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Author SHA256 Message Date
Christoph Junghans
0eec135b39 Accepting request 946726 from home:cjunghans:branches:science 
- 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]) 
- Also obsoletes votca-csg-apps
- 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])- 
- Merge votca-{tools,csg,xtp} into one package

OBS-URL: https://build.opensuse.org/request/show/946726
OBS-URL: https://build.opensuse.org/package/show/science/votca?expand=0&rev=5
 2022-01-16 02:50:34 +00:00
Dominique Leuenberger
ab7fbf34e6 Accepting request 941551 from science 
Merge votca-* into one package for more features and better testing.

OBS-URL: https://build.opensuse.org/request/show/941551
OBS-URL: https://build.opensuse.org/package/show/openSUSE:Factory/votca?expand=0&rev=1
 2021-12-20 20:06:10 +00:00
Christoph Junghans
2af6c311a8 OBS-URL: https://build.opensuse.org/package/show/science/votca?expand=0&rev=3 2021-12-19 22:37:26 +00:00
Christoph Junghans
634f751a85 OBS-URL: https://build.opensuse.org/package/show/science/votca?expand=0&rev=2 2021-12-19 22:36:46 +00:00
Christoph Junghans
a0149f071c Accepting request 941350 from home:cjunghans:branches:science 
Initial import

OBS-URL: https://build.opensuse.org/request/show/941350
OBS-URL: https://build.opensuse.org/package/show/science/votca?expand=0&rev=1
 2021-12-18 14:11:17 +00:00