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matador: v0.9.11

Matthew L. Evans


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{
  "publisher": "Zenodo", 
  "DOI": "10.5281/zenodo.4896519", 
  "title": "matador: v0.9.11", 
  "issued": {
    "date-parts": [
      [
        2021, 
        6, 
        3
      ]
    ]
  }, 
  "abstract": "<ul>\n\t<li>Minor change: allow specification of arbitrary strings for CASTEP pseudopotential libraries (#156).</li>\n\t<li>Bug fix: standardize_cell script failing to use default symmetry tolerance value (#157).</li>\n\t<li>Bug fix: scraping of .cif files with single atoms and no symmetries (#173)</li>\n\t<li>Bug fix: scraping of Hubbard U values from .castep files, and associated bugs when performing relaxations with Hubbard U (#180)</li>\n\t<li>Dependency updates and Python 3.6 deprecation warning (#158, #181)</li>\n</ul>", 
  "author": [
    {
      "family": "Matthew L. Evans"
    }
  ], 
  "version": "v0.9.11", 
  "type": "article", 
  "id": "4896519"
}
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