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@github-actions github-actions released this 16 Sep 10:54
· 43 commits to master since this release
v0.6.0
6357eea

Crystalline v0.6.0

Diff since v0.5.4

This is intended as a preliminary release of a v0.6 series, with some flux still to be expected in the definitions of BandRep, NewBandRep, and SymmetryVector as well as tooling around it.

New features

  • nigglibasis: compute the Niggli-reduced cell basis.
  • SymmetryVector: encode the symmetry content of a set of irrep multiplicities
  • Use SymmetryVector to define a new type NewBandRep{D} (and Collection{NewBandRep{D}}, which is expected to replace BandRep (and BandRepSet) eventually.
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