+1 |
---|
| 6328 | !=============================== |
---|
| 6329 | !--- 51 c003: h + o3 -> oh + o2 |
---|
| 6330 | !=============================== |
---|
| 6331 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 6332 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 6333 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6334 | i_react=i_react+1 |
---|
| 6335 | i_v=i_v+1 |
---|
| 6336 | !=============================== |
---|
| 6337 | !--- 52 c004: h + ho2 -> oh + oh |
---|
| 6338 | !=============================== |
---|
| 6339 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 6340 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6341 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6342 | i_react=i_react+1 |
---|
| 6343 | i_v=i_v+1 |
---|
| 6344 | !=============================== |
---|
| 6345 | !--- 53 c005: h + ho2 -> h2 + o2 |
---|
| 6346 | !=============================== |
---|
| 6347 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 6348 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6349 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6350 | i_react=i_react+1 |
---|
| 6351 | i_v=i_v+1 |
---|
| 6352 | !=============================== |
---|
| 6353 | !--- 54 c006: h + ho2 -> h2o + o |
---|
| 6354 | !=============================== |
---|
| 6355 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_h)*concentration(i_lev) & |
---|
| 6356 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6357 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6358 | i_react=i_react+1 |
---|
| 6359 | i_v=i_v+1 |
---|
| 6360 | !=============================== |
---|
| 6361 | !--- 55 c007: oh + ho2 -> h2o + o2 |
---|
| 6362 | !=============================== |
---|
| 6363 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 6364 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6365 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6366 | i_react=i_react+1 |
---|
| 6367 | i_v=i_v+1 |
---|
| 6368 | !=============================== |
---|
| 6369 | !--- 56 c009: oh + h2o2 -> h2o + ho2 |
---|
| 6370 | !=============================== |
---|
| 6371 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 6372 | *traceur(i_lev,i_h2o2)*concentration(i_lev) |
---|
| 6373 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6374 | i_react=i_react+1 |
---|
| 6375 | i_v=i_v+1 |
---|
| 6376 | !=============================== |
---|
| 6377 | !--- 57 c010: oh + h2 -> h2o + h |
---|
| 6378 | !=============================== |
---|
| 6379 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 6380 | *traceur(i_lev,i_h2)*concentration(i_lev) |
---|
| 6381 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6382 | i_react=i_react+1 |
---|
| 6383 | i_v=i_v+1 |
---|
| 6384 | !=============================== |
---|
| 6385 | !--- 58 c011: h + o2 + co2 -> ho2 + co2 |
---|
| 6386 | !=============================== |
---|
| 6387 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) & |
---|
| 6388 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 6389 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6390 | i_react=i_react+1 |
---|
| 6391 | i_v=i_v+1 |
---|
| 6392 | !=============================== |
---|
| 6393 | !--- 59 c012: o + h2o2 -> oh + ho2 |
---|
| 6394 | !=============================== |
---|
| 6395 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 6396 | *traceur(i_lev,i_h2o2)*concentration(i_lev) |
---|
| 6397 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6398 | i_react=i_react+1 |
---|
| 6399 | i_v=i_v+1 |
---|
| 6400 | !=============================== |
---|
| 6401 | !--- 60 c014: oh + o3 -> ho2 + o2 |
---|
| 6402 | !=============================== |
---|
| 6403 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 6404 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 6405 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6406 | i_react=i_react+1 |
---|
| 6407 | i_v=i_v+1 |
---|
| 6408 | !=============================== |
---|
| 6409 | !--- 61 c015: ho2 + o3 -> oh + o2 + o2 |
---|
| 6410 | !=============================== |
---|
| 6411 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o3)*concentration(i_lev) & |
---|
| 6412 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6413 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6414 | i_react=i_react+1 |
---|
| 6415 | i_v=i_v+1 |
---|
| 6416 | !=============================== |
---|
| 6417 | !--- 62 e001: oh + co -> co2 + h |
---|
| 6418 | !=============================== |
---|
| 6419 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) |
---|
| 6420 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6421 | i_react=i_react+1 |
---|
| 6422 | i_v=i_v+1 |
---|
| 6423 | !=============================== |
---|
| 6424 | !--- 63 e002: o + co + m -> co2 + m |
---|
| 6425 | !=============================== |
---|
| 6426 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 6427 | *traceur(i_lev,i_co)*concentration(i_lev) |
---|
| 6428 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6429 | i_react=i_react+1 |
---|
| 6430 | i_v=i_v+1 |
---|
| 6431 | !=============================== |
---|
| 6432 | !--- 64 f001: hcl + o(1d) -> oh + cl |
---|
| 6433 | !=============================== |
---|
| 6434 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 6435 | *traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 6436 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6437 | i_react=i_react+1 |
---|
| 6438 | i_v=i_v+1 |
---|
| 6439 | !=============================== |
---|
| 6440 | !--- 65 f002: hcl + o(1d) -> h + clo |
---|
| 6441 | !=============================== |
---|
| 6442 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 6443 | *traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 6444 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6445 | i_react=i_react+1 |
---|
| 6446 | i_v=i_v+1 |
---|
| 6447 | !=============================== |
---|
| 6448 | !--- 66 f003: hcl + o -> oh + cl |
---|
| 6449 | !=============================== |
---|
| 6450 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 6451 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6452 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6453 | i_react=i_react+1 |
---|
| 6454 | i_v=i_v+1 |
---|
| 6455 | !=============================== |
---|
| 6456 | !--- 67 f004: hcl + oh -> h2o + cl |
---|
| 6457 | !=============================== |
---|
| 6458 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 6459 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6460 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6461 | i_react=i_react+1 |
---|
| 6462 | i_v=i_v+1 |
---|
| 6463 | !=============================== |
---|
| 6464 | !--- 68 f005: clo + o -> cl + o2 |
---|
| 6465 | !=============================== |
---|
| 6466 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) & |
---|
| 6467 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6468 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6469 | i_react=i_react+1 |
---|
| 6470 | i_v=i_v+1 |
---|
| 6471 | !=============================== |
---|
| 6472 | !--- 69 f006: clo + oh -> cl + ho2 |
---|
| 6473 | !=============================== |
---|
| 6474 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) & |
---|
| 6475 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6476 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6477 | i_react=i_react+1 |
---|
| 6478 | i_v=i_v+1 |
---|
| 6479 | !=============================== |
---|
| 6480 | !--- 70 f007: clo + oh -> hcl + o2 |
---|
| 6481 | !=============================== |
---|
| 6482 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) & |
---|
| 6483 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6484 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6485 | i_react=i_react+1 |
---|
| 6486 | i_v=i_v+1 |
---|
| 6487 | !=============================== |
---|
| 6488 | !--- 71 f008: cl + h2 -> hcl + h |
---|
| 6489 | !=============================== |
---|
| 6490 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6491 | *traceur(i_lev,i_h2)*concentration(i_lev) |
---|
| 6492 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6493 | i_react=i_react+1 |
---|
| 6494 | i_v=i_v+1 |
---|
| 6495 | !=============================== |
---|
| 6496 | !--- 72 f009: cl + o3 -> clo + o2 |
---|
| 6497 | !=============================== |
---|
| 6498 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6499 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 6500 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6501 | i_react=i_react+1 |
---|
| 6502 | i_v=i_v+1 |
---|
| 6503 | !=============================== |
---|
| 6504 | !--- 73 f010: cl + ho2 -> clo + oh |
---|
| 6505 | !=============================== |
---|
| 6506 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6507 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6508 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6509 | i_react=i_react+1 |
---|
| 6510 | i_v=i_v+1 |
---|
| 6511 | !=============================== |
---|
| 6512 | !--- 74 f011: cl + ho2 -> hcl + o2 |
---|
| 6513 | !=============================== |
---|
| 6514 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6515 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6516 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6517 | i_react=i_react+1 |
---|
| 6518 | i_v=i_v+1 |
---|
| 6519 | !=============================== |
---|
| 6520 | !--- 75 f012: cl + h2o2 -> hcl + ho2 |
---|
| 6521 | !=============================== |
---|
| 6522 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6523 | *traceur(i_lev,i_h2o2)*concentration(i_lev) |
---|
| 6524 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6525 | i_react=i_react+1 |
---|
| 6526 | i_v=i_v+1 |
---|
| 6527 | !=============================== |
---|
| 6528 | !--- 76 f013: cl + co + co2 -> clco + co2 |
---|
| 6529 | !=============================== |
---|
| 6530 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6531 | *traceur(i_lev,i_co)*concentration(i_lev) |
---|
| 6532 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6533 | i_react=i_react+1 |
---|
| 6534 | i_v=i_v+1 |
---|
| 6535 | !=============================== |
---|
| 6536 | !--- 77 f015: clco + o2 + m -> clco3 + m |
---|
| 6537 | !=============================== |
---|
| 6538 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) & |
---|
| 6539 | *traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 6540 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6541 | i_react=i_react+1 |
---|
| 6542 | i_v=i_v+1 |
---|
| 6543 | !=============================== |
---|
| 6544 | !--- 78 & 79 f016: clco3 + cl -> cl + clo + co2 |
---|
| 6545 | !=============================== |
---|
| 6546 | ! decomposee en : |
---|
| 6547 | ! 0.5 clco3 + 0.5 cl -> cl + 0.5 co2 |
---|
| 6548 | ! 0.5 clco3 + 0.5 cl -> clo + 0.5 co2 |
---|
| 6549 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 6550 | *traceur(i_lev,i_cl)*concentration(i_lev) |
---|
| 6551 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6552 | i_react=i_react+1 |
---|
| 6553 | i_v=i_v+1 |
---|
| 6554 | |
---|
| 6555 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 6556 | *traceur(i_lev,i_cl)*concentration(i_lev) |
---|
| 6557 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6558 | i_react=i_react+1 |
---|
| 6559 | i_v=i_v+1 |
---|
| 6560 | !=============================== |
---|
| 6561 | !--- 80 & 81 f017: clco3 + o -> cl + o2 + co2 |
---|
| 6562 | !=============================== |
---|
| 6563 | ! decomposee en : |
---|
| 6564 | ! 0.5 clco3 + 0.5 o -> cl |
---|
| 6565 | ! 0.5 clco3 + 0.5 o -> o2 + co2 |
---|
| 6566 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 6567 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6568 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6569 | i_react=i_react+1 |
---|
| 6570 | i_v=i_v+1 |
---|
| 6571 | |
---|
| 6572 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 6573 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6574 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6575 | i_react=i_react+1 |
---|
| 6576 | i_v=i_v+1 |
---|
| 6577 | !=============================== |
---|
| 6578 | !--- 82 f018: clo + ho2 -> hocl + o2 |
---|
| 6579 | !=============================== |
---|
| 6580 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clo)*concentration(i_lev) & |
---|
| 6581 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6582 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6583 | i_react=i_react+1 |
---|
| 6584 | i_v=i_v+1 |
---|
| 6585 | !=============================== |
---|
| 6586 | !--- 83 f019: oh + hocl -> h2o + clo |
---|
| 6587 | !=============================== |
---|
| 6588 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_oh)*concentration(i_lev) & |
---|
| 6589 | *traceur(i_lev,i_hocl)*concentration(i_lev) |
---|
| 6590 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6591 | i_react=i_react+1 |
---|
| 6592 | i_v=i_v+1 |
---|
| 6593 | !=============================== |
---|
| 6594 | !--- 84 f020: o + hocl -> oh + clo |
---|
| 6595 | !=============================== |
---|
| 6596 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hocl)*concentration(i_lev) & |
---|
| 6597 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6598 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6599 | i_react=i_react+1 |
---|
| 6600 | i_v=i_v+1 |
---|
| 6601 | !=============================== |
---|
| 6602 | !--- 85 f022: clco + o -> cl + co2 |
---|
| 6603 | !=============================== |
---|
| 6604 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 6605 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6606 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6607 | i_react=i_react+1 |
---|
| 6608 | i_v=i_v+1 |
---|
| 6609 | !=============================== |
---|
| 6610 | !--- 86 f023: cl2 + o(1d) -> cl + clo |
---|
| 6611 | !=============================== |
---|
| 6612 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 6613 | *traceur(i_lev,i_o1d)*concentration(i_lev) |
---|
| 6614 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6615 | i_react=i_react+1 |
---|
| 6616 | i_v=i_v+1 |
---|
| 6617 | !=============================== |
---|
| 6618 | !--- 87 f024: cl2 + h -> hcl + cl |
---|
| 6619 | !============================== |
---|
| 6620 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 6621 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 6622 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6623 | i_react=i_react+1 |
---|
| 6624 | i_v=i_v+1 |
---|
| 6625 | !=============================== |
---|
| 6626 | !--- 88 f025: cl + clco -> cl2 + co |
---|
| 6627 | !=============================== |
---|
| 6628 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6629 | *traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 6630 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6631 | i_react=i_react+1 |
---|
| 6632 | i_v=i_v+1 |
---|
| 6633 | !=============================== |
---|
| 6634 | !--- 89 f027: cl + so2 + co2 -> clso2 + co2 |
---|
| 6635 | !=============================== |
---|
| 6636 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so2)*concentration(i_lev) & |
---|
| 6637 | *traceur(i_lev,i_cl)*concentration(i_lev) |
---|
| 6638 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6639 | i_react=i_react+1 |
---|
| 6640 | i_v=i_v+1 |
---|
| 6641 | !=============================== |
---|
| 6642 | !--- 90 f028: clso2 + o -> so2 + clo |
---|
| 6643 | !=============================== |
---|
| 6644 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clso2)*concentration(i_lev) & |
---|
| 6645 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6646 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6647 | i_react=i_react+1 |
---|
| 6648 | i_v=i_v+1 |
---|
| 6649 | !=============================== |
---|
| 6650 | !--- 91 f029: clso2 + h -> so2 + hcl |
---|
| 6651 | !=============================== |
---|
| 6652 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clso2)*concentration(i_lev) & |
---|
| 6653 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 6654 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6655 | i_react=i_react+1 |
---|
| 6656 | i_v=i_v+1 |
---|
| 6657 | !=============================== |
---|
| 6658 | !--- 92 f031: cl + o + co2 -> clo + co2 |
---|
| 6659 | !=============================== |
---|
| 6660 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6661 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6662 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6663 | i_react=i_react+1 |
---|
| 6664 | i_v=i_v+1 |
---|
| 6665 | !=============================== |
---|
| 6666 | !--- 93 f032: cl2 + o -> clo + cl |
---|
| 6667 | !=============================== |
---|
| 6668 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 6669 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6670 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6671 | i_react=i_react+1 |
---|
| 6672 | i_v=i_v+1 |
---|
| 6673 | !=============================== |
---|
| 6674 | !--- 94 f033: clco + oh -> hocl + co |
---|
| 6675 | !=============================== |
---|
| 6676 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 6677 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6678 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6679 | i_react=i_react+1 |
---|
| 6680 | i_v=i_v+1 |
---|
| 6681 | !=============================== |
---|
| 6682 | !--- 95 f034: cl2 + oh -> cl + hocl |
---|
| 6683 | !=============================== |
---|
| 6684 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 6685 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6686 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6687 | i_react=i_react+1 |
---|
| 6688 | i_v=i_v+1 |
---|
| 6689 | !=============================== |
---|
| 6690 | !--- 96 f035: clco + o -> co + clo |
---|
| 6691 | !=============================== |
---|
| 6692 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 6693 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6694 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6695 | i_react=i_react+1 |
---|
| 6696 | i_v=i_v+1 |
---|
| 6697 | !=============================== |
---|
| 6698 | !--- 97 f036: clco + cl2 -> cocl2 + cl |
---|
| 6699 | !=============================== |
---|
| 6700 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl2)*concentration(i_lev) & |
---|
| 6701 | *traceur(i_lev,i_clco)*concentration(i_lev) |
---|
| 6702 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6703 | i_react=i_react+1 |
---|
| 6704 | i_v=i_v+1 |
---|
| 6705 | !=============================== |
---|
| 6706 | !--- 98 f037: hcl + h -> h2 + cl |
---|
| 6707 | !=============================== |
---|
| 6708 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_hcl)*concentration(i_lev) & |
---|
| 6709 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 6710 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6711 | i_react=i_react+1 |
---|
| 6712 | i_v=i_v+1 |
---|
| 6713 | !=============================== |
---|
| 6714 | !--- 99 f038: clco + h -> hcl + co |
---|
| 6715 | !=============================== |
---|
| 6716 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) |
---|
| 6717 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6718 | i_react=i_react+1 |
---|
| 6719 | i_v=i_v+1 |
---|
| 6720 | !=============================== |
---|
| 6721 | !--- 100 f039: cl + h + m -> hcl + m |
---|
| 6722 | !=============================== |
---|
| 6723 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_cl)*concentration(i_lev) & |
---|
| 6724 | *traceur(i_lev,i_h)*concentration(i_lev) |
---|
| 6725 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6726 | i_react=i_react+1 |
---|
| 6727 | i_v=i_v+1 |
---|
| 6728 | !=============================== |
---|
| 6729 | !--- 101 g001: s + o2 -> so + o |
---|
| 6730 | !=============================== |
---|
| 6731 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6732 | *traceur(i_lev,i_o2)*concentration(i_lev) |
---|
| 6733 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6734 | i_react=i_react+1 |
---|
| 6735 | i_v=i_v+1 |
---|
| 6736 | !=============================== |
---|
| 6737 | !--- 102 g002: s + o3 -> so + o2 |
---|
| 6738 | !=============================== |
---|
| 6739 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6740 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 6741 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6742 | i_react=i_react+1 |
---|
| 6743 | i_v=i_v+1 |
---|
| 6744 | !=============================== |
---|
| 6745 | !--- 103 g003: so + o2 -> so2 + o |
---|
| 6746 | !=============================== |
---|
| 6747 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 6748 | *traceur(i_lev,i_o2)*concentration(i_lev) |
---|
| 6749 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6750 | i_react=i_react+1 |
---|
| 6751 | i_v=i_v+1 |
---|
| 6752 | !=============================== |
---|
| 6753 | !--- 104 g004: so + o3 -> so2 + o2 |
---|
| 6754 | !=============================== |
---|
| 6755 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 6756 | *traceur(i_lev,i_o3)*concentration(i_lev) |
---|
| 6757 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6758 | i_react=i_react+1 |
---|
| 6759 | i_v=i_v+1 |
---|
| 6760 | !=============================== |
---|
| 6761 | !--- 105 g005: so + oh -> so2 + h |
---|
| 6762 | !=============================== |
---|
| 6763 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 6764 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6765 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6766 | i_react=i_react+1 |
---|
| 6767 | i_v=i_v+1 |
---|
| 6768 | !=============================== |
---|
| 6769 | !--- 106 g006: s + oh -> so + h |
---|
| 6770 | !=============================== |
---|
| 6771 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6772 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6773 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6774 | i_react=i_react+1 |
---|
| 6775 | i_v=i_v+1 |
---|
| 6776 | !=============================== |
---|
| 6777 | !--- 107 g007: so + o + co2 -> so2 + co2 |
---|
| 6778 | !=============================== |
---|
| 6779 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 6780 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6781 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6782 | i_react=i_react+1 |
---|
| 6783 | i_v=i_v+1 |
---|
| 6784 | !=============================== |
---|
| 6785 | !--- 108 g008: so + ho2 -> so2 + oh |
---|
| 6786 | !=============================== |
---|
| 6787 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 6788 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6789 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6790 | i_react=i_react+1 |
---|
| 6791 | i_v=i_v+1 |
---|
| 6792 | !=============================== |
---|
| 6793 | !--- 109 g009: so2 + o + co2 -> so3 + co2 |
---|
| 6794 | !=============================== |
---|
| 6795 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so2)*concentration(i_lev) & |
---|
| 6796 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6797 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6798 | i_react=i_react+1 |
---|
| 6799 | i_v=i_v+1 |
---|
| 6800 | !=============================== |
---|
| 6801 | !--- 110 g010: s + o + co2 -> so + co2 |
---|
| 6802 | !=============================== |
---|
| 6803 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6804 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6805 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6806 | i_react=i_react+1 |
---|
| 6807 | i_v=i_v+1 |
---|
| 6808 | !=============================== |
---|
| 6809 | !--- 111 g011: so3 + h2o -> h2so4 |
---|
| 6810 | !=============================== |
---|
| 6811 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so3)*concentration(i_lev) & |
---|
| 6812 | *traceur(i_lev,i_h2o)*concentration(i_lev) |
---|
| 6813 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6814 | i_react=i_react+1 |
---|
| 6815 | i_v=i_v+1 |
---|
| 6816 | !=============================== |
---|
| 6817 | !--- 112 g012: so + clo -> so2 + cl |
---|
| 6818 | !=============================== |
---|
| 6819 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 6820 | *traceur(i_lev,i_clo)*concentration(i_lev) |
---|
| 6821 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6822 | i_react=i_react+1 |
---|
| 6823 | i_v=i_v+1 |
---|
| 6824 | !=============================== |
---|
| 6825 | !--- 113 g013: so + so3 -> so2 + so2 |
---|
| 6826 | !=============================== |
---|
| 6827 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so)*concentration(i_lev) & |
---|
| 6828 | *traceur(i_lev,i_so3)*concentration(i_lev) |
---|
| 6829 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6830 | i_react=i_react+1 |
---|
| 6831 | i_v=i_v+1 |
---|
| 6832 | !=============================== |
---|
| 6833 | !--- 114 g014: so3 + o -> so2 + o2 |
---|
| 6834 | !=============================== |
---|
| 6835 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so3)*concentration(i_lev) & |
---|
| 6836 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6837 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6838 | i_react=i_react+1 |
---|
| 6839 | i_v=i_v+1 |
---|
| 6840 | !=============================== |
---|
| 6841 | !--- 115 & 116 g017: clco3 + so -> cl + so2 + co2 |
---|
| 6842 | !=============================== |
---|
| 6843 | ! decomposee en : |
---|
| 6844 | ! 0.5 clco3 + 0.5 so -> cl |
---|
| 6845 | ! 0.5 clco3 + 0.5 so -> so2 + co2 |
---|
| 6846 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 6847 | *traceur(i_lev,i_so)*concentration(i_lev) |
---|
| 6848 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6849 | i_react=i_react+1 |
---|
| 6850 | i_v=i_v+1 |
---|
| 6851 | |
---|
| 6852 | rate_local = v4(i_lev,i_v)*0.25*traceur(i_lev,i_clco3)*concentration(i_lev) & |
---|
| 6853 | *traceur(i_lev,i_so)*concentration(i_lev) |
---|
| 6854 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6855 | i_react=i_react+1 |
---|
| 6856 | i_v=i_v+1 |
---|
| 6857 | !=============================== |
---|
| 6858 | !--- 117 g018: s + co + co2 -> ocs + co2 |
---|
| 6859 | !=============================== |
---|
| 6860 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6861 | *traceur(i_lev,i_co)*concentration(i_lev) |
---|
| 6862 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6863 | i_react=i_react+1 |
---|
| 6864 | i_v=i_v+1 |
---|
| 6865 | !=============================== |
---|
| 6866 | !--- 118 g019: clco + s -> ocs + cl |
---|
| 6867 | !=============================== |
---|
| 6868 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_clco)*concentration(i_lev) & |
---|
| 6869 | *traceur(i_lev,i_s)*concentration(i_lev) |
---|
| 6870 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6871 | i_react=i_react+1 |
---|
| 6872 | i_v=i_v+1 |
---|
| 6873 | !=============================== |
---|
| 6874 | !--- 119 g020: so2 + oh + co2 -> hso3 + co2 |
---|
| 6875 | !=============================== |
---|
| 6876 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_so2)*concentration(i_lev) & |
---|
| 6877 | *traceur(i_lev,i_oh)*concentration(i_lev) |
---|
| 6878 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6879 | i_react=i_react+1 |
---|
| 6880 | i_v=i_v+1 |
---|
| 6881 | !=============================== |
---|
| 6882 | !--- 120 g021: hso3 + o2 -> ho2 + so3 |
---|
| 6883 | !=============================== |
---|
| 6884 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o2)*concentration(i_lev) & |
---|
| 6885 | *traceur(i_lev,i_hso3)*concentration(i_lev) |
---|
| 6886 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6887 | i_react=i_react+1 |
---|
| 6888 | i_v=i_v+1 |
---|
| 6889 | !=============================== |
---|
| 6890 | !--- 121 g024: s2 + o -> so + s |
---|
| 6891 | !=============================== |
---|
| 6892 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s2)*concentration(i_lev) & |
---|
| 6893 | *traceur(i_lev,i_o)*concentration(i_lev) |
---|
| 6894 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6895 | i_react=i_react+1 |
---|
| 6896 | i_v=i_v+1 |
---|
| 6897 | !=============================== |
---|
| 6898 | !--- 122 g025: s + ocs -> s2 + co |
---|
| 6899 | !=============================== |
---|
| 6900 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6901 | *traceur(i_lev,i_ocs)*concentration(i_lev) |
---|
| 6902 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6903 | i_react=i_react+1 |
---|
| 6904 | i_v=i_v+1 |
---|
| 6905 | !=============================== |
---|
| 6906 | !--- 123 g026: ocs + o -> so + co |
---|
| 6907 | !=============================== |
---|
| 6908 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_o)*concentration(i_lev) & |
---|
| 6909 | *traceur(i_lev,i_ocs)*concentration(i_lev) |
---|
| 6910 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6911 | i_react=i_react+1 |
---|
| 6912 | i_v=i_v+1 |
---|
| 6913 | !=============================== |
---|
| 6914 | !--- 124 g027: s + so3 -> so2 + so |
---|
| 6915 | !=============================== |
---|
| 6916 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6917 | *traceur(i_lev,i_so3)*concentration(i_lev) |
---|
| 6918 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6919 | i_react=i_react+1 |
---|
| 6920 | i_v=i_v+1 |
---|
| 6921 | !=============================== |
---|
| 6922 | !--- 125 g028: s + ho2 -> so + oh |
---|
| 6923 | !=============================== |
---|
| 6924 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6925 | *traceur(i_lev,i_ho2)*concentration(i_lev) |
---|
| 6926 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6927 | i_react=i_react+1 |
---|
| 6928 | i_v=i_v+1 |
---|
| 6929 | !=============================== |
---|
| 6930 | !--- 126 g029: s + clo -> so + cl |
---|
| 6931 | !=============================== |
---|
| 6932 | rate_local = v4(i_lev,i_v)*traceur(i_lev,i_s)*concentration(i_lev) & |
---|
| 6933 | *traceur(i_lev,i_clo)*concentration(i_lev) |
---|
| 6934 | rate_day(i_lev,i_react) = rate_day(i_lev,i_react) + 2.*rate_local/nbr_pdt |
---|
| 6935 | i_react=i_react+1 |
---|
| 6936 | i_v=i_v+1 |
---|
| 6937 | END DO |
---|
| 6938 | END IF |
---|
| 6939 | cpt_time_rate = cpt_time_rate + 1 |
---|
| 6940 | |
---|
| 6941 | END IF |
---|
| 6942 | |
---|
| 6943 | IF (cpt_time .EQ. (time_tot+nbr_pdt)) THEN |
---|
| 6944 | OPEN(100,file='profile_rate_day.csv') |
---|
| 6945 | DO i_lev=1,n_lev |
---|
| 6946 | write (100,"(128(e15.8,','))")pres(i_lev), temperature(i_lev), (rate_day(i_lev,i_react),i_react=1,126) |
---|
| 6947 | END DO |
---|
| 6948 | |
---|
| 6949 | OPEN(101,file='profile_rate_night.csv') |
---|
| 6950 | DO i_lev=1,n_lev |
---|
| 6951 | write (101,"(128(e15.8,','))") pres(i_lev), temperature(i_lev), (rate_night(i_lev,i_react),i_react=1,126) |
---|
| 6952 | END DO |
---|
| 6953 | |
---|
| 6954 | OPEN(102,file='profile_rate_fullday.csv') |
---|
| 6955 | rate_day=(rate_day+rate_night)/2. |
---|
| 6956 | DO i_lev=1,n_lev |
---|
| 6957 | write (102,"(128(e15.8,','))") pres(i_lev), temperature(i_lev), (rate_day(i_lev,i_react),i_react=1,126) |
---|
| 6958 | END DO |
---|
| 6959 | |
---|
| 6960 | PRINT*,"pression top",pres(n_lev) |
---|
| 6961 | PRINT*,"temp top",temperature(n_lev) |
---|
| 6962 | |
---|
| 6963 | END IF |
---|
| 6964 | |
---|
| 6965 | cpt_time = cpt_time + 1 |
---|
| 6966 | |
---|
| 6967 | END |
---|