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hackingmaterials / automatminer

An automatic engine for predicting materials properties.
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Bump pymatgen from 2020.01.28 to 2020.10.9.1 #341

Closed dependabot-preview[bot] closed 4 years ago

dependabot-preview[bot] commented 4 years ago

Bumps pymatgen from 2020.01.28 to 2020.10.9.1.

Release notes

Sourced from pymatgen's releases.

v2020.10.9

A supplemental update, v2020.10.9.01, was pushed to add back the Specie and DummySpecie root-level convenience imports, to preserve backwards compatibility.

v2020.9.14

v2020.8.13

Supplemental release notes to include bug fix in MPHSEBSSet caught during release process, and a more general method of including package data (.json, .yaml, .csv).

v2020.8.3

  • Change neighbor-finding algorithm extension to C instead of C++ for better cross-platform robustness (@chc273)
  • Add I/O for JARVIS Atoms (@knc6)

Apologies for double release, previous tag had version string set incorrectly.

v2020.7.18

  • Add validation and extrapolation for stitching XAS (@yimingcheng)
  • Better error handling and possibly verbose warning to get_structure_by_material_id

v2020.7.16

Changelog

Sourced from pymatgen's changelog.

Change log

v2020.10.9

v2020.9.14

v2020.8.13

v2020.8.3

  • Change neighbor-finding algorithm extension to C instead of C++ for better cross-platform robustness (@chc273)
  • Add I/O for JARVIS Atoms (@knc6)

v2020.7.18

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dependabot-preview[bot] commented 4 years ago

Superseded by #342.