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Diffstat (limited to 'science/bagel/Makefile')
| -rw-r--r-- | science/bagel/Makefile | 52 |
1 files changed, 52 insertions, 0 deletions
diff --git a/science/bagel/Makefile b/science/bagel/Makefile new file mode 100644 index 000000000000..64065a4cd3a3 --- /dev/null +++ b/science/bagel/Makefile @@ -0,0 +1,52 @@ +# $FreeBSD$ + +PORTNAME= bagel +DISTVERSIONPREFIX= v +DISTVERSION= 1.1.2-21 +DISTVERSIONSUFFIX= -g2a9472a50 +CATEGORIES= science +DIST_SUBDIR= ${PORTNAME}${PKGNAMESUFFIX} + +MAINTAINER= yuri@FreeBSD.org +COMMENT= Brilliantly Advanced General Electronic-structure Library + +LICENSE= GPLv3 +LICENSE_FILE= ${WRKSRC}/COPYING + +BROKEN_i386= error: static_assert failed "size_t is assumed to be the same size as unsigned long long" + +LIB_DEPENDS= libboost_serialization.so:devel/boost-libs \ + libcblas.so:math/cblas + +USES= autoreconf fortran gmake libtool localbase python:build +GNU_CONFIGURE= yes +CONFIGURE_ARGS= --datarootdir=${DATADIR} +USE_GITHUB= yes +GH_ACCOUNT= nubakery +USE_LDCONFIG= yes + +OPTIONS_DEFINE= MPI LIBXC SCALAPACK SMITH # SLATER (needs a separate lib) +OPTIONS_DEFAULT= MPI LIBXC SCALAPACK SMITH + +MPI_CONFIGURE_ON= --with-mpi=openmpi +MPI_CONFIGURE_OFF= --with-mpi=no +MPI_LIB_DEPENDS= libmpicxx.so:net/mpich # openmpi option erroneously links to mpich (due to a name clash) + +LIBXC_DESC= Build DFT with libxc +LIBXC_CONFIGURE_WITH= libxc +LIBXC_LIB_DEPENDS= libxc.so:science/libxc + +SCALAPACK_DESC= Use ScaLapack library for parallelized linear algebra +SCALAPACK_CONFIGURE_ENABLE= libxc +SCALAPACK_MAKE_ARGS= EXTRA_LIBS="-lcblas" +SCALAPACK_MAKE_ARGS_OFF= EXTRA_LIBS="-lcblas -llapack -lblas" # -llapack -lblas are a replacement of libscalapack +SCALAPACK_LIB_DEPENDS= libscalapack.so:math/scalapack +SCALAPACK_LIB_DEPENDS_OFF= liblapack.so:math/lapack \ + libblas.so:math/blas +SCALAPACK_IMPLIES= MPI + +SMITH_DESC= Compile SMITH generated code +SMITH_CONFIGURE_ENABLE= smith +SMITH_IMPLIES= MPI + +.include <bsd.port.mk> |