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sci-physics/abinit

Find total energy, charge density and electronic structure using density functional theory

Screenshots

  • abinit-5.4.4
    ~amd64 ~ppc ~x86
    mpi test debug
    View      Download      License: GPL-2
  • abinit-5.3.4
    ~ppc ~x86
    mpi test debug
    View      Download      License: GPL-2

ChangeLog

# ChangeLog for sci-physics/abinit
# Copyright 1999-2008 Gentoo Foundation; Distributed under the GPL v2
# $Header: /var/cvsroot/gentoo-x86/sci-physics/abinit/ChangeLog,v 1.9 2008/07/05 01:10:36 dberkholz Exp $

*abinit-5.4.4 (05 Jul 2008)

05 Jul 2008; Donnie Berkholz <dberkholz@gentoo.org>; +abinit-5.4.4.ebuild:
(#223111) Bump, fix various compilation issues of the older version with
newer autotools. Keyword ~amd64.

31 Jan 2008; Donnie Berkholz <dberkholz@gentoo.org>;
-files/5.2.3-change-default-directories.patch, -abinit-5.2.3.ebuild:
Clean up.

*abinit-5.3.4 (09 May 2007)

09 May 2007; Donnie Berkholz <dberkholz@gentoo.org>;
+files/5.3.4-change-default-directories.patch, +abinit-5.3.4.ebuild:
Bump.

18 Oct 2006; Donnie Berkholz <dberkholz@gentoo.org>;
-files/fix-64bit-detection.patch,
-files/5.1.3-fix-blas-lapack-check.patch,
-files/change-default-directories.patch, -files/fix-test-tarball.patch,
-abinit-5.1.3.ebuild:
Pull old version.

*abinit-5.2.3 (18 Oct 2006)

18 Oct 2006; Donnie Berkholz <dberkholz@gentoo.org>;
+files/5.2.3-fix-64bit-detection.patch,
+files/5.2.3-change-default-directories.patch, +abinit-5.2.3.ebuild:
Bump. This is the first release in the 5.x series officially considered
ready for production use.

07 Jul 2006; Donnie Berkholz <dberkholz@gentoo.org>; metadata.xml:
Update to my new email address.

02 Jul 2006; Luis Medinas <metalgod@gentoo.org> metadata.xml:
Update metadata to sci-physics.

02 Jul 2006; Luis Medinas <metalgod@gentoo.org>
+files/fix-64bit-detection.patch,
+files/5.1.3-fix-blas-lapack-check.patch,
+files/change-default-directories.patch, +files/fix-test-tarball.patch,
+metadata.xml, +abinit-5.1.3.ebuild:
Moved from sci-chemistry/abinit to sci-physics/abinit.

*abinit-5.1.3 (04 Jun 2006)

04 Jun 2006; Donnie Berkholz <dberkholz@gentoo.org>;
+files/fix-64bit-detection.patch,
+files/5.1.3-fix-blas-lapack-check.patch,
+files/change-default-directories.patch, +files/fix-test-tarball.patch,
+metadata.xml, +abinit-5.1.3.ebuild:
New package for ab initio calculations using density functional theory.
Requires gcc 4.1 to build, which is why I haven't added it until now.