mirror of
https://code.it4i.cz/sccs/easyconfigs-it4i.git
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8dcb965f9c
new file: d/DL_MG/DL_MG-3.0.0-intel-2021b-disable-openmp.patch new file: d/DL_MG/DL_MG-3.0.0-intel-2021b.eb new file: i/iimpi/iimpi-2021b-VASP-SCPC.eb new file: p/PSPFFT/PSPFFT-1.0-intel-2021b.eb new file: p/PSPFFT/pspfft-1.0-intel-2021b-makefile-setup.patch new file: p/phonopy/phonopy-2.15.1-conda.eb new file: v/VASP/VASP-6.3.2-intel-2021b-SCPC.eb deleted: p/phonopy/phonopy-2.15.0-conda.eb
49 lines
1.7 KiB
Diff
49 lines
1.7 KiB
Diff
diff -Nru pspfft-1.0.orig/Config/Makefile_Build pspfft-1.0/Config/Makefile_Build
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--- pspfft-1.0.orig/Config/Makefile_Build 2022-08-10 11:00:54.307622000 +0200
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+++ pspfft-1.0/Config/Makefile_Build 2022-08-10 11:11:57.981694000 +0200
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@@ -8,5 +8,5 @@
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VPATH = $(VPATH_SOURCES):../
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OBJECTS = $(SOURCES)
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-INCLUDE = $(INCLUDE_FFTW) $(INCLUDE_SILO)
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-LIBRARIES = $(LIBRARY_FFTW) $(LIBRARY_SILO)
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+INCLUDE = $(INCLUDE_FFTW)
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+LIBRARIES = $(LIBRARY_FFTW)
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diff -Nru pspfft-1.0.orig/Config/Makefile_Config pspfft-1.0/Config/Makefile_Config
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--- pspfft-1.0.orig/Config/Makefile_Config 2022-08-10 11:00:54.288126000 +0200
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+++ pspfft-1.0/Config/Makefile_Config 2022-08-10 11:48:36.017884000 +0200
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@@ -1,25 +1,25 @@
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# Sample
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#-- Specify compilers and appropriate flags
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-C_COMPILE = mpicc -c
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+C_COMPILE = mpiicc -c
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C_DEBUG = -g -Wall
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C_OPTIMIZE = -O3
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-FORTRAN_COMPILE = mpif90 -c
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+FORTRAN_COMPILE = mpiifort -c
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FORTRAN_DEBUG = -g -gdwarf-2 -ffpe-trap=invalid,zero,overflow -Wall
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FORTRAN_OPTIMIZE = -O3
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#-- Specify linker to link the Fortran Test programs with.
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-LINK = mpif90
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+LINK = mpiifort
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#-- Specify location of FFTW library.
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-INCLUDE_FFTW = -I /usr/include
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-LIBRARY_FFTW = -L /usr/lib64 -lfftw3
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+INCLUDE_FFTW = -I ${EBDEVELIMKLMINFFTW}
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+LIBRARY_FFTW = -L ${EBROOTIMKLMINFFTW}/lib -lfftw3xf_intel
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#-- Specify location of Silo library. This is only necessary to compile
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# & run Test programs. PSPFFT itself does not need this.
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-INCLUDE_SILO = -I /usr/local/silo/4.7.2/gcc/include
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-LIBRARY_SILO = -L /usr/local/silo/4.7.2/gcc/lib -lsilo
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+#INCLUDE_SILO = -I /usr/local/silo/4.7.2/gcc/include
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+#LIBRARY_SILO = -L /usr/local/silo/4.7.2/gcc/lib -lsilo
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#-- Specify the directory to install PSPFFT
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-INSTALL = /usr/local/pspfft/1.0/${PE}
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+INSTALL = ../install
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