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Releases: pierre-24/cp2k-basis

v0.5.2

06 Aug 14:19
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Stable release

Full Changelog: v0.5.1...v0.5.2

v0.5.1

06 Aug 13:36
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Stable release

v0.5.0

21 Mar 14:05
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Update everything by @pierre-24 in #24

latest

21 Mar 10:37
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latest Pre-release
Pre-release

Pre-release library

v0.4.1

22 Feb 10:26
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Fix some minor bugs (#19, #20, #21) and improve the documentation (#18)

v0.4.0

03 Jan 16:03
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Add auxiliary basis sets (#17)

v0.3.0

19 Dec 16:35
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  • -qX is for valence, not core (#5)
  • Add BASIS_MOLOPT_UCL (#6)
  • Ease the selection and change the way metadata are added and handled (#12)
  • Improve the documentation on the way
  • Change the logo

v0.2.0

14 Dec 18:42
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First version with an interesting set of basis sets and pseudos and user documentation. Also include a few bugs.