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libxc-devel-6.2.2-1.1 RPM for s390x

From OpenSuSE Ports Tumbleweed for s390x

Name: libxc-devel Distribution: openSUSE:Factory:zSystems
Version: 6.2.2 Vendor: openSUSE
Release: 1.1 Build date: Thu Jun 22 23:30:21 2023
Group: Development/Libraries/Other Build host: s390zl24
Size: 384391 Source RPM: libxc-6.2.2-1.1.src.rpm
Packager: https://bugs.opensuse.org
Url: https://www.tddft.org/programs/libxc/
Summary: Development files for libxc
 
Libxc is a library of exchange and correlation functionals. Its
purpose is to be used in codes that implement density-functional
theory. The library includes most of the local density
approximations (LDAs), generalized density approximation (GGAs), and
meta-GGAs. The library provides values for the energy density and its
1st, 2nd, and (for the LDAs) 3rd derivatives.

This package contains development headers and libraries for libxc.

Provides

Requires

License

MPL-2.0

Changelog

* Thu Jun 22 2023 Martin Pluskal <mpluskal@suse.com>
  - Update to version 6.2.2:
    * Dimension of v4rhosigma2lapl, v4rhosigma2tau, v4rhosigmatau2,
      v4sigma3tau arrays was wrong
    * CMake employed ENABLE_XHOST=ON by default, resulting in
      binaries specific to the host processor
* Mon May 29 2023 Dirk Müller <dmueller@suse.com>
  - update to 6.2.0:
    * CMake does not link standard math library in shared xc
      library
    * Taylor expansions used in GGA_C_REVTCA, GGA_K_VT84F,
      MGGA_X_FT98 were not of sufficient to guarantee accuracy of
      all derivatives
    * Replaced hard cutoff in MGGA_X_MBRXC_BG with a Taylor
      expansion
    * StandardMathLibraryC.cmake reusing variable names
    * Memory allocation in xc-regression
    * MGGA_C_REVSCAN was implemented incorrectly
    * Missing comma in MGGA_XC_B97M_V
    * GGA_X_HERMAN was incorrect: the functional is really a meta-
      GGA but its form was unclear and it seems numerically
      unstable
* Wed Dec 14 2022 Atri Bhattacharya <badshah400@gmail.com>
  - Move xc-info binary to devel package and make devel pkg conflict
    with older libxc5 to work around SLPP guideline violation from
    older shared lib versions.
* Fri Dec 09 2022 Atri Bhattacharya <badshah400@gmail.com>
  - Update to version 6.0.0:
    * Changes to the internal handling of derivatives
    * Improvements in array access, resulting in significant
      speedups on GPUs.
    * Bug fix: LDA_C_KARASIEV and LDA_C_KARASIEV_MOD were
      implemented incorrectly.
    * Added:
    - GGA functionals: XC_B97_3C, X_PBE_GAUSSIAN, C_PBE_GAUSSIAN,
      X_PBE_MOD, X_NCAPR
    - HYB_GGA functionals: XC_B3P86_NWCHEM
    - MGGA functionals: C_TPSS_GAUSSIAN, C_CC, C_CCALDA, X_VCML,
      XC_VCML_RVV10
    - HYB_MGGA functionals: XC_BR3P86
    - functions to extract BibTeX reference keys from functionals
  - Specfile clean up.
  - Bump so version.
  - Drop unnecessary autotools BuildRequires (automake, autoconf,
    libtool).
  - Update source URL.
* Tue Jan 01 2019 Jan Engelhardt <jengelh@inai.de>
  - Trim time-sensitive wording from description.
* Sun Dec 30 2018 Christoph Junghans <junghans@votca.org>
  - Update to 4.2.3
    * timeout when generating the xc_func.h file with CMake.
  - Major spec file cleanup
* Sun Jun 17 2018 rwarmbier@uj.ac.za
  - Update to 4.2.1
    * Many changes (see http://www.tddft.org/programs/libxc/changes/) , f.e.:
    * License from LGPL to the Mozilla Public License 2 (MPL2).
    * CPP for Fortran sources macro, so that cpp -C -freestanding is used instead of cpp -ansi.
* Wed Mar 14 2018 robert.warmbier@wits.ac.za
  - Update to 4.0.4
    * Fixed:
    * Incorrect XC_CORRELATION flag in the XC_LDA_K_ZLP, XC_LDA_X_RAE, and XC_GGA_XC_HLE16 functionals.
    * Incorrect XC_EXCHANGE flag in the XC_GGA_C_SG4, XC_GGA_C_PBE_MOL, and XC_GGA_C_TM_PBE functionals.
    * Incorrect XC_EXCHANGE_CORRELATION flag in the XC_MGGA_C_SCAN_RVV10 functional.
    * Incorrect XC_FAMILY_MGGA family in the HYB_MGGA_XC_B0KCIS functional.
* Wed Nov 22 2017 robert.warmbier@wits.ac.za
  - Update to 4.0.3
    * Fixed: Generation of libxc_docs.txt file.
    * Added: Missing C to Fortran interface for xc_f90_nlc_coef.
* Wed Nov 08 2017 robert.warmbier@wits.ac.za
  - Update to 4.0.2
    * See https://gitlab.com/libxc/libxc/wikis/Libxc-changes for details
    * There are a few incompatible changes, be careful

Files

/usr/bin/xc-info
/usr/include/libxc.bib
/usr/include/xc.h
/usr/include/xc_f03_lib_m.mod
/usr/include/xc_f90_lib_m.mod
/usr/include/xc_funcs.h
/usr/include/xc_funcs_removed.h
/usr/include/xc_funcs_worker.h
/usr/include/xc_version.h
/usr/lib64/libxc.so
/usr/lib64/libxcf03.so
/usr/lib64/libxcf90.so
/usr/lib64/pkgconfig/libxc.pc
/usr/lib64/pkgconfig/libxcf03.pc
/usr/lib64/pkgconfig/libxcf90.pc
/usr/share/doc/packages/libxc-devel
/usr/share/doc/packages/libxc-devel/AUTHORS
/usr/share/doc/packages/libxc-devel/ChangeLog
/usr/share/doc/packages/libxc-devel/NEWS
/usr/share/doc/packages/libxc-devel/README
/usr/share/licenses/libxc-devel
/usr/share/licenses/libxc-devel/COPYING

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Fabrice Bellet, Sat Mar 9 12:50:11 2024