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50 lines
1.4 KiB
Makefile
50 lines
1.4 KiB
Makefile
PORTNAME= latte
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DISTVERSIONPREFIX= v
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DISTVERSION= 1.2.2
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CATEGORIES= science
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MAINTAINER= yuri@FreeBSD.org
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COMMENT= Quantum chemistry: Density functional tight binding molecular dynamics
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LICENSE= GPLv3
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LICENSE_FILE= ${WRKSRC}/LICENSE_GPL-2.0
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USES= blaslapack:openblas cmake:noninja fortran shebangfix
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SHEBANG_FILES= tests/run_test.sh
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USE_GITHUB= yes
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GH_ACCOUNT= lanl
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GH_PROJECT= ${PORTNAME:tu}
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USE_LDCONFIG= yes
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CMAKE_SOURCE_PATH= ${WRKSRC}/cmake
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CMAKE_ON= BUILD_SHARED_LIBS
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CMAKE_ARGS= -DBLA_VENDOR:STRING="OpenBLAS"
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OPTIONS_DEFINE= DBCSR OPENMP MPI # TODO PROGRESS needs to be ported
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OPTIONS_DEFAULT= OPENMP MPI
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DBCSR_DESC= Use distributed block compressed sparse row matrix library
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DBCSR_CMAKE_BOOL= DBCSR_OPT
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DBCSR_LIB_DEPENDS= libdbcsr.so:math/dbcsr
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DBCSR_BROKEN= see https://github.com/lanl/LATTE/issues/92
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OPENMP_CMAKE_BOOL= OPENMP
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MPI_CMAKE_BOOL= DO_MPI
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MPI_LIB_DEPENDS= libmpi.so:net/openmpi
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MPI_LDFLAGS= ${LOCALBASE}/mpi/openmpi/lib/libmpi_mpifh.so
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MPI_PLIST_FILES= bin/LATTE_MPI_DOUBLE
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MPI_PLIST_FILES_OFF= bin/LATTE_DOUBLE
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CONFLICTS_INSTALL= latte-integrale
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.include <bsd.port.pre.mk>
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.if ${GCC_DEFAULT} >= 10
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# workaround for Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/REAL(8)).
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# in theory, this should set FCFLAGS, but the port does not conform
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FFLAGS+= -fallow-argument-mismatch
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.endif
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.include <bsd.port.post.mk>
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