Makefile.include.fujitsu a64fx: Difference between revisions
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#LLIBS += -L$(WANNIER90_ROOT)/lib -lwannier | #LLIBS += -L$(WANNIER90_ROOT)/lib -lwannier | ||
</pre> | </pre> | ||
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[[The_VASP_Manual|Contents]] | |||
[[Category:VASP]] | |||
[[Category:Installation]] |
Revision as of 09:59, 20 January 2022
# Default precompiler options CPP_OPTIONS = -DHOST=\"FJ-A64FX\" \ -DMPI -DMPI_BLOCK=8000 -Duse_collective \ -DscaLAPACK \ -DCACHE_SIZE=4000 \ -Davoidalloc \ -Dvasp6 \ -Duse_bse_te \ -Dtbdyn \ -Dfock_dblbuf CPP = cpp -P -traditional-cpp $(CPP_OPTIONS) $*$(FUFFIX) > $*$(SUFFIX) # N.B.: to cross-compile for A64FX on X86_64 replace mpifrt, frt, fcc, and FCC # by mpifrtpx, frtpx, fccpx, and FCCpx, respectively. FC = mpifrt -Ksimd_nouse_multiple_structures -X03 FCL = mpifrt -Ksimd_nouse_multiple_structures -lstdc++ FREE = FFLAGS = -Koptmsg=2 OFLAG = -Kfast OFLAG_IN = $(OFLAG) DEBUG = -O0 -g OFLAG_1 = -O1 OFLAG_2 = -O2 OFLAG_3 = -Kfast OBJECTS = zdotc.o fftmpiw.o fftmpi_map.o fft3dlib.o fftw3d.o OBJECTS_O1 += minimax_dependence.o fftw3d.o fftmpi.o fftmpiw.o OBJECTS_O2 += fft3dlib.o # For what used to be vasp.5.lib CPP_LIB = $(CPP) FC_LIB = frt -Ksimd_nouse_multiple_structures CC_LIB = fcc -Nclang CFLAGS_LIB = -O3 FFLAGS_LIB = $(OFLAG) FREE_LIB = $(FREE) OBJECTS_LIB = linpack_double.o # For the parser library CXX_PARS = FCC -Nclang ## ## Customize as of this point! Of course you may change the preceding ## part of this file as well if you like, but it should rarely be ## necessary ... ## # BLAS, LAPACK, and SCALAPACK (mandatory) LLIBS = -SSL2 -SCALAPACK # HINT: Fujitsu maintains its own fftw fork on GitHub # (https://github.com/fujitsu/fftw3) FFTW ?= /path/to/your/fujitsu/fftw3 LLIBS += -L$(FFTW)/lib -lfftw3 INCS = -I$(FFTW)/include # HDF5-support (optional but strongly recommended) #CPP_OPTIONS+= -DVASP_HDF5 #HDF5_ROOT ?= /path/to/your/hdf5/installation #LLIBS += -L$(HDF5_ROOT)/lib -lhdf5_fortran #INCS += -I$(HDF5_ROOT)/include # For the VASP-2-Wannier90 interface (optional) #CPP_OPTIONS += -DVASP2WANNIER90 #WANNIER90_ROOT ?= /path/to/your/wannier90/installation #LLIBS += -L$(WANNIER90_ROOT)/lib -lwannier