1 | !> @file chem_photolysis_mod.f90 |
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2 | !--------------------------------------------------------------------------------------------------! |
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3 | ! This file is part of the PALM model system. |
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4 | ! |
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5 | ! PALM is free software: you can redistribute it and/or modify it under the terms of the GNU General |
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6 | ! Public License as published by the Free Software Foundation, either version 3 of the License, or |
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7 | ! (at your option) any later version. |
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8 | ! |
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9 | ! PALM is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the |
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10 | ! implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General |
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11 | ! Public License for more details. |
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12 | ! |
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13 | ! You should have received a copy of the GNU General Public License along with PALM. If not, see |
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14 | ! <http://www.gnu.org/licenses/>. |
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15 | ! |
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16 | ! Copyright 2018-2021 Leibniz Universitaet Hannover |
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17 | ! Copyright 2018-2021 Karlsruhe Institute of Technology |
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18 | !--------------------------------------------------------------------------------------------------! |
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19 | ! |
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20 | ! Current revisions: |
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21 | ! ----------------- |
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22 | ! |
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23 | ! |
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24 | ! Former revisions: |
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25 | ! ----------------- |
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26 | ! $Id: chem_photolysis_mod.f90 4828 2021-01-05 11:21:41Z scharf $ |
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27 | ! further re-formatting to follow the PALM coding standard |
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28 | ! |
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29 | ! 4559 2020-06-11 08:51:48Z raasch |
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30 | ! file re-formatted to follow the PALM coding standard |
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31 | ! |
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32 | ! 4481 2020-03-31 18:55:54Z maronga |
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33 | ! Change call to calc_zenith |
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34 | ! |
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35 | ! 4223 2019-09-10 09:20:47Z gronemeier |
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36 | ! Corrected "Former revisions" section |
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37 | ! |
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38 | ! 3876 2019-04-08 18:41:49Z knoop |
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39 | ! some formatting and comments added |
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40 | ! |
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41 | ! 3824 2019-03-27 15:56:16Z pavelkrc |
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42 | ! unused variables removed |
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43 | ! |
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44 | ! 2718 2018-01-02 08:49:38Z maronga |
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45 | ! Initial revision |
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46 | ! |
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47 | ! |
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48 | ! Authors: |
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49 | ! -------- |
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50 | ! @author Renate Forkel |
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51 | ! |
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52 | !--------------------------------------------------------------------------------------------------! |
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53 | ! Description: |
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54 | ! ------------ |
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55 | !> photolysis models and interfaces (Adapted from photolysis_model_mod.f90) |
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56 | !> @todo more complex scheme, add shading |
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57 | !--------------------------------------------------------------------------------------------------! |
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58 | MODULE chem_photolysis_mod |
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59 | |
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60 | ! USE arrays_3d, & |
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61 | ! ONLY: dzw, q, ql, zu, zw |
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62 | |
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63 | USE control_parameters, & |
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64 | ONLY: time_since_reference_point |
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65 | |
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66 | USE pegrid, & |
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67 | ONLY: myid, threads_per_task |
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68 | |
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69 | USE indices, & |
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70 | ONLY: nxl, nxlg, nxr, nxrg, nyn, nyng, nys, nysg, nzb, nzt |
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71 | |
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72 | USE control_parameters, & |
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73 | ONLY: initializing_actions |
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74 | |
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75 | USE chem_gasphase_mod, & |
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76 | ONLY: nphot, phot, phot_names |
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77 | |
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78 | USE chem_modules, & |
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79 | ONLY: phot_frequen, photolysis_scheme |
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80 | |
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81 | USE chem_modules, & |
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82 | ONLY: chem_debug2 |
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83 | |
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84 | USE kinds |
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85 | |
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86 | #if defined ( __netcdf ) |
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87 | USE NETCDF |
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88 | #endif |
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89 | |
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90 | |
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91 | IMPLICIT NONE |
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92 | |
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93 | |
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94 | ! LOGICAL :: unscheduled_photolysis_calls = .TRUE., & !< flag parameter indicating whether additional calls of the photolysis |
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95 | ! !< code are allowed |
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96 | ! constant_albedo = .FALSE., & !< flag parameter indicating whether the albedo may change depending on |
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97 | ! !< zenith |
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98 | ! force_photolysis_call = .FALSE., & !< flag parameter for unscheduled photolysis calls |
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99 | ! photolysis = .FALSE., & !< flag parameter indicating whether the photolysis model is used |
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100 | ! sun_up = .TRUE., & !< flag parameter indicating whether the sun is up or down |
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101 | ! photolysis = .TRUE., & !< flag parameter indicing whether photolysis shall be calculated |
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102 | ! sun_direction = .FALSE. !< flag parameter indicing whether solar direction shall be calculated |
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103 | |
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104 | ! |
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105 | !-- Parameters for constant photolysis frequencies |
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106 | INTEGER,PARAMETER :: nconst = 15 !< available predefined photolysis prequencies for constant |
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107 | ! |
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108 | !-- Names for predefined fixed photolysis frequencies at zenith angle 0 |
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109 | CHARACTER(LEN=10), PARAMETER, DIMENSION(nconst) :: names_c = (/ & |
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110 | 'J_O31D ','J_O33P ','J_NO2 ','J_HNO3 ','J_RCHO ', & |
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111 | 'J ','J ','J ','J ','J ', & |
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112 | 'J ','J ','J ','J ','J ' /) |
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113 | ! |
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114 | !-- Photolysis frequency at zenith angle 0 degrees in 1/s |
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115 | REAL(wp), PARAMETER, DIMENSION(nconst) :: phot0 = (/ & |
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116 | 2.489E-05_wp, 3.556E-04_wp, 8.89E-03_wp,5.334E-07_wp, 3.734E-05_wp, & |
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117 | 0.0000E00_wp, 0.0000E00_wp, 0.0000E00_wp,0.0000E00_wp, 0.0000E00_wp, & |
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118 | 0.0000E00_wp, 0.0000E00_wp, 0.0000E00_wp,0.0000E00_wp, 0.0000E00_wp /) |
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119 | ! |
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120 | !-- Parameters for simple photolysis frequencies from MCM (http://mcm.leeds.ac.uk/MCM) |
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121 | !-- Saunders et al., 2003, Atmos. Chem. Phys., 3, 161-180 |
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122 | INTEGER,PARAMETER :: nsimple = 15 !< available predefined photolysis prequencies for simple parameterisation |
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123 | ! |
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124 | !-- Names for simple photolysis frequencies parameterisation ( |
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125 | CHARACTER(LEN=10), PARAMETER, DIMENSION(nsimple) :: names_s = (/ & |
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126 | 'J_O31D ','J_O33P ','J_H2O2 ','J_NO2 ','J_NO3_A ', & |
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127 | 'J_NO3_B ','J_HONO ','J_HNO3 ','J_HCHO_A ','J_HCHO_B ', & |
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128 | 'J_CH3CHO ','J ','J ','J ','J_RCHO ' /) |
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129 | ! |
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130 | !-- Species dependent parameters for simple photolysis frequencies from MCM |
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131 | !-- (http://mcm.leeds.ac.uk/MCM) |
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132 | !-- J = l*COSx@m*EXP(-n*SECx) with l,m,n named par_l etc., x is the zenith angle |
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133 | REAL(wp), PARAMETER, DIMENSION(nconst) :: par_l = (/ & |
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134 | 6.073E-05_wp, 4.775E-04_wp, 1.041E-05_wp, 1.165E-02_wp, 2.485E-02_wp, & |
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135 | 1.747E-01_wp, 2.644E-03_wp, 9.312E-07_wp, 4.642E-05_wp, 6.853E-05_wp, & |
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136 | 7.344E-06_wp, 0.0000E00_wp, 0.0000E00_wp, 0.000E00_wp, 6.853E-05_wp /) |
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137 | |
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138 | REAL(wp), PARAMETER, DIMENSION(nconst) :: par_m = (/ & |
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139 | 1.743_wp, 0.298_wp, 0.723_wp, 0.244_wp, 0.168_wp, & |
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140 | 0.155_wp, 0.261_wp, 1.230_wp, 0.762_wp, 0.477_wp, & |
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141 | 1.202_wp, 0.000_wp, 0.000_wp, 0.000_wp, 0.477_wp /) |
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142 | |
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143 | REAL(wp), PARAMETER, DIMENSION(nconst) :: par_n = (/ & |
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144 | 0.474_wp, 0.080_wp, 0.279_wp, 0.267_wp, 0.108_wp, & |
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145 | 0.125_wp, 0.288_wp, 0.307_wp, 0.353_wp, 0.323_wp, & |
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146 | 0.417_wp, 0.000_wp, 0.000_wp, 0.000_wp, 0.323_wp /) |
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147 | |
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148 | |
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149 | REAL(wp) :: cosz = 0.7_wp !< cosine of fixed zenith angle (45 deg, if not |
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150 | !< specified otherwise) |
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151 | |
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152 | |
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153 | INTERFACE photolysis_constant |
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154 | MODULE PROCEDURE photolysis_constant |
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155 | END INTERFACE photolysis_constant |
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156 | |
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157 | INTERFACE photolysis_simple |
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158 | MODULE PROCEDURE photolysis_simple |
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159 | END INTERFACE photolysis_simple |
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160 | ! |
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161 | ! INTERFACE photolysis_fastj |
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162 | ! MODULE PROCEDURE photolysis_fastj |
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163 | ! END INTERFACE photolysis_fastj |
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164 | ! |
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165 | INTERFACE photolysis_control |
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166 | MODULE PROCEDURE photolysis_control |
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167 | END INTERFACE photolysis_control |
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168 | |
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169 | SAVE |
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170 | |
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171 | PRIVATE |
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172 | |
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173 | PUBLIC photolysis_control |
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174 | |
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175 | PUBLIC photolysis_scheme |
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176 | |
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177 | CONTAINS |
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178 | |
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179 | |
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180 | !--------------------------------------------------------------------------------------------------! |
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181 | ! Description: |
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182 | ! ------------ |
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183 | !> This subroutine controls the calls of the photolysis schemes. |
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184 | !--------------------------------------------------------------------------------------------------! |
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185 | SUBROUTINE photolysis_control |
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186 | |
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187 | IMPLICIT NONE |
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188 | |
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189 | SELECT CASE ( TRIM( photolysis_scheme ) ) |
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190 | |
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191 | CASE ( 'constant' ) |
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192 | CALL photolysis_constant |
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193 | |
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194 | CASE ( 'simple' ) |
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195 | CALL photolysis_simple |
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196 | |
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197 | ! CASE ( 'fastj' ) |
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198 | ! CALL photolysis_fastj |
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199 | |
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200 | CASE DEFAULT |
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201 | |
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202 | END SELECT |
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203 | |
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204 | |
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205 | END SUBROUTINE photolysis_control |
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206 | |
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207 | |
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208 | !--------------------------------------------------------------------------------------------------! |
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209 | ! Description: |
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210 | ! ------------ |
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211 | !> This scheme keeps the prescribed net radiation constant during the run. |
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212 | !> Default zenith angle is 45 deg |
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213 | !--------------------------------------------------------------------------------------------------! |
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214 | SUBROUTINE photolysis_constant |
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215 | |
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216 | IMPLICIT NONE |
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217 | |
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218 | INTEGER(iwp) :: iphot,iav !< loop index for photolysis reaction |
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219 | |
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220 | DO iphot = 1, nphot |
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221 | DO iav = 1, nconst |
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222 | IF ( TRIM( names_c(iav) ) == TRIM( phot_names(iphot) ) ) THEN |
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223 | !-- Prescribe fixed photolysis frequencies [1/s] |
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224 | phot_frequen(iphot)%freq(nzb+1:nzt,:,:) = phot0(iav) * cosz |
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225 | ENDIF |
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226 | ENDDO |
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227 | ENDDO |
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228 | |
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229 | |
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230 | END SUBROUTINE photolysis_constant |
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231 | |
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232 | |
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233 | !--------------------------------------------------------------------------------------------------! |
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234 | ! Description: |
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235 | ! ------------ |
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236 | !> This scheme applies a simple parameterisation for clear sky photolysis frequencies from the |
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237 | !> Master Chemical Mechanism, MCM v3.2 (http://mcm.leeds.ac.uk/MCM). |
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238 | !> Reference: Saunders et al., Atmos. Chem. Phys., 3, 161, 2003 |
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239 | !> J = l*COSx@m*EXP(-n*SECx) with l,m,n named par_l etc., x is the zenith angle |
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240 | !--------------------------------------------------------------------------------------------------! |
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241 | SUBROUTINE photolysis_simple |
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242 | |
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243 | USE palm_date_time_mod, & |
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244 | ONLY: get_date_time |
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245 | |
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246 | USE radiation_model_mod, & |
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247 | ONLY: calc_zenith, cos_zenith |
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248 | |
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249 | IMPLICIT NONE |
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250 | |
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251 | INTEGER(iwp) :: day_of_year !< day of the year |
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252 | INTEGER(iwp) :: iav !< loop indix for photolysis reaction |
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253 | INTEGER(iwp) :: iphot !< loop indix for photolysis reaction |
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254 | |
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255 | REAL(wp) :: coszi !< 1./cosine of zenith angle |
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256 | REAL(wp) :: second_of_day !< second of the day |
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257 | |
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258 | DO iphot = 1, nphot |
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259 | phot_frequen(iphot)%freq = 0.0_wp |
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260 | ENDDO |
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261 | |
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262 | CALL get_date_time( time_since_reference_point, day_of_year = day_of_year, & |
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263 | second_of_day=second_of_day ) |
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264 | CALL calc_zenith( day_of_year, second_of_day ) |
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265 | |
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266 | IF ( cos_zenith > 0.0_wp ) THEN |
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267 | coszi = 1.0_wp / cos_zenith |
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268 | |
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269 | DO iphot = 1, nphot |
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270 | DO iav = 1, nsimple |
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271 | IF ( TRIM( names_s(iav) ) == TRIM( phot_names(iphot) ) ) THEN |
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272 | phot_frequen(iphot)%freq(nzb+1:nzt,:,:) = par_l(iav) * cos_zenith**par_m(iav) * & |
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273 | EXP( - par_n(iav) * coszi ) |
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274 | ENDIF |
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275 | ENDDO |
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276 | ENDDO |
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277 | ENDIF |
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278 | |
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279 | |
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280 | END SUBROUTINE photolysis_simple |
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281 | |
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282 | END MODULE chem_photolysis_mod |
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