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3.1.5

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@laborleben laborleben released this 24 Sep 12:55
· 26 commits to master since this release
3.1.5
47f11e4
  • support of clustering positions/coordinates in addition to indices
  • adding parameter to enable/disable (default) charge weighted clustering
  • adding a parameter to adjust the charge offset (in case where charge weighted clustering is enabled)
  • code cleanup
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