1 files changed, 97 insertions, 0 deletions
diff --git a/sci-libs/wannier90/wannier90-2.0.1.1.ebuild b/sci-libs/wannier90/wannier90-2.0.1.1.ebuild
new file mode 100644
index 000000000..3958bfb45
--- /dev/null
+++ b/sci-libs/wannier90/wannier90-2.0.1.1.ebuild
@@ -0,0 +1,97 @@
+# Copyright 1999-2017 Gentoo Foundation
+# Distributed under the terms of the GNU General Public License v2
+# $Id$
+
+EAPI=5
+
+inherit autotools-utils eutils fortran-2 multilib toolchain-funcs
+
+DESCRIPTION="Calculates maximally localized Wannier functions (MLWFs)"
+HOMEPAGE="http://www.wannier.org/"
+#SRC_URI="http://wannier.org/code/${P}.tar.gz"
+SRC_URI="https://launchpad.net/${PN}/2.0/${PV}/+download/${P}.tar.gz"
+
+LICENSE="GPL-2"
+SLOT="0"
+KEYWORDS="~amd64 ~x86 ~amd64-linux"
+IUSE="doc mpi perl test"
+
+RDEPEND="
+	virtual/blas
+	virtual/lapack
+	perl? ( dev-lang/perl )"
+DEPEND="${RDEPEND}
+	virtual/pkgconfig
+	doc? ( virtual/latex-base
+		dev-texlive/texlive-latexextra
+		dev-tex/revtex
+	)"
+
+pkg_setup() {
+	# fortran-2.eclass does not handle mpi wrappers
+	if use mpi; then
+		export FC="mpif90"
+		export F77="mpif77"
+		export CC="mpicc"
+		export CXX="mpic++"
+		export MPIFC="mpif90"
+		export MPICC="mpicc"
+	else
+		tc-export FC F77 CC CXX
+	fi
+
+	# Preprocesor macross can make some lines really long
+	append-fflags -ffree-line-length-none
+
+	fortran-2_pkg_setup
+}
+
+src_prepare() {
+	epatch "${FILESDIR}"/"$P"-runtest.patch
+}
+
+src_configure() {
+	export LINALG_INCLUDES="$($(tc-getPKG_CONFIG) --cflags blas lapack)"
+	export LINALG_LIBS="$($(tc-getPKG_CONFIG) --libs blas lapack)"
+	autotools-utils_src_configure
+}
+
+src_compile() {
+	autotools-utils_src_compile
+	pushd "${BUILD_DIR}"/utility > /dev/null || die
+	emake || die "emake in utility failed"
+	popd > /dev/null || die
+	if use doc; then
+		VARTEXFONTS="${T}/fonts"
+		pushd "${BUILD_DIR}"/doc/user_guide > /dev/null || die
+		emake || die 'emake in doc/user_guide failed'
+		cd "${BUILD_DIR}"/doc/tutorial
+		emake || die 'emake in doc/tutorial failed'
+		cd "${BUILD_DIR}"/utility/w90vdw/doc
+		emake || die 'emake in utility/w90vdw/doc failed'
+		cd "${BUILD_DIR}"/utility/w90pov/doc
+		emake || die 'emake in utility/w90pov/doc failed'
+		popd > /dev/null || die
+	fi
+}
+
+src_test() {
+	einfo "Compare the 'Standard' and 'Current' outputs of this test."
+#	cd tests
+#	emake test
+	autotools-utils_src_compile check
+	cat "${BUILD_DIR}"/tests/wantest.log
+}
+
+src_install() {
+	autotools-utils_src_install
+	dobin "${BUILD_DIR}"/utility/w90pov/src/w90pov.x
+	dobin "${BUILD_DIR}"/utility/PL_assessment/w90_pl_assess.x
+	use perl && dobin "$S"/utility/w90_kmesh.pl
+	if use doc; then
+		dodoc "${BUILD_DIR}"/doc/tutorial/tutorial.pdf
+		dodoc "${BUILD_DIR}"/doc/user_guide/user_guide.pdf
+		dodoc "${BUILD_DIR}"/utility/w90vdw/doc/w90vdw.pdf
+		dodoc "${BUILD_DIR}"/utility/w90pov/doc/w90pov.pdf
+	fi
+}