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| author |   Honza Macháček <Hloupy.Honza@centrum.cz> | 2016-06-07 10:52:34 +0200 |
|---|---|---|
| committer | Honza Macháček <Hloupy.Honza@centrum.cz> | 2016-06-07 10:52:34 +0200 |
| commit | 6a570714eafe29fa3525ebbb6c096187b73b19c1 (patch) | |
| tree | bf0c54b87b5be1240a07fab5dac1857995b361b5 /sci-physics/atompaw | |
| parent | sci-mathematics/scilab: fix freehep dependency (diff) | |
| download | sci-6a570714eafe29fa3525ebbb6c096187b73b19c1.tar.gz sci-6a570714eafe29fa3525ebbb6c096187b73b19c1.tar.bz2 sci-6a570714eafe29fa3525ebbb6c096187b73b19c1.zip | |
sci-chemistry/atompaw version bumped to 4.0.0.13
Package-Manager: portage-2.2.27
Diffstat (limited to 'sci-physics/atompaw')
| -rw-r--r-- | sci-physics/atompaw/Manifest | 1 | ||||
| -rw-r--r-- | sci-physics/atompaw/atompaw-4.0.0.13.ebuild | 69 |
2 files changed, 70 insertions, 0 deletions
diff --git a/sci-physics/atompaw/Manifest b/sci-physics/atompaw/Manifest index e3138e143..6ccd4ec8c 100644 --- a/sci-physics/atompaw/Manifest +++ b/sci-physics/atompaw/Manifest @@ -1,4 +1,5 @@ DIST atompaw-3.0.1.9.tar.gz 3809640 SHA256 6acc591ec3f5c5bb4652a40e4d8414619d680e84e370143d4ca36df7d50f0c63 SHA512 0608e289bfd51bfdce618f24c3056b8258ae2273ecc8671f931dd553d8356bd245911f0c2e461a890b4bf3e14f0fa5f3ac2d0c6c60bc19665b56236619ccf1d4 WHIRLPOOL 5a1a37fc1913a5e510d516ea996842e0cc193856298137c05b28e25d5f653b3c9ef34356fe95829164ab20f7d9e5627c3eac273d3be7511a80150d128aa72e0f DIST atompaw-4.0.0.10.tar.gz 5612750 SHA256 a2c9a28cfacf16f94e1aca1684644b09c8c1d2a6270bad0d4576dfeb475a3011 SHA512 c487fd287091b5080b467284b4145f78e6643a7814c822164f201c7ab383f7e0db7b2aaff3a5e0c26341ec0858eca60b83aa0c6ad75a7e9b6660518458d72475 WHIRLPOOL 340aac53418609e13fcde545fa1baba6faa76000529dbbe45b9ff59fe944cef50e0e725dd34c7f78e35c3e93f9fe73a9c5a6bdf68daa3511ad9ff55baeb26649 +DIST atompaw-4.0.0.13.tar.gz 5615203 SHA256 cbd73f11f3e9cc3ff2e5f3ec87498aeaf439555903d0b95a72f3b0a021902020 SHA512 81ebd586200b7cfdcc6c0e47369d42d736ed742fcba71c7f286d4b6cefeb5385c9002390af799cec0d53e8156a1d5bed3f5d9e3f5c171f55f4bb5c82b98a5fab WHIRLPOOL 1f4cf06bf983389a5830285de8f1e0887e201cd2905522e95b1a8c95e4c63a463fab79355359e99813d08f6dda61593e9d1ee3b3edf4512449d7169d427370c4 DIST atompaw.pdf 334715 SHA256 10a70f0c31e4a0a06e31b2b922b938742daf8635c87b95f5a48609555d9397ed SHA512 287f521a10b144bf8c6f59f21a025a8b1e0f6a23d576abe347be8fd41f8577dec0febd289618384d6e7796f0f68bfb41672c9d6d7bf1658f245cff20463ffff7 WHIRLPOOL ae9280374777fd61751d60b4944f3d21aceb86d3b6f4879ced1c26200e33d8ebb08b99e81cffd562e43643274f83bd6d4263360d399acee7eefad3f36791606a DIST atompawEqns.pdf 198480 SHA256 181af33190b77b630c1fb94882d0cbc5f79281346f93c25ef4d645806f2c1dc6 SHA512 e0b7fcbce906ceda953e000378786d3b679b68a5dd3d1a53b8d41a61e80bfa5a83fa04a6b8945b274ffe351491bffe3bdd801937f1b838f90b21e462fb09b9e9 WHIRLPOOL 9ba9c90df0c368b935fce573a6be30c492819fda4245f10d217bff3576f82b21036aeee837c28e5b694220f2749a6cf7e26b797b2690624dbfbc3bb598cc2bdd diff --git a/sci-physics/atompaw/atompaw-4.0.0.13.ebuild b/sci-physics/atompaw/atompaw-4.0.0.13.ebuild new file mode 100644 index 000000000..1251b17e5 --- /dev/null +++ b/sci-physics/atompaw/atompaw-4.0.0.13.ebuild @@ -0,0 +1,69 @@ +# Copyright 1999-2014 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="PAW atomic data generator" +HOMEPAGE="http://www.wfu.edu/~natalie/papers/pwpaw/man.html" +SRC_URI=" + http://www.wfu.edu/~natalie/papers/pwpaw/${P}.tar.gz + doc? ( + http://www.wfu.edu/~natalie/papers/pwpaw/atompaw.pdf + http://www.wfu.edu/~natalie/papers/pwpaw/notes/atompaw/atompawEqns.pdf )" + +LICENSE="GPL-2" +SLOT="0" +KEYWORDS="~amd64 ~x86" +IUSE="doc libxc longplot test" + +RDEPEND=" + virtual/blas + virtual/lapack + libxc? ( >=sci-libs/libxc-2.0.1[fortran] )" +DEPEND="${RDEPEND} + virtual/pkgconfig" + +DOCS=( README ) + +FORTRAN_STANDARD=90 + +src_unpack() { + unpack ${P}.tar.gz + if use doc; then + cp "${DISTDIR}"/atompaw.pdf "${DISTDIR}"/atompawEqns.pdf "${S}"/doc/ || die + fi +} + +src_prepare() { + use longplot && epatch "${FILESDIR}"/4.0-longplot.patch +} + +src_configure() { + local myeconfargs=( + $(use_enable libxc) + --with-linalg-flavor=atlas + --with-linalg-libs="$($(tc-getPKG_CONFIG) --libs lapack)" + --with-libxc-incs="-I/usr/include $($(tc-getPKG_CONFIG) --cflags libxc)" + --with-libxc-libs="$($(tc-getPKG_CONFIG) --libs libxc)" + FC="$(tc-getFC)" FCFLAGS="${FCFLAGS:- ${FFLAGS:- -O2}}" + CC="$(tc-getCC)" LDFLAGS="${LDFLAGS:- ${CFLAGS:- -O2}}" + ) + autotools-utils_src_configure +} + +src_compile() { + autotools-utils_src_compile -j1 +} + +src_test() { + use test && autotools-utils_src_test +} + +src_install() { + autotools-utils_src_install + + use doc && dodoc doc/atompaw.pdf doc/atompawEqns.pdf +} |