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Fixed for new IRPF90

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This commit is contained in:
Anthony Scemama 2017-05-16 16:58:24 +02:00
parent 05df6784da
commit e1dbd6795d
4 changed files with 298 additions and 301 deletions
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2
config/gfortran_debug.cfg
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@ -10,7 +10,7 @@
# #
# #
[COMMON] [COMMON]
FC : gfortran -g -ffree-line-length-none -I . -static-libgcc FC : gfortran -g -ffree-line-length-none -I .
LAPACK_LIB : -llapack -lblas LAPACK_LIB : -llapack -lblas
IRPF90 : irpf90 IRPF90 : irpf90
IRPF90_FLAGS : --ninja --align=32 IRPF90_FLAGS : --ninja --align=32

2
config/travis.cfg
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@ -51,7 +51,7 @@ FCFLAGS : -Ofast
# -g : Extra debugging information # -g : Extra debugging information
# #
[DEBUG] [DEBUG]
FCFLAGS : -fcheck=all -g -Waliasing -Wampersand -Wconversion -Wsurprising -Wintrinsics-std -Wno-tabs -Wintrinsic-shadow -Wline-truncation -Wreal-q-constant FCFLAGS : -Ofast -fcheck=all -g -Waliasing -Wampersand -Wconversion -Wsurprising -Wintrinsics-std -Wno-tabs -Wintrinsic-shadow -Wline-truncation -Wreal-q-constant
# OpenMP flags # OpenMP flags
################# #################

3
plugins/loc_cele/loc_cele.irp.f
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@ -293,9 +293,6 @@
call save_mos call save_mos
stop stop
end end

2
plugins/mrcepa0/dressing.irp.f
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@ -684,7 +684,7 @@ subroutine getHP(a,h,p,Nint)
end do lh end do lh
h = deg h = deg
!isInCassd = .true. !isInCassd = .true.
end function end subroutine
BEGIN_PROVIDER [ double precision, delta_mrcepa0_ij, (N_det_ref,N_det_non_ref,N_states) ] BEGIN_PROVIDER [ double precision, delta_mrcepa0_ij, (N_det_ref,N_det_non_ref,N_states) ]