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|
*DECK MCRDRV
SUBROUTINE MCRDRV(IPMPO,LCUBIC,NMIX,IMPX,NMIL,NCAL,NBISO,NPAR,
1 HEDIT,ITER,MAXNIS,MIXC,TERP,NISO,LISO,HISO,CONC,ITODO)
*
*-----------------------------------------------------------------------
*
*Purpose:
* Compute TERP factors for MPO file interpolation. Use user-defined
* global parameters.
*
*Copyright:
* Copyright (C) 2022 Ecole Polytechnique de Montreal
*
*Author(s):
* A. Hebert
*
*Parameters: input
* IPMPO address of the MPO file.
* LCUBIC =.TRUE.: cubic Ceschino interpolation; =.FALSE: linear
* Lagrange interpolation.
* NMIX maximum number of material mixtures in the microlib.
* IMPX print parameter (equal to zero for no print).
* NMIL number of material mixtures in the MPO file.
* NCAL number of elementary calculations in the MPO file.
* NBISO number of particularized isotopes in the MPO file.
* NPAR number of parameters
* HEDIT name of output group for a (multigroup mesh, output geometry)
* couple (generally equal to 'output_0').
*
*Parameters: output
* ITER completion flag (=0: all over; =1: use another MPO file;
* =2 use another L_MAP + MPO file).
* MAXNIS maximum value of NISO(I) in user data.
* MIXC mixture index in the MPO file corresponding to each microlib
* mixture.
* TERP interpolation factors.
* NISO number of user-selected isotopes.
* LISO type of treatment (=.true.: ALL; =.false.: ONLY).
* HISO name of the user-selected isotopes.
* CONC user-defined number density of the user-selected isotopes. A
* value of -99.99 is set to indicate that the compo value is
* used.
* ITODO non-depletion mask (=1 to force a user-selected isotope to be
* non-depleting)
*
*-----------------------------------------------------------------------
*
USE GANLIB
USE hdf5_wrap
IMPLICIT NONE
*----
* SUBROUTINE ARGUMENTS
*----
TYPE(C_PTR) IPMPO
INTEGER NMIX,IMPX,NMIL,NCAL,NBISO,NPAR,ITER,MAXNIS,MIXC(NMIX),
1 NISO(NMIX),ITODO(NMIX,NBISO)
REAL TERP(NCAL,NMIX),CONC(NMIX,NBISO)
LOGICAL LCUBIC,LISO(NMIX)
CHARACTER(LEN=8) HISO(NMIX,NBISO)
CHARACTER(LEN=12) HEDIT
*----
* LOCAL VARIABLES
*----
INTEGER, PARAMETER::IOUT=6
INTEGER, PARAMETER::MAXLIN=132
INTEGER, PARAMETER::MAXPAR=50
INTEGER, PARAMETER::MAXVAL=200
REAL, PARAMETER::REPS=1.0E-4
INTEGER I, J, IBM, IBMOLD, ICAL, INDIC, IPAR, ITYPE, JBM, NITMA
REAL SUM, FLOTT
CHARACTER TEXT72*72,HSMG*131,TEXT132*132,VALH(MAXPAR)*12,
1 RECNAM*80,HCUBIC*12
INTEGER VALI(MAXPAR)
INTEGER RANK,TYPE,NBYTE,DIMSR(5)
DOUBLE PRECISION DFLOTT
REAL VALR(2*MAXPAR,2)
LOGICAL LCUB2(MAXPAR)
*----
* ALLOCATABLE ARRAYS
*----
LOGICAL, ALLOCATABLE, DIMENSION(:) :: LDELTA
INTEGER, ALLOCATABLE, DIMENSION(:) :: MUPLET,MUTYPE,NVALUE,VINTE
INTEGER, ALLOCATABLE, DIMENSION(:,:) :: MUBASE
REAL, ALLOCATABLE, DIMENSION(:) :: VREAL
CHARACTER(LEN=8), ALLOCATABLE, DIMENSION(:) :: PARFMT
CHARACTER(LEN=12), ALLOCATABLE, DIMENSION(:) :: VCHAR
CHARACTER(LEN=24), ALLOCATABLE, DIMENSION(:) :: PARTYP,PARKEY
CHARACTER(LEN=132), ALLOCATABLE, DIMENSION(:) :: TEXT132V1
*----
* SCRATCH STORAGE ALLOCATION
*----
ALLOCATE(MUPLET(NPAR),MUTYPE(NPAR),LDELTA(NMIX),MUBASE(NPAR,NCAL))
*----
* RECOVER INFORMATION FOR THE MPO FILE.
*----
CALL hdf5_info(IPMPO,"/info/MPO_CREATION_INFO",RANK,TYPE,NBYTE,
1 DIMSR)
IF(RANK.GT.MAXLIN) CALL XABORT('MCRDRV: MAXLIN OVERFLOW.')
IF(NPAR.GT.MAXPAR) CALL XABORT('MCRDRV: MAXPAR OVERFLOW.')
IF((RANK.EQ.1).AND.(DIMSR(1).EQ.1)) THEN
CALL hdf5_read_data(IPMPO,"/info/MPO_CREATION_INFO",TEXT132)
IF(IMPX.GT.0) WRITE(IOUT,'(1X,A)') TEXT132
ELSE IF(RANK.EQ.1) THEN
CALL hdf5_read_data(IPMPO,"/info/MPO_CREATION_INFO",TEXT132V1)
IF(IMPX.GT.0) THEN
DO I=1,DIMSR(1)
WRITE(IOUT,'(1X,A)') TEXT132V1(I)
ENDDO
ENDIF
DEALLOCATE(TEXT132V1)
ENDIF
IF(NPAR.GT.0) THEN
CALL hdf5_read_data(IPMPO,"/parameters/info/PARAMTYPE",PARTYP)
CALL hdf5_read_data(IPMPO,"/parameters/info/PARAMNAME",PARKEY)
CALL hdf5_read_data(IPMPO,"/parameters/info/PARAMFORM",PARFMT)
IF(IMPX.GT.1) THEN
WRITE(IOUT,*) 'NPAR=',NPAR,SIZE(PARKEY,1)
DO I=1,NPAR
WRITE(IOUT,*)'PARKEY(',I,')=',PARKEY(I),' PARFMT=',PARFMT(I)
ENDDO
ENDIF
ENDIF
TERP(:NCAL,:NMIX)=0.0
MIXC(:NMIX)=0
*----
* SCAN THE MPO FILE INFORMATION TO RECOVER THE MUPLET DATABASE
*----
IF(IMPX.GT.5) THEN
WRITE(IOUT,'(24H MCRDRV: MUPLET DATABASE/12H CALCULATION,5X,
1 10HMUPLET....)')
ENDIF
IF(NPAR.GT.0) THEN
DO ICAL=1,NCAL
WRITE(RECNAM,'(8H/output/,A,9H/statept_,I0)') TRIM(HEDIT),
1 ICAL-1
CALL hdf5_read_data(IPMPO,TRIM(RECNAM)//"/PARAMVALUEORD",
1 VINTE)
IF(SIZE(VINTE).NE.NPAR) THEN
WRITE(HSMG,'(41HMCRDRV: INCONSISTENT PARAMVALUEORD LENGTH,
1 2H (,I5,3H VS,I5,2H).)') SIZE(VINTE),NPAR
CALL XABORT(HSMG)
ENDIF
DO IPAR=1,NPAR
MUBASE(IPAR,ICAL)=VINTE(IPAR)+1
ENDDO
IF(IMPX.GT.5) THEN
WRITE(IOUT,'(I8,6X,20I4/(14X,20I4))') ICAL,
1 MUBASE(:,ICAL)
ENDIF
DEALLOCATE(VINTE)
ENDDO
ENDIF
*----
* READ (INTERP_DATA) AND SET VALI, VALR AND VALH PARAMETERS
* CORRESPONDING TO THE INTERPOLATION POINT. FILL MUPLET FOR
* PARAMETERS SET WITHOUT INTERPOLATION.
*----
IBM=0
MAXNIS=0
NISO(:NMIX)=0
LISO(:NMIX)=.TRUE.
LDELTA(:NMIX)=.FALSE.
ITODO(:NMIX,:NBISO)=0
10 CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
IF(INDIC.NE.3) CALL XABORT('MCRDRV: CHARACTER DATA EXPECTED.')
20 IF(TEXT72.EQ.'MIX') THEN
MUPLET(:NPAR)=0
MUTYPE(:NPAR)=0
VALI(:NPAR)=0
VALR(:NPAR,1)=0.0
VALR(:NPAR,2)=0.0
DO 30 I=1,NPAR
VALH(I)=' '
30 CONTINUE
LCUB2(:NPAR)=LCUBIC
CALL REDGET(INDIC,IBM,FLOTT,TEXT72,DFLOTT)
IF(INDIC.NE.1) CALL XABORT('MCRDRV: INTEGER DATA EXPECTED.')
IF(IBM.GT.NMIX) THEN
WRITE(HSMG,'(27HMCRDRV: NMIX OVERFLOW (IBM=,I8,6H NMIX=,I8,
1 2H).)') IBM,NMIX
CALL XABORT(HSMG)
ENDIF
IBMOLD=1
CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
IF(INDIC.NE.3) CALL XABORT('MCRDRV: CHARACTER DATA EXPECTED.')
IF(TEXT72.EQ.'FROM') THEN
CALL REDGET(INDIC,IBMOLD,FLOTT,TEXT72,DFLOTT)
IF(INDIC.NE.1) CALL XABORT('MCRDRV: INTEGER DATA EXPECTED.')
IF(IBMOLD.GT.NMIL) CALL XABORT('MCRDRV: MPO MIX OVERFLOW'
1 //'(1).')
MIXC(IBM)=IBMOLD
GO TO 10
ELSE IF(TEXT72.EQ.'USE') THEN
IF(IBM.GT.NMIL) CALL XABORT('MCRDRV: MPO MIX OVERFLOW(2).')
MIXC(IBM)=IBM
GO TO 10
ENDIF
MIXC(IBM)=IBMOLD
GO TO 20
ELSE IF(TEXT72.EQ.'MICRO') THEN
IF(IBM.EQ.0) CALL XABORT('MCRDRV: MIX NOT SET (1).')
CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
IF(INDIC.NE.3) CALL XABORT('MCRDRV: CHARACTER DATA EXPECTED.')
IF(TEXT72.EQ.'ALL') THEN
LISO(IBM)=.TRUE.
ELSE IF(TEXT72.EQ.'ONLY') THEN
LISO(IBM)=.FALSE.
ENDIF
CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
IF(INDIC.NE.3) CALL XABORT('MCRDRV: CHARACTER DATA EXPECTED.')
40 IF(TEXT72.EQ.'ENDMIX') THEN
GO TO 20
ELSE IF(TEXT72.EQ.'NOEV') THEN
IF(NISO(IBM).EQ.0) CALL XABORT('MCRDRV: MISPLACED NOEV.')
ITODO(IBM,NISO(IBM))=1
ELSE
NISO(IBM)=NISO(IBM)+1
IF(NISO(IBM).GT.NBISO) CALL XABORT('MCRDRV: NBISO OVERFLOW.')
MAXNIS=MAX(MAXNIS,NISO(IBM))
HISO(IBM,NISO(IBM))=TEXT72(:8)
CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
IF(INDIC.EQ.2) THEN
CONC(IBM,NISO(IBM))=FLOTT
ELSE IF((INDIC.EQ.3).AND.(TEXT72.EQ.'*')) THEN
CONC(IBM,NISO(IBM))=-99.99
ELSE
CALL XABORT('MCRDRV: INVALID HISO DATA.')
ENDIF
ENDIF
CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
IF(INDIC.NE.3) CALL XABORT('MCRDRV: CHARACTER DATA EXPECTED.')
GO TO 40
ELSE IF((TEXT72.EQ.'SET').OR.(TEXT72.EQ.'DELTA')) THEN
IF(IBM.EQ.0) CALL XABORT('MCRDRV: MIX NOT SET (2).')
ITYPE=0
IF(TEXT72.EQ.'SET') THEN
ITYPE=1
ELSE IF(TEXT72.EQ.'DELTA') THEN
ITYPE=2
LDELTA(IBM)=.TRUE.
ENDIF
CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
IF(INDIC.NE.3) CALL XABORT('MCRDRV: CHARACTER DATA EXPECTED.')
IF((TEXT72.EQ.'LINEAR').OR.(TEXT72.EQ.'CUBIC')) THEN
HCUBIC=TEXT72(:12)
CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
ELSE
HCUBIC=' '
ENDIF
IF(INDIC.NE.3) CALL XABORT('MCRDRV: CHARACTER DATA EXPECTED.')
IPAR=0
DO 50 I=1,NPAR
IF(TEXT72.EQ.PARKEY(I)) THEN
IPAR=I
GO TO 60
ENDIF
50 CONTINUE
CALL XABORT('MCRDRV: PARAMETER '//TEXT72//' NOT FOUND.')
60 IF(HCUBIC.EQ.'LINEAR') THEN
LCUB2(IPAR)=.FALSE.
ELSE IF(HCUBIC.EQ.'CUBIC') THEN
LCUB2(IPAR)=.TRUE.
ENDIF
CALL hdf5_read_data(IPMPO,"/parameters/info/NVALUE",NVALUE)
IF(NVALUE(IPAR).GT.MAXVAL) CALL XABORT('MCRDRV: MAXVAL OVERFL'
1 //'OW.')
WRITE(RECNAM,'(25H/parameters/values/PARAM_,I0)') IPAR-1
CALL hdf5_info(IPMPO,RECNAM,RANK,TYPE,NBYTE,DIMSR)
IF(TYPE.EQ.99) THEN
WRITE(HSMG,'(25HMCRDRV: GLOBAL PARAMETER ,A,9H NOT SET.)')
1 TRIM(PARKEY(IPAR))
CALL XABORT(HSMG)
ENDIF
IF(PARFMT(IPAR).EQ.'INTEGER') THEN
IF(ITYPE.NE.1) CALL XABORT('MCRDRV: SET MANDATORY WITH INT'
1 //'EGER PARAMETERS.')
CALL REDGET(INDIC,VALI(IPAR),FLOTT,TEXT72,DFLOTT)
IF(INDIC.NE.1) CALL XABORT('MCRDRV: INTEGER DATA EXPECTED.')
CALL hdf5_read_data(IPMPO,RECNAM,VINTE)
DO 70 J=1,NVALUE(IPAR)
IF(VALI(IPAR).EQ.VINTE(J)) THEN
MUPLET(IPAR)=J
MUTYPE(IPAR)=ITYPE
DEALLOCATE(NVALUE,VINTE)
GO TO 10
ENDIF
70 CONTINUE
WRITE(HSMG,'(26HMCRDRV: INTEGER PARAMETER ,A,11H WITH VALUE,
1 I5,32H NOT FOUND IN MPO FILE DATABASE.)')
2 TRIM(PARKEY(IPAR)),VALI(IPAR)
CALL XABORT(HSMG)
ELSE IF(PARFMT(IPAR).EQ.'FLOAT') THEN
CALL REDGET(INDIC,NITMA,VALR(IPAR,1),TEXT72,DFLOTT)
IF(INDIC.NE.2) CALL XABORT('MCRDRV: REAL DATA EXPECTED.')
VALR(IPAR,2)=VALR(IPAR,1)
CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
IF(INDIC.EQ.2) THEN
VALR(IPAR,2)=FLOTT
CALL REDGET(INDIC,NITMA,FLOTT,TEXT72,DFLOTT)
ENDIF
CALL hdf5_read_data(IPMPO,RECNAM,VREAL)
IF(VALR(IPAR,1).EQ.VALR(IPAR,2)) THEN
DO 80 J=1,NVALUE(IPAR)
IF(ABS(VALR(IPAR,1)-VREAL(J)).LE.REPS*ABS(VREAL(J))) THEN
MUPLET(IPAR)=J
IF(ITYPE.NE.1) MUPLET(IPAR)=-1
MUTYPE(IPAR)=ITYPE
DEALLOCATE(NVALUE,VREAL)
GO TO 20
ENDIF
80 CONTINUE
ENDIF
IF(VALR(IPAR,1).LT.VREAL(1)) THEN
WRITE(HSMG,'(23HMCRDRV: REAL PARAMETER ,A,10H WITH VALU,
1 1HE,1P,E12.4,25H IS OUTSIDE THE DOMAIN (<,E12.4,1H))')
2 TRIM(PARKEY(IPAR)),VALR(IPAR,1),VREAL(1)
CALL XABORT(HSMG)
ELSE IF(VALR(IPAR,2).GT.VREAL(NVALUE(IPAR))) THEN
WRITE(HSMG,'(23HMCRDRV: REAL PARAMETER ,A,10H WITH VALU,
1 1HE,1P,E12.4,25H IS OUTSIDE THE DOMAIN (>,E12.4,1H))')
2 TRIM(PARKEY(IPAR)),VALR(IPAR,1),VREAL(NVALUE(IPAR))
CALL XABORT(HSMG)
ELSE IF(VALR(IPAR,1).GT.VALR(IPAR,2)) THEN
WRITE(HSMG,'(23HMCRDRV: REAL PARAMETER ,A,9H IS DEFIN,
1 7HED WITH,1P,E12.4,2H >,E12.4,1H.)') TRIM(PARKEY(IPAR)),
2 VALR(IPAR,1),VALR(IPAR,2)
CALL XABORT(HSMG)
ENDIF
MUPLET(IPAR)=-1
MUTYPE(IPAR)=ITYPE
DEALLOCATE(NVALUE,VREAL)
GO TO 20
ELSE IF(PARFMT(IPAR).EQ.'STRING') THEN
IF(ITYPE.NE.1) CALL XABORT('MCRDRV: SET MANDATORY WITH STR'
1 //'ING PARAMETERS.')
CALL REDGET(INDIC,NITMA,FLOTT,VALH(IPAR),DFLOTT)
IF(INDIC.NE.3) CALL XABORT('MCRDRV: STRING DATA EXPECTED.')
CALL hdf5_read_data(IPMPO,RECNAM,VCHAR)
DO 90 J=1,NVALUE(IPAR)
IF(VALH(IPAR).EQ.VCHAR(J)) THEN
MUPLET(IPAR)=J
MUTYPE(IPAR)=ITYPE
DEALLOCATE(NVALUE,VCHAR)
GO TO 10
ENDIF
90 CONTINUE
WRITE(HSMG,'(25HMCRDRV: STRING PARAMETER ,A,10H WITH VALU,
1 2HE ,A12,32H NOT FOUND IN MPO FILE DATABASE.)')
2 TRIM(PARKEY(IPAR)), VALH(IPAR)
CALL XABORT(HSMG)
ELSE
CALL XABORT('MCRDRV: INVALID FORMAT='//PARFMT(IPAR))
ENDIF
ELSE IF(TEXT72.EQ.'ENDMIX') THEN
*----
* COMPUTE THE TERP FACTORS USING TABLE-OF-CONTENT INFORMATION.
*----
IF(IMPX.GT.0) THEN
DO IPAR=1,NPAR
IF(PARFMT(IPAR).EQ.'FLOAT')THEN
IF(LCUB2(IPAR)) THEN
WRITE(IOUT,'(26H MCRDRV: GLOBAL PARAMETER:,A,7H ->CUBI,
1 16HC INTERPOLATION.)') TRIM(PARKEY(IPAR))
ELSE
WRITE(IOUT,'(26H MCRDRV: GLOBAL PARAMETER:,A,7H ->LINE,
1 17HAR INTERPOLATION.)') TRIM(PARKEY(IPAR))
ENDIF
ENDIF
ENDDO
ENDIF
IF(IBMOLD.GT.NMIL)CALL XABORT('MCRDRV: MPO MIX OVERFLOW(3).')
IF(IBM.GT.NMIX)CALL XABORT('MCRDRV: MIX OVERFLOW (MICROLIB).')
IF(NCAL.EQ.1) THEN
TERP(1,IBM)=1.0
ELSE
CALL MCRTRP(IPMPO,LCUB2,IMPX,NPAR,NCAL,MUPLET,MUTYPE,PARTYP,
1 VALR,0.0,MUBASE,TERP(1,IBM))
ENDIF
IBM=0
ELSE IF((TEXT72.EQ.'MPO').OR.(TEXT72.EQ.'TABLE').OR.
1 (TEXT72.EQ.'CHAIN').OR.(TEXT72.EQ.';')) THEN
*----
* CHECK TERP FACTORS AND RETURN
*----
IF(TEXT72.EQ.';') ITER=0
IF(TEXT72.EQ.'MPO') ITER=1
IF(TEXT72.EQ.'TABLE') ITER=2
IF(TEXT72.EQ.'CHAIN') ITER=3
DO 150 IBM=1,NMIX
IBMOLD=MIXC(IBM)
IF(IBMOLD.EQ.0) GO TO 150
IF(NISO(IBM).GT.MAXNIS) CALL XABORT('MCRDRV: MAXNIS OVERFLOW.')
IF(LDELTA(IBM)) THEN
SUM=0.0
ELSE
SUM=1.0
ENDIF
DO 140 ICAL=1,NCAL
SUM=SUM-TERP(ICAL,IBM)
140 CONTINUE
IF(ABS(SUM).GT.1.0E-4) THEN
WRITE(HSMG,'(43HMCRDRV: INVALID INTERPOLATION FACTORS IN MI,
1 5HXTURE,I4,1H.)') IBM
CALL XABORT(HSMG)
ENDIF
150 CONTINUE
GO TO 160
ELSE
CALL XABORT('MCRDRV: '//TEXT72//' IS AN INVALID KEYWORD.')
ENDIF
GO TO 10
*----
* PRINT INTERPOLATION (TERP) FACTORS
*----
160 IF(IMPX.GT.2) THEN
WRITE(IOUT,'(/30H MCRDRV: INTERPOLATION FACTORS)')
DO ICAL=1,NCAL
DO IBM=1,NMIX
IF(TERP(ICAL,IBM).NE.0.0) THEN
WRITE(IOUT,170) ICAL,(TERP(ICAL,JBM),JBM=1,NMIX)
EXIT
ENDIF
ENDDO
ENDDO
ENDIF
*----
* SCRATCH STORAGE DEALLOCATION
*----
IF(NPAR.GT.0) DEALLOCATE(PARFMT,PARKEY,PARTYP)
DEALLOCATE(MUBASE,LDELTA,MUTYPE,MUPLET)
RETURN
170 FORMAT(6H CALC=,I8,6H TERP=,1P,8E13.5/(20X,8E13.5))
END
|
