3 |
|
|
4 |
#include "DIC_OPTIONS.h" |
#include "DIC_OPTIONS.h" |
5 |
|
|
6 |
CStartOfInterFace |
CBOP |
7 |
|
C !ROUTINE: Fe_CHEM |
8 |
|
C !INTERFACE: |
9 |
SUBROUTINE Fe_CHEM( |
SUBROUTINE Fe_CHEM( |
10 |
I bi,bj,iMin,iMax,jMin,jMax, |
I bi,bj, iMin,iMax,jMin,jMax, |
11 |
I fe, freefe, |
I fe, freefe, |
12 |
I myIter, myThid ) |
I myIter, myThid ) |
13 |
C /==========================================================\ |
|
14 |
C | SUBROUTINE Fe_chem | |
C !DESCRIPTION: \bv |
15 |
C | | |
C *==========================================================* |
16 |
C | o Calculate L,FeL,Fe concentration | |
C | SUBROUTINE Fe_CHEM |
17 |
C |==========================================================| |
C | o Calculate L,FeL,Fe concentration |
18 |
|
C *==========================================================* |
19 |
|
C \ev |
20 |
|
|
21 |
|
C !USES: |
22 |
IMPLICIT NONE |
IMPLICIT NONE |
23 |
|
|
24 |
C == GLobal variables == |
C == GLobal variables == |
25 |
#include "SIZE.h" |
#include "SIZE.h" |
|
#include "DYNVARS.h" |
|
26 |
#include "EEPARAMS.h" |
#include "EEPARAMS.h" |
27 |
#include "PARAMS.h" |
#include "PARAMS.h" |
28 |
#include "GRID.h" |
#include "GRID.h" |
29 |
#include "DIC_VARS.h" |
#include "DIC_VARS.h" |
30 |
|
|
31 |
C == Routine arguments == |
C !INPUT/OUTPUT PARAMETERS: |
32 |
C bi, bj, iMin, iMax, jMin, jMax - Range of points for which calculation |
C == Routine arguments == |
33 |
C results will be set. |
C bi, bj :: current tile indices |
34 |
C myThid - Instance number for this innvocation of CALC_GT |
C iMin,iMax,jMin,jMax :: Range of points for which calculation is performed. |
35 |
_RL freefe(1-OLx:sNx+OLx,1-OLy:sNy+OLy,Nr,nSx,nSy) |
C myThid :: my Thread Id number |
36 |
_RL fe(1-OLx:sNx+OLx,1-OLy:sNy+OLy,Nr,nSx,nSy) |
INTEGER bi,bj |
37 |
INTEGER bi,bj,iMin,iMax,jMin,jMax |
INTEGER iMin,iMax,jMin,jMax |
38 |
INTEGER myIter,myThid |
_RL fe(1-OLx:sNx+OLx,1-OLy:sNy+OLy,Nr) |
39 |
#ifdef AD_SAFE |
_RL freefe(1-OLx:sNx+OLx,1-OLy:sNy+OLy,Nr) |
40 |
_RL thx, thy, theps |
INTEGER myIter, myThid |
41 |
#endif |
CEOP |
|
CEndOfInterface |
|
42 |
|
|
43 |
#ifdef ALLOW_FE |
#ifdef ALLOW_FE |
44 |
|
C !LOCAL VARIABLES: |
45 |
INTEGER I,J,K |
INTEGER i,j,k |
46 |
_RL lig, FeL |
_RL lig, FeL |
47 |
_RL tmpfe |
_RL tmpfe |
48 |
|
#ifdef AD_SAFE |
49 |
|
_RL thx, thy, theps |
50 |
|
#endif |
51 |
|
|
52 |
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc |
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
53 |
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc |
C |
54 |
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc |
C ADAPTED FROM PAYAL |
55 |
CC |
C |
56 |
CC ADAPTED FROM PAYAL |
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
|
CC |
|
|
CC |
|
|
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc |
|
|
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc |
|
|
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc |
|
57 |
|
|
58 |
C ligand balance in surface layer |
C ligand balance in surface layer |
59 |
C in surface layer |
C in surface layer |
60 |
|
|
61 |
DO j=jmin,jmax |
DO k=1,Nr |
62 |
DO i=imin,imax |
DO j=jMin,jMax |
63 |
DO k=1,Nr |
DO i=iMin,iMax |
64 |
IF (hFacC(i,j,k,bi,bj) .GT. 0. _d 0) THEN |
IF ( maskC(i,j,k,bi,bj).GT.0. ) THEN |
65 |
|
|
66 |
#ifdef DIC_NO_NEG |
#ifdef DIC_NO_NEG |
67 |
tmpfe=max(0. _d 0 , fe (i,j,k,bi,bj)) |
tmpfe =MAX( 0. _d 0 , fe(i,j,k) ) |
68 |
#else |
#else |
69 |
tmpfe=fe (i,j,k,bi,bj) |
tmpfe = fe(i,j,k) |
70 |
#endif |
#endif |
71 |
|
|
72 |
C Ligand,FeL,Fe calculation |
C Ligand,FeL,Fe calculation |
73 |
lig=(-ligand_stab*tmpfe + |
lig=(-ligand_stab*tmpfe + |
74 |
& ligand_stab*ligand_tot-1. _d 0 |
& ligand_stab*ligand_tot-1. _d 0 |
75 |
& +((ligand_stab*tmpfe |
& +((ligand_stab*tmpfe |
76 |
& -ligand_stab*ligand_tot+1. _d 0)**2 |
& -ligand_stab*ligand_tot+1. _d 0)**2 |
77 |
& +4. _d 0*ligand_stab*ligand_tot)**0.5 _d 0 |
& +4. _d 0*ligand_stab*ligand_tot)**0.5 _d 0 |
78 |
& )/(2. _d 0*ligand_stab) |
& )/(2. _d 0*ligand_stab) |
79 |
|
|
80 |
FeL = ligand_tot-lig |
FeL = ligand_tot-lig |
81 |
if (tmpfe.ne.0. _d 0) then |
IF (tmpfe.NE.0. _d 0) THEN |
82 |
freefe(i,j,k,bi,bj) = tmpfe -FeL |
freefe(i,j,k) = tmpfe -FeL |
83 |
else |
ELSE |
84 |
freefe(i,j,k,bi,bj) = 0. _d 0 |
freefe(i,j,k) = 0. _d 0 |
85 |
endif |
ENDIF |
86 |
#ifdef MINFE |
#ifdef MINFE |
87 |
#ifdef AD_SAFE |
#ifdef AD_SAFE |
88 |
thx=freefe(i,j,k,bi,bj) |
thx=freefe(i,j,k) |
89 |
thy=freefemax |
thy=freefemax |
90 |
theps=1. _d -8 |
theps=1. _d -8 |
91 |
freefe(i,j,k,bi,bj) = |
freefe(i,j,k) = |
92 |
& ( 1. _d 0 - tanh((thx-thy)/theps) ) * thx/2.+ |
& ( 1. _d 0 - tanh((thx-thy)/theps) ) * thx/2.+ |
93 |
& ( 1. _d 0 + tanh((thx-thy)/theps) ) * thy/2. |
& ( 1. _d 0 + tanh((thx-thy)/theps) ) * thy/2. |
94 |
|
|
95 |
#else |
#else |
96 |
freefe(i,j,k,bi,bj) = min(freefe(i,j,k,bi,bj),freefemax) |
freefe(i,j,k) = MIN(freefe(i,j,k),freefemax) |
97 |
#endif |
#endif |
98 |
fe(i,j,k,bi,bj) = FeL+freefe(i,j,k,bi,bj) |
fe(i,j,k) = FeL+freefe(i,j,k) |
99 |
#endif |
#endif |
100 |
END IF |
ENDIF |
101 |
ENDDO |
ENDDO |
102 |
ENDDO |
ENDDO |
103 |
ENDDO |
ENDDO |
104 |
c |
|
105 |
#endif |
#endif /* ALLOW_FE */ |
106 |
RETURN |
RETURN |
107 |
END |
END |