| 1 | SUBROUTINE check_isotopes_seq(q, ip1jmp1, err_msg) |
|---|
| 2 | USE strings_mod, ONLY: maxlen, msg, strIdx, strStack, int2str, real2str |
|---|
| 3 | USE infotrac, ONLY: nqtot, niso, nphas, isotope, isoCheck, iqIsoPha, isoSelect, & |
|---|
| 4 | ntiso, iH2O, nzone, tracers, isoName, itZonIso, getKey |
|---|
| 5 | IMPLICIT NONE |
|---|
| 6 | include "dimensions.h" |
|---|
| 7 | REAL, INTENT(INOUT) :: q(ip1jmp1,llm,nqtot) |
|---|
| 8 | INTEGER, INTENT(IN) :: ip1jmp1 |
|---|
| 9 | CHARACTER(LEN=*), INTENT(IN) :: err_msg !--- Error message to display |
|---|
| 10 | CHARACTER(LEN=maxlen) :: modname, msg1, nm(2) |
|---|
| 11 | INTEGER :: ixt, ipha, k, i, iq, iiso, izon, ieau, iqeau, iqpar |
|---|
| 12 | INTEGER, ALLOCATABLE :: ix(:) |
|---|
| 13 | REAL, ALLOCATABLE, SAVE :: tnat(:) |
|---|
| 14 | REAL :: xtractot, xiiso, deltaD, q1, q2 |
|---|
| 15 | REAL, PARAMETER :: borne = 1e19, & |
|---|
| 16 | errmax = 1e-8, & !--- Max. absolute error |
|---|
| 17 | errmaxrel = 1e-3, & !--- Max. relative error |
|---|
| 18 | qmin = 1e-11, & |
|---|
| 19 | deltaDmax =1000.0, & |
|---|
| 20 | deltaDmin =-999.0, & |
|---|
| 21 | ridicule = 1e-12 |
|---|
| 22 | INTEGER, SAVE :: iso_eau, iso_HDO, iso_O18, & |
|---|
| 23 | iso_O17, iso_HTO |
|---|
| 24 | LOGICAL, SAVE :: first=.TRUE. |
|---|
| 25 | |
|---|
| 26 | modname='check_isotopes' |
|---|
| 27 | IF(.NOT.isoCheck) RETURN !--- No need to check => finished |
|---|
| 28 | IF(isoSelect('H2O')) RETURN !--- No H2O isotopes group found |
|---|
| 29 | IF(niso == 0) RETURN !--- No isotopes => finished |
|---|
| 30 | IF(first) THEN |
|---|
| 31 | iso_eau = strIdx(isoName,'H216O') |
|---|
| 32 | iso_HDO = strIdx(isoName,'HDO') |
|---|
| 33 | iso_O18 = strIdx(isoName,'H218O') |
|---|
| 34 | iso_O17 = strIdx(isoName,'H217O') |
|---|
| 35 | iso_HTO = strIdx(isoName,'HTO') |
|---|
| 36 | IF(getKey('tnat', tnat)) CALL abort_gcm(modname, 'missing isotopic parameter', 1) |
|---|
| 37 | first = .FALSE. |
|---|
| 38 | END IF |
|---|
| 39 | CALL msg('31: err_msg='//TRIM(err_msg), modname) |
|---|
| 40 | |
|---|
| 41 | !--- CHECK FOR NaNs (FOR ALL THE ISOTOPES, INCLUDING GEOGRAPHIC TAGGING TRACERS) |
|---|
| 42 | modname = 'check_isotopes:iso_verif_noNaN' |
|---|
| 43 | DO ixt = 1, ntiso |
|---|
| 44 | DO ipha = 1, nphas |
|---|
| 45 | iq = iqIsoPha(ixt,ipha) |
|---|
| 46 | DO k = 1, llm |
|---|
| 47 | DO i = 1, ip1jmp1 |
|---|
| 48 | IF(ABS(q(i,k,iq)) < borne) CYCLE |
|---|
| 49 | WRITE(msg1,'(s,"(",i0,",",i0,",",i0,") = ",ES12.4)')TRIM(isoName(ixt)),i,k,iq,q(i,k,iq) |
|---|
| 50 | CALL msg(msg1, modname) |
|---|
| 51 | CALL abort_gcm(modname, 'Error with isotopes: '//TRIM(err_msg), 1) |
|---|
| 52 | END DO |
|---|
| 53 | END DO |
|---|
| 54 | END DO |
|---|
| 55 | END DO |
|---|
| 56 | |
|---|
| 57 | !--- CHECK CONSERVATION (MAIN ISOTOPE AND PARENT CONCENTRATIONS MUST BE EQUAL) |
|---|
| 58 | modname = 'check_isotopes:iso_verif_egalite' |
|---|
| 59 | ixt = iso_eau |
|---|
| 60 | IF(ixt /= 0) THEN |
|---|
| 61 | DO ipha = 1, nphas |
|---|
| 62 | iq = iqIsoPha(ixt,ipha) |
|---|
| 63 | iqpar = tracers(iq)%iqParent |
|---|
| 64 | DO k = 1, llm |
|---|
| 65 | DO i = 1, ip1jmp1 |
|---|
| 66 | q1 = q(i,k,iqpar) |
|---|
| 67 | q2 = q(i,k,iq) |
|---|
| 68 | !--- IMPROVEMENT in case at least one isotope is not negligible compared to the main isotopic form. |
|---|
| 69 | ! This would be probably required to sum from smallest to highest concentrations ; the corresponding |
|---|
| 70 | ! indices vector can be computed once only (in the initializations stage), using mean concentrations. |
|---|
| 71 | ! q2 = SUM(q(i,k,tracers(iqPar)%iqDesc), DIM=3) |
|---|
| 72 | IF(ABS(q1-q2) <= errmax .OR. ABS(q1-q2)/MAX(MAX(ABS(q1),ABS(q2)),1e-18) <= errmaxrel) THEN |
|---|
| 73 | q(i,k,iq) = q1 !--- Bidouille pour convergence |
|---|
| 74 | ! q(i,k,tracers(iqPar)%iqDesc) = q(i,k,tracers(iqPar)%iqDesc) * q1 / q2 |
|---|
| 75 | CYCLE |
|---|
| 76 | END IF |
|---|
| 77 | CALL msg('ixt, iq = '//TRIM(strStack(int2str([ixt,iq]))), modname) |
|---|
| 78 | msg1 = '('//TRIM(strStack(int2str([i,k])))//')' |
|---|
| 79 | CALL msg(TRIM(tracers(iqpar)%name)//TRIM(msg1)//' = '//TRIM(real2str(q1)), modname) |
|---|
| 80 | CALL msg(TRIM(tracers(iq )%name)//TRIM(msg1)//' = '//TRIM(real2str(q2)), modname) |
|---|
| 81 | CALL abort_gcm(modname, 'Error with isotopes: '//TRIM(err_msg), 1) |
|---|
| 82 | END DO |
|---|
| 83 | END DO |
|---|
| 84 | END DO |
|---|
| 85 | END IF |
|---|
| 86 | |
|---|
| 87 | !--- CHECK DELTA ANOMALIES |
|---|
| 88 | modname = 'check_isotopes:iso_verif_aberrant' |
|---|
| 89 | ix = [ iso_HDO , iso_O18 ] |
|---|
| 90 | nm = ['deltaD ', 'deltaO18'] |
|---|
| 91 | DO iiso = 1, SIZE(ix) |
|---|
| 92 | ixt = ix(iiso) |
|---|
| 93 | IF(ixt == 0) CYCLE |
|---|
| 94 | DO ipha = 1, nphas |
|---|
| 95 | iq = iqIsoPha(ixt,ipha) |
|---|
| 96 | iqpar = tracers(iq)%iqParent |
|---|
| 97 | DO k = 1, llm |
|---|
| 98 | DO i = 1, ip1jmp1 |
|---|
| 99 | q1 = q(i,k,iqpar) |
|---|
| 100 | q2 = q(i,k,iq) |
|---|
| 101 | !--- IMPROVEMENT in case at least one isotope is not negligible compared to the main isotopic form. |
|---|
| 102 | ! This would be probably required to sum from smallest to highest concentrations ; the corresponding |
|---|
| 103 | ! indices vector can be computed once only (in the initializations stage), using mean concentrations. |
|---|
| 104 | ! q2 = SUM(q(i,k,tracers(iqPar)%iqDesc), DIM=3) |
|---|
| 105 | IF(q2 <= qmin) CYCLE |
|---|
| 106 | deltaD = (q2/q1/tnat(ixt)-1.)*1000. |
|---|
| 107 | IF(deltaD <= deltaDmax .AND. deltaD >= deltaDmin) CYCLE |
|---|
| 108 | CALL msg('ixt, iq = '//TRIM(strStack(int2str([ixt,iq]))), modname) |
|---|
| 109 | msg1 = '('//TRIM(strStack(int2str([i,k])))//')' |
|---|
| 110 | CALL msg(TRIM(tracers(iqpar)%name)//TRIM(msg1)//' = '//TRIM(real2str(q1)), modname) |
|---|
| 111 | CALL msg(TRIM(tracers(iq )%name)//TRIM(msg1)//' = '//TRIM(real2str(q2)), modname) |
|---|
| 112 | CALL msg(TRIM(nm(iiso))//TRIM(real2str(deltaD)), modname) |
|---|
| 113 | CALL abort_gcm(modname, 'Error with isotopes: '//TRIM(err_msg), 1) |
|---|
| 114 | END DO |
|---|
| 115 | END DO |
|---|
| 116 | END DO |
|---|
| 117 | END DO |
|---|
| 118 | |
|---|
| 119 | IF(nzone == 0) RETURN |
|---|
| 120 | |
|---|
| 121 | !--- CHECK FOR TAGGING TRACERS DELTAD ANOMALIES |
|---|
| 122 | modname = 'check_isotopes:iso_verif_aberrant' |
|---|
| 123 | IF(iso_eau /= 0 .AND. iso_HDO /= 0) THEN |
|---|
| 124 | DO izon = 1, nzone |
|---|
| 125 | ixt = itZonIso(izon, iso_HDO) |
|---|
| 126 | ieau = itZonIso(izon, iso_eau) |
|---|
| 127 | DO ipha = 1, nphas |
|---|
| 128 | iq = iqIsoPha(ixt, ipha) |
|---|
| 129 | iqeau = iqIsoPha(ieau, ipha) |
|---|
| 130 | DO k = 1, llm |
|---|
| 131 | DO i = 1, ip1jmp1 |
|---|
| 132 | q1 = q(i,k,iqeau) |
|---|
| 133 | q2 = q(i,k,iq) |
|---|
| 134 | IF(q2<=qmin) CYCLE |
|---|
| 135 | deltaD = (q2/q1/tnat(iso_HDO)-1.)*1000. |
|---|
| 136 | IF(deltaD <= deltaDmax .AND. deltaD >= deltaDmin) CYCLE |
|---|
| 137 | CALL msg('izon, ipha = '//TRIM(strStack(int2str([izon, ipha]))), modname) |
|---|
| 138 | CALL msg( 'ixt, ieau = '//TRIM(strStack(int2str([ ixt, ieau]))), modname) |
|---|
| 139 | msg1 = '('//TRIM(strStack(int2str([i,k])))//')' |
|---|
| 140 | CALL msg(TRIM(tracers(iqeau)%name)//TRIM(msg1)//' = '//TRIM(real2str(q1)), modname) |
|---|
| 141 | CALL msg(TRIM(tracers(iq )%name)//TRIM(msg1)//' = '//TRIM(real2str(q2)), modname) |
|---|
| 142 | CALL msg('deltaD = '//TRIM(real2str(deltaD)), modname) |
|---|
| 143 | CALL abort_gcm(modname, 'Error with isotopes: '//TRIM(err_msg), 1) |
|---|
| 144 | END DO |
|---|
| 145 | END DO |
|---|
| 146 | END DO |
|---|
| 147 | END DO |
|---|
| 148 | END IF |
|---|
| 149 | |
|---|
| 150 | !--- CHECK FOR TAGGING TRACERS CONSERVATION (PARENT AND TAGGING TRACERS SUM OVER ALL REGIONS MUST BE EQUAL) |
|---|
| 151 | DO iiso = 1, niso |
|---|
| 152 | DO ipha = 1, nphas |
|---|
| 153 | iq = iqIsoPha(iiso, ipha) |
|---|
| 154 | DO k = 1, llm |
|---|
| 155 | DO i = 1, ip1jmp1 |
|---|
| 156 | xiiso = q(i,k,iq) |
|---|
| 157 | xtractot = SUM(q(i, k, iqIsoPha(itZonIso(1:nzone,iiso), ipha))) |
|---|
| 158 | IF(ABS(xtractot-xiiso) > errmax .AND. ABS(xtractot-xiiso)/MAX(MAX(ABS(xtractot),ABS(xiiso)),1e-18) > errmaxrel) THEN |
|---|
| 159 | CALL msg('Error in iso_verif_aberrant trac: '//TRIM(err_msg)) |
|---|
| 160 | CALL msg('iiso, ipha = '//TRIM(strStack(int2str([iiso, ipha]))), modname) |
|---|
| 161 | CALL msg('q('//TRIM(strStack(int2str([i,k])))//',:) = '//TRIM(strStack(real2str(q(i,k,:)))), modname) |
|---|
| 162 | CALL abort_gcm(modname, 'Error with isotopes: '//TRIM(err_msg), 1) |
|---|
| 163 | END IF |
|---|
| 164 | IF(ABS(xtractot) <= ridicule) CYCLE |
|---|
| 165 | DO izon = 1, nzone |
|---|
| 166 | q(i,k,iq) = q(i,k,iq) / xtractot * xiiso !--- Bidouille pour convergence |
|---|
| 167 | END DO |
|---|
| 168 | END DO |
|---|
| 169 | END DO |
|---|
| 170 | END DO |
|---|
| 171 | END DO |
|---|
| 172 | |
|---|
| 173 | END SUBROUTINE check_isotopes_seq |
|---|
| 174 | |
|---|
