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v1.1.2

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@amcadmus amcadmus released this 20 Dec 19:37
· 2093 commits to master since this release
53049b7

New features:

  • GPU supported descriptor computation
  • Support ASE evaluation of deep potential
  • Trainable (true/false) descriptors

Bug fixings:

  • import warnings in common.py
  • relative force model deviation
  • freezing bug in se_ar