From 732f65b463bbb68e05a530dfa6655d1246160d00 Mon Sep 17 00:00:00 2001
From: badshah400 <>
Date: Sep 16 2022 12:57:40 +0000
Subject: Update libmbd to version 0.12.6 / rev 1 via SR 1003990
https://build.opensuse.org/request/show/1003990
by user badshah400 + dimstar_suse
Many-body dispersion lib, needed for upcoming quantum-espresso update
---
diff --git a/.files b/.files
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diff --git a/.meta b/.meta
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+
+ Many-body dispersion library
+ Libmbd implements the many-body dispersion (MBD) method in several programming
+languages and frameworks. This is the reference implementation in Fortran and
+C.
+
+
+
+ https://github.com/libmbd/libmbd
+
diff --git a/.rev b/.rev
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+
+
+ 4142fbeb4289ced5fba33aeee26281e9
+ 0.12.6
+
+ dimstar_suse
+ Many-body dispersion lib, needed for upcoming quantum-espresso update
+ 1003990
+
+
diff --git a/_multibuild b/_multibuild
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+
+ mvapich2
+ openmpi4
+
diff --git a/libmbd-0.12.6.tar.gz b/libmbd-0.12.6.tar.gz
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+/ipfs/bafkreibat2wqgzuq5le6gcfagbiulrxyro73la5br4gs4rrsgnmdhurldi
\ No newline at end of file
diff --git a/libmbd.changes b/libmbd.changes
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+-------------------------------------------------------------------
+Wed Sep 14 17:35:47 UTC 2022 - Atri Bhattacharya
+
+- Update to version 0.12.6:
+ * Ewald cutoff scaling to Python/C API
+ * Density evaluation to Python/C API
+ * Access to intermediate vdW params to Python/C API
+
+-------------------------------------------------------------------
+Mon Aug 1 22:05:22 UTC 2022 - Atri Bhattacharya
+
+- Initial package.
diff --git a/libmbd.spec b/libmbd.spec
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+#
+# spec file for package libmbd
+#
+# Copyright (c) 2022 SUSE LLC
+#
+# All modifications and additions to the file contributed by third parties
+# remain the property of their copyright owners, unless otherwise agreed
+# upon. The license for this file, and modifications and additions to the
+# file, is the same license as for the pristine package itself (unless the
+# license for the pristine package is not an Open Source License, in which
+# case the license is the MIT License). An "Open Source License" is a
+# license that conforms to the Open Source Definition (Version 1.9)
+# published by the Open Source Initiative.
+
+# Please submit bugfixes or comments via https://bugs.opensuse.org/
+#
+
+
+%global flavor @BUILD_FLAVOR@%{nil}
+%global srcname libmbd
+
+# SECTION MPI DEFINITIONS
+%if "%{flavor}" == "mvapich2"
+%global mpi_flavor mvapich2
+%endif
+
+%if "%{flavor}" == "openmpi4"
+%global mpi_flavor openmpi
+%define mpi_vers 4
+%endif
+
+%{?mpi_flavor:%{bcond_without mpi}}%{!?mpi_flavor:%{bcond_with mpi}}
+%{?with_mpi:%{!?mpi_flavor:error "No MPI family specified!"}}
+
+%if %{with mpi}
+%define my_prefix %{_libdir}/mpi/gcc/%{mpi_flavor}%{?mpi_vers}
+%define my_bindir %{my_prefix}/bin
+%define my_libdir %{my_prefix}/%{_lib}
+%define my_incdir %{my_prefix}/include
+%define my_datadir %{my_prefix}/share
+%define my_suffix -%{mpi_flavor}%{?mpi_vers}
+%else
+%define my_prefix %{_prefix}
+%define my_bindir %{_bindir}
+%define my_libdir %{_libdir}
+%define my_incdir %{_includedir}
+%define my_datadir %{_datadir}
+%endif
+# /SECTION MPI DEFINITIONS
+
+Name: %{srcname}%{?my_suffix}
+Version: 0.12.6
+Release: 0
+Summary: Many-body dispersion library
+License: MPL-2.0
+URL: https://github.com/libmbd/libmbd
+Source: %{url}/releases/download/%{version}/%{srcname}-%{version}.tar.gz
+BuildRequires: cmake
+BuildRequires: gcc-fortran
+BuildRequires: lapack-devel
+%if %{with mpi}
+BuildRequires: %{mpi_flavor}%{?mpi_vers}-devel
+BuildRequires: scalapack%{?my_suffix}-devel
+%if 0%{?suse_version} >= 1550 && "%{flavor}" != "mvapich2"
+BuildRequires: %{mpi_flavor}%{?mpi_vers}-config
+%endif
+%endif
+
+%description
+Libmbd implements the many-body dispersion (MBD) method in several programming
+languages and frameworks. This is the reference implementation in Fortran and
+C.
+
+%package devel
+Summary: Many-body dispersion library -- headers and sources
+Requires: %{name} = %{version}
+%if %{with mpi}
+Requires: scalapack%{?my_suffix}-devel
+%endif
+
+%description devel
+Libmbd implements the many-body dispersion (MBD) method in several programming
+languages and frameworks. This is the reference implementation in Fortran and
+C.
+
+This package provides the files needed for developing against %{name}.
+
+%prep
+%autosetup -p1 -n %{srcname}-%{version}
+
+%build
+%if %{with mpi}
+source %{my_bindir}/mpivars.sh
+%endif
+
+%cmake -DCMAKE_INSTALL_PREFIX:PATH=%{my_prefix} \
+ -DCMAKE_PREFIX_PATH:PATH=%{my_prefix} \
+ -DCMAKE_INSTALL_LIBDIR:PATH=%{my_libdir} \
+ -DENABLE_SCALAPACK_MPI:BOOL=%{?with_mpi:ON}%{!?with_mpi:OFF} \
+ -DSCALAPACK_LIBRARY:PATH=%{my_libdir}/libscalapack.so \
+ %{nil}
+%cmake_build
+
+%install
+%cmake_install
+
+%post -p /sbin/ldconfig
+%postun -p /sbin/ldconfig
+
+%files
+%{my_libdir}/libmbd.so
+
+%files devel
+%license LICENSE
+%doc README.md
+%{my_incdir}/mbd
+%if %{with mpi}
+%dir %{my_libdir}/cmake
+%endif
+%{my_libdir}/cmake/mbd/
+
+%changelog