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Published July 28, 2020 | Version 0.9.6
Software Open

ml-evs/matador: v0.9.6

Creators

  • 1. University of Cambridge

Contributors

Supervisor:

  • 1. University of Birmingham

Description

  • Improvements to ASE and pymatgen interoperability (#80)
  • Fixed bug in matador.hull.TemperatureDependentHull which would crash when not provided a list of temperatures (#82).
  • Added plotting functions for magres data, and improved its handling inside matador.crystal.Crystal (#79).

Files

ml-evs/matador-0.9.6.zip

Files (16.6 MB)

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Additional details

Related works

Is supplement to
https://github.com/ml-evs/matador/tree/0.9.6 (URL)