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MRChem-v1.1.1: Bugfix release
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@stigrj stigrj released this 02 Dec 17:59
· 8 commits to release/1.1 since this release
v1.1.1
744b3e5
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Learn about vigilant mode.

Fixed

  • Use dynamic threshold in 0th iteration (initial guess) SCRF
  • Bundling issue with pyparsing in input parser
  • Bug in CUBEfile parser
Assets 2
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