Date: Tue, 28 Aug 2018 00:57:26 +0000 (UTC) From: Yuri Victorovich <yuri@FreeBSD.org> To: ports-committers@freebsd.org, svn-ports-all@freebsd.org, svn-ports-head@freebsd.org Subject: svn commit: r478276 - in head/science: . libint2 libint2/files Message-ID: <201808280057.w7S0vQm9054028@repo.freebsd.org>
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Author: yuri Date: Tue Aug 28 00:57:26 2018 New Revision: 478276 URL: https://svnweb.freebsd.org/changeset/ports/478276 Log: New port: science/libint2: Evaluate the integrals in modern atomic and molecular theory Repocopy of science/libint. science/libint is at version 1.X, is incompatible, and is used by several other packages. Added: head/science/libint2/ - copied from r478259, head/science/libint/ head/science/libint2/files/ head/science/libint2/files/patch-src_bin_libint_tactic.h (contents, props changed) Modified: head/science/Makefile head/science/libint2/Makefile head/science/libint2/distinfo head/science/libint2/pkg-descr head/science/libint2/pkg-plist Modified: head/science/Makefile ============================================================================== --- head/science/Makefile Tue Aug 28 00:56:04 2018 (r478275) +++ head/science/Makefile Tue Aug 28 00:57:26 2018 (r478276) @@ -101,6 +101,7 @@ SUBDIR += libgeodecomp SUBDIR += libghemical SUBDIR += libint + SUBDIR += libint2 SUBDIR += libkml SUBDIR += liblinear SUBDIR += liboglappth Modified: head/science/libint2/Makefile ============================================================================== --- head/science/libint/Makefile Mon Aug 27 22:56:43 2018 (r478259) +++ head/science/libint2/Makefile Tue Aug 28 00:57:26 2018 (r478276) @@ -1,9 +1,10 @@ # Created by: NAKATA, Maho <maho@FreeBSD.org> # $FreeBSD$ -PORTNAME= libint -DISTVERSIONPREFIX= release- -DISTVERSION= 1-2-1 +PORTNAME= libint2 +DISTVERSIONPREFIX= v +DISTVERSION= 2.5.0-beta.2-20 +DISTVERSIONSUFFIX= -gc2e0a72 CATEGORIES= science MAINTAINER= yuri@FreeBSD.org @@ -12,15 +13,23 @@ COMMENT= Evaluate the integrals in modern atomic and m LICENSE= GPLv2 LICENSE_FILE= ${WRKSRC}/LICENSE -USES= autoreconf:build gmake libtool +BROKEN_FreeBSD_10= /usr/include/c++/v1/memory:4004:35: error: no viable overloaded '=': __e->__weak_this_ = *this; + +LIB_DEPENDS= libboost_system.so:devel/boost-libs \ + libgmpxx.so:math/gmp + +USES= autoreconf:build compiler:c++11-lang gmake libtool localbase:ldflags USE_GITHUB= yes GH_ACCOUNT= evaleev +GH_PROJECT= ${PORTNAME:S/2//} USE_LDCONFIG= yes ALL_TARGET= default GNU_CONFIGURE= yes CONFIGURE_ARGS= --enable-shared --disable-static --with-cc-optflags="${CFLAGS}" \ --with-cxx-optflags="${CXXFLAGS}" + +DATADIR= ${PREFIX}/share/${PORTNAME:S/2//} post-patch: @${REINPLACE_CMD} -e 's| -rpath|${LDFLAGS} -rpath|g' \ Modified: head/science/libint2/distinfo ============================================================================== --- head/science/libint/distinfo Mon Aug 27 22:56:43 2018 (r478259) +++ head/science/libint2/distinfo Tue Aug 28 00:57:26 2018 (r478276) @@ -1,3 +1,3 @@ -TIMESTAMP = 1535407045 -SHA256 (evaleev-libint-release-1-2-1_GH0.tar.gz) = fe5900c98d6adfeadb69cecee9895548ef69b5464f9c2cfb85bd315cf349f3a4 -SIZE (evaleev-libint-release-1-2-1_GH0.tar.gz) = 298356 +TIMESTAMP = 1535411311 +SHA256 (evaleev-libint-v2.5.0-beta.2-20-gc2e0a72_GH0.tar.gz) = dd2fc5bcbc6373475f9dd00aa7fa5ee3a26d0f89e725d5a0c3a03ae1b6d1525c +SIZE (evaleev-libint-v2.5.0-beta.2-20-gc2e0a72_GH0.tar.gz) = 11944895 Added: head/science/libint2/files/patch-src_bin_libint_tactic.h ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/libint2/files/patch-src_bin_libint_tactic.h Tue Aug 28 00:57:26 2018 (r478276) @@ -0,0 +1,10 @@ +--- src/bin/libint/tactic.h.orig 2018-08-27 23:11:44 UTC ++++ src/bin/libint/tactic.h +@@ -21,6 +21,7 @@ + #include <cmath> + #include <cstdlib> + #include <smart_ptr.h> ++#include <time.h> + + #ifndef _libint2_src_bin_libint_tactic_h_ + #define _libint2_src_bin_libint_tactic_h_ Modified: head/science/libint2/pkg-descr ============================================================================== --- head/science/libint/pkg-descr Mon Aug 27 22:56:43 2018 (r478259) +++ head/science/libint2/pkg-descr Tue Aug 28 00:57:26 2018 (r478276) @@ -1,5 +1,4 @@ Libint is a library for evaluating ERI (electron replusion integral) -over Cartesian Gaussian fuctions for modern atomic and molecular theory; -esp. for science/mpqc and science/psi3. +over Cartesian Gaussian fuctions for modern atomic and molecular theory. WWW: https://github.com/evaleev/libint Modified: head/science/libint2/pkg-plist ============================================================================== --- head/science/libint/pkg-plist Mon Aug 27 22:56:43 2018 (r478259) +++ head/science/libint2/pkg-plist Tue Aug 28 00:57:26 2018 (r478276) @@ -1,14 +1,347 @@ -include/libderiv/libderiv.h -include/libint/hrr_header.h -include/libint/libint.h -include/libint/vrr_header.h -include/libr12/libr12.h -lib/libderiv.so -lib/libderiv.so.1 -lib/libderiv.so.1.0.0 -lib/libint.so -lib/libint.so.1 -lib/libint.so.1.0.0 -lib/libr12.so -lib/libr12.so.1 -lib/libr12.so.1.0.0 +include/libint2.h +include/libint2.hpp +include/libint2/GenericContract.h +include/libint2/GenericGaussDeriv.h +include/libint2/GenericGaussDeriv.impl.h +include/libint2/GenericScale.h +include/libint2/ITR_xs_xs.h +include/libint2/OSVRR_sx_sx.h +include/libint2/OSVRR_sx_sx_deriv.h +include/libint2/OSVRR_xs_xs.h +include/libint2/OSVRR_xs_xs_deriv.h +include/libint2/VRR_GTG_1d_xx_xx.h +include/libint2/VRR_GTG_1d_xx_xx_vec.h +include/libint2/VRR_r12kg12_xs_xs.h +include/libint2/atom.h +include/libint2/basis.h +include/libint2/boost/preprocessor.hpp +include/libint2/boost/preprocessor/arithmetic.hpp +include/libint2/boost/preprocessor/arithmetic/add.hpp +include/libint2/boost/preprocessor/arithmetic/dec.hpp +include/libint2/boost/preprocessor/arithmetic/detail/div_base.hpp +include/libint2/boost/preprocessor/arithmetic/div.hpp +include/libint2/boost/preprocessor/arithmetic/inc.hpp +include/libint2/boost/preprocessor/arithmetic/mod.hpp +include/libint2/boost/preprocessor/arithmetic/mul.hpp +include/libint2/boost/preprocessor/arithmetic/sub.hpp +include/libint2/boost/preprocessor/array.hpp +include/libint2/boost/preprocessor/array/data.hpp +include/libint2/boost/preprocessor/array/detail/get_data.hpp +include/libint2/boost/preprocessor/array/elem.hpp +include/libint2/boost/preprocessor/array/enum.hpp +include/libint2/boost/preprocessor/array/insert.hpp +include/libint2/boost/preprocessor/array/pop_back.hpp +include/libint2/boost/preprocessor/array/pop_front.hpp +include/libint2/boost/preprocessor/array/push_back.hpp +include/libint2/boost/preprocessor/array/push_front.hpp +include/libint2/boost/preprocessor/array/remove.hpp +include/libint2/boost/preprocessor/array/replace.hpp +include/libint2/boost/preprocessor/array/reverse.hpp +include/libint2/boost/preprocessor/array/size.hpp +include/libint2/boost/preprocessor/array/to_list.hpp +include/libint2/boost/preprocessor/array/to_seq.hpp +include/libint2/boost/preprocessor/array/to_tuple.hpp +include/libint2/boost/preprocessor/cat.hpp +include/libint2/boost/preprocessor/comparison.hpp +include/libint2/boost/preprocessor/comparison/equal.hpp +include/libint2/boost/preprocessor/comparison/greater.hpp +include/libint2/boost/preprocessor/comparison/greater_equal.hpp +include/libint2/boost/preprocessor/comparison/less.hpp +include/libint2/boost/preprocessor/comparison/less_equal.hpp +include/libint2/boost/preprocessor/comparison/not_equal.hpp +include/libint2/boost/preprocessor/config/config.hpp +include/libint2/boost/preprocessor/config/limits.hpp +include/libint2/boost/preprocessor/control.hpp +include/libint2/boost/preprocessor/control/deduce_d.hpp +include/libint2/boost/preprocessor/control/detail/dmc/while.hpp +include/libint2/boost/preprocessor/control/detail/edg/while.hpp +include/libint2/boost/preprocessor/control/detail/msvc/while.hpp +include/libint2/boost/preprocessor/control/detail/while.hpp +include/libint2/boost/preprocessor/control/expr_if.hpp +include/libint2/boost/preprocessor/control/expr_iif.hpp +include/libint2/boost/preprocessor/control/if.hpp +include/libint2/boost/preprocessor/control/iif.hpp +include/libint2/boost/preprocessor/control/while.hpp +include/libint2/boost/preprocessor/debug.hpp +include/libint2/boost/preprocessor/debug/assert.hpp +include/libint2/boost/preprocessor/debug/error.hpp +include/libint2/boost/preprocessor/debug/line.hpp +include/libint2/boost/preprocessor/detail/auto_rec.hpp +include/libint2/boost/preprocessor/detail/check.hpp +include/libint2/boost/preprocessor/detail/dmc/auto_rec.hpp +include/libint2/boost/preprocessor/detail/is_binary.hpp +include/libint2/boost/preprocessor/detail/is_unary.hpp +include/libint2/boost/preprocessor/detail/split.hpp +include/libint2/boost/preprocessor/facilities.hpp +include/libint2/boost/preprocessor/facilities/apply.hpp +include/libint2/boost/preprocessor/facilities/detail/is_empty.hpp +include/libint2/boost/preprocessor/facilities/empty.hpp +include/libint2/boost/preprocessor/facilities/expand.hpp +include/libint2/boost/preprocessor/facilities/identity.hpp +include/libint2/boost/preprocessor/facilities/intercept.hpp +include/libint2/boost/preprocessor/facilities/is_1.hpp +include/libint2/boost/preprocessor/facilities/is_empty.hpp +include/libint2/boost/preprocessor/facilities/is_empty_variadic.hpp +include/libint2/boost/preprocessor/facilities/overload.hpp +include/libint2/boost/preprocessor/iteration.hpp +include/libint2/boost/preprocessor/iteration/iterate.hpp +include/libint2/boost/preprocessor/iteration/local.hpp +include/libint2/boost/preprocessor/iteration/self.hpp +include/libint2/boost/preprocessor/library.hpp +include/libint2/boost/preprocessor/list.hpp +include/libint2/boost/preprocessor/list/adt.hpp +include/libint2/boost/preprocessor/list/append.hpp +include/libint2/boost/preprocessor/list/at.hpp +include/libint2/boost/preprocessor/list/cat.hpp +include/libint2/boost/preprocessor/list/detail/dmc/fold_left.hpp +include/libint2/boost/preprocessor/list/detail/edg/fold_left.hpp +include/libint2/boost/preprocessor/list/detail/edg/fold_right.hpp +include/libint2/boost/preprocessor/list/detail/fold_left.hpp +include/libint2/boost/preprocessor/list/detail/fold_right.hpp +include/libint2/boost/preprocessor/list/enum.hpp +include/libint2/boost/preprocessor/list/filter.hpp +include/libint2/boost/preprocessor/list/first_n.hpp +include/libint2/boost/preprocessor/list/fold_left.hpp +include/libint2/boost/preprocessor/list/fold_right.hpp +include/libint2/boost/preprocessor/list/for_each.hpp +include/libint2/boost/preprocessor/list/for_each_i.hpp +include/libint2/boost/preprocessor/list/for_each_product.hpp +include/libint2/boost/preprocessor/list/rest_n.hpp +include/libint2/boost/preprocessor/list/reverse.hpp +include/libint2/boost/preprocessor/list/size.hpp +include/libint2/boost/preprocessor/list/to_array.hpp +include/libint2/boost/preprocessor/list/to_seq.hpp +include/libint2/boost/preprocessor/list/to_tuple.hpp +include/libint2/boost/preprocessor/list/transform.hpp +include/libint2/boost/preprocessor/logical.hpp +include/libint2/boost/preprocessor/logical/and.hpp +include/libint2/boost/preprocessor/logical/bitand.hpp +include/libint2/boost/preprocessor/logical/bitnor.hpp +include/libint2/boost/preprocessor/logical/bitor.hpp +include/libint2/boost/preprocessor/logical/bitxor.hpp +include/libint2/boost/preprocessor/logical/bool.hpp +include/libint2/boost/preprocessor/logical/compl.hpp +include/libint2/boost/preprocessor/logical/nor.hpp +include/libint2/boost/preprocessor/logical/not.hpp +include/libint2/boost/preprocessor/logical/or.hpp +include/libint2/boost/preprocessor/logical/xor.hpp +include/libint2/boost/preprocessor/punctuation.hpp +include/libint2/boost/preprocessor/punctuation/comma.hpp +include/libint2/boost/preprocessor/punctuation/comma_if.hpp +include/libint2/boost/preprocessor/punctuation/detail/is_begin_parens.hpp +include/libint2/boost/preprocessor/punctuation/is_begin_parens.hpp +include/libint2/boost/preprocessor/punctuation/paren.hpp +include/libint2/boost/preprocessor/punctuation/paren_if.hpp +include/libint2/boost/preprocessor/punctuation/remove_parens.hpp +include/libint2/boost/preprocessor/repetition.hpp +include/libint2/boost/preprocessor/repetition/deduce_r.hpp +include/libint2/boost/preprocessor/repetition/deduce_z.hpp +include/libint2/boost/preprocessor/repetition/detail/dmc/for.hpp +include/libint2/boost/preprocessor/repetition/detail/edg/for.hpp +include/libint2/boost/preprocessor/repetition/detail/for.hpp +include/libint2/boost/preprocessor/repetition/detail/msvc/for.hpp +include/libint2/boost/preprocessor/repetition/enum.hpp +include/libint2/boost/preprocessor/repetition/enum_binary_params.hpp +include/libint2/boost/preprocessor/repetition/enum_params.hpp +include/libint2/boost/preprocessor/repetition/enum_params_with_a_default.hpp +include/libint2/boost/preprocessor/repetition/enum_params_with_defaults.hpp +include/libint2/boost/preprocessor/repetition/enum_shifted.hpp +include/libint2/boost/preprocessor/repetition/enum_shifted_binary_params.hpp +include/libint2/boost/preprocessor/repetition/enum_shifted_params.hpp 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