Date: Sun, 15 Dec 2024 06:25:13 GMT From: Yuri Victorovich <yuri@FreeBSD.org> To: ports-committers@FreeBSD.org, dev-commits-ports-all@FreeBSD.org, dev-commits-ports-main@FreeBSD.org Subject: git: efa44eab4350 - main - science/qmcpack: update 3.15.0 =?utf-8?Q?=E2=86=92?= 3.17.1 Message-ID: <202412150625.4BF6PDBm034381@gitrepo.freebsd.org>
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The branch main has been updated by yuri: URL: https://cgit.FreeBSD.org/ports/commit/?id=efa44eab4350bc3adb58b77b9c4801010ce7f8a9 commit efa44eab4350bc3adb58b77b9c4801010ce7f8a9 Author: Yuri Victorovich <yuri@FreeBSD.org> AuthorDate: 2024-12-15 04:48:58 +0000 Commit: Yuri Victorovich <yuri@FreeBSD.org> CommitDate: 2024-12-15 06:25:05 +0000 science/qmcpack: update 3.15.0 → 3.17.1 --- science/qmcpack/Makefile | 6 +++--- science/qmcpack/distinfo | 6 +++--- science/qmcpack/files/patch-CMakeLists.txt | 6 +++--- ...l__codes_mpi__wrapper_mpi3_include_mpi3_detail_package.hpp | 11 +++++++++++ 4 files changed, 20 insertions(+), 9 deletions(-) diff --git a/science/qmcpack/Makefile b/science/qmcpack/Makefile index 3275a670a9df..bf22b3b00ae5 100644 --- a/science/qmcpack/Makefile +++ b/science/qmcpack/Makefile @@ -1,12 +1,12 @@ PORTNAME= qmcpack DISTVERSIONPREFIX= v -DISTVERSION= 3.15.0 -PORTREVISION= 6 +DISTVERSION= 3.17.1 CATEGORIES= science MAINTAINER= yuri@FreeBSD.org COMMENT= Many-body ab initio Quantum Monte Carlo code for quantum chemistry -WWW= https://www.qmcpack.org/ +WWW= https://www.qmcpack.org/ \ + https://github.com/QMCPACK/qmcpack LICENSE= BSD3CLAUSE LICENSE_FILE= ${WRKSRC}/LICENSE diff --git a/science/qmcpack/distinfo b/science/qmcpack/distinfo index a7c920cad7f5..1bbc215f233c 100644 --- a/science/qmcpack/distinfo +++ b/science/qmcpack/distinfo @@ -1,3 +1,3 @@ -TIMESTAMP = 1665201281 -SHA256 (QMCPACK-qmcpack-v3.15.0_GH0.tar.gz) = cab0b78a481bac9f74d44d2ab5314443d5fb5891c5fbda4b9a46920c2aea6839 -SIZE (QMCPACK-qmcpack-v3.15.0_GH0.tar.gz) = 120993890 +TIMESTAMP = 1734220039 +SHA256 (QMCPACK-qmcpack-v3.17.1_GH0.tar.gz) = 5318e69a46c035986e560ea3d4c79dc273b67974f01715c93b017ce2a0098399 +SIZE (QMCPACK-qmcpack-v3.17.1_GH0.tar.gz) = 122344183 diff --git a/science/qmcpack/files/patch-CMakeLists.txt b/science/qmcpack/files/patch-CMakeLists.txt index 7e555b7a8aff..b86e4b24b7b5 100644 --- a/science/qmcpack/files/patch-CMakeLists.txt +++ b/science/qmcpack/files/patch-CMakeLists.txt @@ -1,6 +1,6 @@ ---- CMakeLists.txt.orig 2022-09-28 23:03:18 UTC +--- CMakeLists.txt.orig 2023-08-25 11:42:03 UTC +++ CMakeLists.txt -@@ -292,7 +292,7 @@ set(CMAKE_CXX_EXTENSIONS OFF) +@@ -303,7 +303,7 @@ include(Testlibstdc++) include(Testlibstdc++) # Check that a C++ standard library is configured properly @@ -9,7 +9,7 @@ #----------------------------------------------------------------------- # SETUP SANITIZERS FLAGS -@@ -1043,7 +1043,7 @@ include(CTest) +@@ -1063,7 +1063,7 @@ include(CTest) #------------------------------------------------------------------- # Verify Python3 available #------------------------------------------------------------------- diff --git a/science/qmcpack/files/patch-external__codes_mpi__wrapper_mpi3_include_mpi3_detail_package.hpp b/science/qmcpack/files/patch-external__codes_mpi__wrapper_mpi3_include_mpi3_detail_package.hpp new file mode 100644 index 000000000000..74158d89089e --- /dev/null +++ b/science/qmcpack/files/patch-external__codes_mpi__wrapper_mpi3_include_mpi3_detail_package.hpp @@ -0,0 +1,11 @@ +--- external_codes/mpi_wrapper/mpi3/include/mpi3/detail/package.hpp.orig 2024-12-15 00:09:27 UTC ++++ external_codes/mpi_wrapper/mpi3/include/mpi3/detail/package.hpp +@@ -24,7 +24,7 @@ struct package : buffer { + + public: + explicit package(communicator& comm, buffer::size_type n = 0) +- : buffer{n}, bcomm_{reinterpret_cast<basic_communicator&>(comm)} { // NOLINT(cppcoreguidelines-pro-type-reinterpret-cast) TODO(correaa) break cyclic dependency of classes ++ : buffer(static_cast<size_t>(n)), bcomm_{reinterpret_cast<basic_communicator&>(comm)} { // NOLINT(cppcoreguidelines-pro-type-reinterpret-cast) TODO(correaa) break cyclic dependency of classes + reserve(n); + } + package(package const&) = delete;
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