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Update PROGRESS subroutine call #116

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Update PROGRESS subroutine call #116

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13 changes: 12 additions & 1 deletion src/bodirect.F90
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Original file line number Diff line number Diff line change
Expand Up @@ -40,6 +40,9 @@ SUBROUTINE BOEVECS
REAL(LATTEPREC), PARAMETER :: MAXSHIFT = ONE
REAL(LATTEPREC) :: EBAND, QMIXORIG
REAL(LATTEPREC) :: S, OCCLOGOCC_ELECTRONS, OCCLOGOCC_HOLES
#ifdef PROGRESSON
LOGICAL :: PROGRESSERROR
#endif

IF (EXISTERROR) RETURN

Expand All @@ -66,7 +69,15 @@ SUBROUTINE BOEVECS

#ifdef PROGRESSON

CALL PRG_GET_FLEVEL(EVALS,KBT,BNDFIL,BREAKTOL,CHEMPOT)
! PROGRESSERROR is kind 4, but LATTE's EXISTERROR is kind 1
! so use temporary variable
PROGRESSERROR = EXISTERROR
CALL PRG_GET_FLEVEL(EVALS,KBT,BNDFIL,BREAKTOL,CHEMPOT,PROGRESSERROR)
EXISTERROR = PROGRESSERROR
IF (EXISTERROR) THEN
CALL ERRORS("bodirect","PROGRESS Fermi level bisection search (PRG_GET_FLEVEL) not converged")
RETURN
ENDIF

#else

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