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Diffstat (limited to 'sci-physics/elk/elk-1.4.18.ebuild')
-rw-r--r--sci-physics/elk/elk-1.4.18.ebuild115
1 files changed, 0 insertions, 115 deletions
diff --git a/sci-physics/elk/elk-1.4.18.ebuild b/sci-physics/elk/elk-1.4.18.ebuild
deleted file mode 100644
index 27b3f3af5..000000000
--- a/sci-physics/elk/elk-1.4.18.ebuild
+++ /dev/null
@@ -1,115 +0,0 @@
-# Copyright 1999-2012 Gentoo Foundation
-# Distributed under the terms of the GNU General Public License v2
-# $Header: $
-
-EAPI="4"
-
-inherit eutils fortran-2 multilib toolchain-funcs
-
-DESCRIPTION="All-electron full-potential linearised augmented-plane wave (FP-LAPW) code with advanced features."
-HOMEPAGE="http://elk.sourceforge.net/"
-SRC_URI="mirror://sourceforge/${PN}/${P}.tgz"
-
-LICENSE="GPL-3"
-SLOT="0"
-KEYWORDS="~amd64 ~x86"
-IUSE="-debug lapack libxc mpi openmp perl test"
-
-RDEPEND="lapack? ( virtual/blas
- virtual/lapack )
- libxc? ( =sci-libs/libxc-1*[fortran] )
- mpi? ( virtual/mpi )"
-DEPEND="${RDEPEND}
- perl? ( dev-lang/perl )
- dev-util/pkgconfig"
-
-DOCS=( README )
-
-FORTRAN_STANDARD=90
-
-pkg_setup() {
- # fortran-2.eclass does not handle mpi wrappers
- if use mpi; then
- export FC="mpif90"
- export F77="mpif77"
- export CC="mpicc"
- export CXX="mpic++"
- else
- tc-export FC F77 CC CXX
- fi
-
- if use openmp; then
- FORTRAN_NEED_OPENMP=1
- fi
-
- fortran-2_pkg_setup
-
- if use openmp; then
- export FC="${FC} -fopenmp"
- export F77="${F77} -fopenmp"
- export CC="${CC} -fopenmp"
- export CXX="${CXX} -fopenmp"
- fi
-}
-
-src_prepare() {
- if use libxc; then
- sed -i -e's/^\(SRC_libxc =\)/#\1/' "${S}/src/Makefile"
- fi
- if use mpi; then
- sed -i -e's/^\(SRC_mpi =\)/#\1/' "${S}/src/Makefile"
- fi
-}
-
-src_configure() {
- FCFLAGS="${FCFLAGS:- ${FFLAGS:- -O3 -funroll-loops -ffast-math}}"
- FCFLAGS="${FCFLAGS} -I/usr/include -I/usr/$(get_libdir)/finclude"
- CFLAGS="${CFLAGS:- -O3 -funroll-loops -ffast-math}"
- CXXFLAGS="${CXXFLAGS:- ${CFLAGS}}"
- export FCFLAGS CFLAGS CXXFLAGS
- echo "MAKE = make" > make.inc
- echo "F90 = $FC" >> make.inc
- echo "F90_OPTS = $FCFLAGS" >> make.inc
- echo "F77 = $FC" >> make.inc
- echo "F77_OPTS = $FCFLAGS" >> make.inc
- echo "CC = ${CC}" >> make.inc
- echo "CXX = ${CXX}" >> make.inc
- echo "CFLAGS = ${CFLAGS}" >> make.inc
- echo "CXXFLAGS = ${CXXFLAGS}" >> make.inc
- echo "LD = $(tc-getLD)" >> make.inc
- echo "AR = ar" >> make.inc
- echo "LIB_SYS = " >> make.inc
- if use lapack; then
- echo "LIB_LPK = $(pkg-config --libs lapack)" >> make.inc
- else
- echo "LIB_LPK = lapack.a blas.a" >> make.inc
- fi
- echo "LIB_FFT = fftlib.a" >> make.inc
- if use libxc; then
- echo "LIB_XC = -L/usr/$(get_libdir) -lxc" >> make.inc
- echo "SRC_libxc = libxc_funcs.f90 libxc.f90 libxcifc.f90" >>make.inc
- fi
-}
-
-src_compile() {
- emake -j1 || die "make failed"
-}
-
-src_test() {
- emake test
-}
-
-src_install() {
- dobin src/elk src/protex src/eos/eos src/spacegroup/spacegroup
- dobin utilities/elk-bands
- use perl && dobin utilities/xps_exc.pl utilities/se.pl
- dodoc README
- for doc in docs/*; do
- dodoc $doc
- done
- insinto /usr/share/${P}
- doins -r species
- doins -r utilities
- doins -r examples
- doins -r tests
-}