Change log

v2022.0.12

  • @chc273 Major bugfix for cython handling of fractional coordinates wrapping.

  • @mattmcdermott Bug fix for entry_ID phase diagram plotting bug described in this Issue: #2219

  • @FCMeng Fix for PWSCF to distinguish same element with different oxidation state, which might have different pseudopotentials.

  • @gmatteo fix minor bug when reading Structure from a netcdf4 file with hdf5 groups