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fix broken 64_to_32 conversion

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edoapra 2023-10-24 17:26:05 -07:00
parent 3d5909dea4
commit 21dfea24c3
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GPG key ID: 48E12DA1EDE9E1B0
4 changed files with 5 additions and 4 deletions
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2
src/nwdft/libxc/GNUmakefile
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@ -6,7 +6,7 @@ OBJ = nwchem_libxc_read.o \
nwchem_libxc_util.o
OBJ_OPTIMIZE = nwchem_libxc_compute.o
USES_BLAS = nwchem_libxc_compute.o
USES_BLAS = nwchem_libxc_compute.F
LIBRARY = libnwdft.a

2
src/nwdft/lr_tddft/GNUmakefile
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@ -16,7 +16,7 @@ LIBRARY = libnwdft.a
LIB_INCLUDES = -I../include
USES_BLAS = tddft_diagon.F tddft_transfm.F tddft_analysis.F tddft_restart.F tddft_civecs_phase.F \
tddft_fock_fit.F
tddft_fock_fit.F tddft_memory.F
LIB_DEFINES = -DDEBUG_PRINT
#

3
src/nwdft/scf_dft/GNUmakefile
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@ -48,7 +48,8 @@
LIB_INCLUDES = -I../include -I../grid
USES_BLAS = dft_mxovl.F diis_bld12.F diis_bsolve.F dft_densm.F dft_swapab.F dft_canorg.F cdft_util.F dft_diagn.F dft_spinflip.F
USES_BLAS = dft_mxovl.F diis_bld12.F diis_bsolve.F dft_densm.F dft_swapab.F dft_canorg.F cdft_util.F dft_diagn.F dft_spinflip.F \
dft_pstat.F
HEADERS = dftps.fh dft_fdist.fh dft_conv.fh

2
src/nwdft/xc/GNUmakefile
View file

@ -74,7 +74,7 @@ LIB_INCLUDES = -I../include
xc_eval_basis.F xc_eval_fnl.F xc_fd.F xc_optc.F xc_atomblock.F scat_mat.F \
xc_replicated.F xc_vdw_main.F xc_vdw_util.F\
xc_3rd_deriv.F xc_hcth.F ts_tf.F xc_xn12.F xc_util.F \
xc_tabcd_adft.F xc_rhogen_adft.F
xc_tabcd_adft.F xc_rhogen_adft.F xc_getvxc.F xc_lb94.F
include ../../config/makefile.h
ifeq ($(_FC),ifort)