votca/votca.changes

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Wed Dec 21 22:25:15 UTC 2022 - Christoph Junghans <junghans@votca.org>

- Update to 2022.1
  - fix PROJECT_VERSION in subdirs ([gh#votca/votca#951])
  - make csg_resample and csg_stat spacing consistent
    ([gh#votca/votca#956])
  - fix build on FreeBSD ([gh#votca/votca#959])
  - update CI container names ([gh#votca/votca#961])
  - Fix gw quadrature scheme ([gh#votca/votca#967])
  - update install guide for spack ([gh#votca/votca#972],
    [gh#votca/votca#974])
  - drop gmx-2021 builds from CI ([gh#votca/votca#976])
  - update syntax for cmake 3.23 ([gh#votca/votca#978])
  - fix CI build on Ubuntu ([gh#votca/votca#981])
  - fix CI builds with icpx ([gh#votca/votca#984],
    [gh#votca/votca#1004])
  - fix CI builds with ESPResSo 4.2.0 ([gh#votca/votca#993])
  - fix localization issue ([gh#votca/votca#998],
    [gh#votca/votca#1000])
  - update github actions to new versions ([gh#votca/votca#1007],
    [gh#votca/votca#1013]) 

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Thu Dec 15 11:49:02 UTC 2022 - Guillaume GARDET <guillaume.gardet@opensuse.org>

- Disable gromacs on 32-bit arm since it is missing
- Do not requires libint when xtp is disabled

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Wed Dec  7 06:21:38 UTC 2022 - Stefan Brüns <stefan.bruens@rwth-aachen.de>

- Adjust constraints to avoid rejecting too many workers, enable
  parallel builds with limit_build.
- Clean up specfile, remove obsolete __DATE__ mangling.

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Fri Jul 29 05:23:54 UTC 2022 - Christoph Junghans <junghans@votca.org>

- only use python3-epressomd for testing on x86_64

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Sun Jan 16 01:10:58 UTC 2022 - Christoph Junghans <junghans@votca.org>

- Update to 2022
  - fix some icpc warnings ([gh#votca/votca#934])
  - only check for pytest if testing is enabled
    ([gh#votca/votca#930])
  - exclude some builds from CI ([gh#votca/votca#940],
    [gh#votca/votca#942], [gh#votca/votca#944],
    [gh#votca/votca#945])
  - update interface documentation ([gh#votca/votca#939])
  - update install guide for binary packages
    ([gh#votca/votca#936])
  - fixed sigma plot options passing ([gh#votca/votca#943]) 

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Sun Dec 19 22:37:10 UTC 2021 - Christoph Junghans <junghans@votca.org>

- Also obsoletes votca-csg-apps

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Thu Dec 16 03:53:04 UTC 2021 - Christoph Junghans <junghans@votca.org>

- Update to 2022-rc.2
  - fix iqm merge orbitals command ([gh#votca/votca#907])
  - fix bug in basisset serialization that caused wrong Vxc values
    in GW ([gh#votca/votca#910])
  - update performance compilation info ([gh#votca/votca#911])
  - license for monorepo and all license files rst -> plain text
    ([gh#votca/votca#912], [gh#votca/votca#913])
  - use python3 in xtp-tutorials ([gh#votca/votca#917])
  - bump required boost version to 1.71 ([gh#votca/votca#915],
    [gh#votca/votca#916])
  - clean up NOTICE files ([gh#votca/votca#919])
  - rm PYTHON_INSTDIR from VOTCARC ([gh#votca/votca#924])
  - update citation in xtp README ([gh#votca/votca#925])
  - fix install permission of tutorials ([gh#votca/votca#926])- 

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Mon Dec  6 11:27:23 UTC 2021 - Christoph Junghans <junghans@votca.org>

- Merge votca-{tools,csg,xtp} into one package