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srmnitc/pyscal: 2.10.13

Sarath Menon; rogalj; Daniel S. Katz; test-bot-pathsampling; Jan Janssen


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  <identifier identifierType="DOI">10.5281/zenodo.4585666</identifier>
  <creators>
    <creator>
      <creatorName>Sarath Menon</creatorName>
      <affiliation>ICAMS, Ruhr-Universit├Ąt Bochum</affiliation>
    </creator>
    <creator>
      <creatorName>rogalj</creatorName>
    </creator>
    <creator>
      <creatorName>Daniel S. Katz</creatorName>
      <affiliation>UIUC</affiliation>
    </creator>
    <creator>
      <creatorName>test-bot-pathsampling</creatorName>
    </creator>
    <creator>
      <creatorName>Jan Janssen</creatorName>
      <affiliation>@eisenforschung</affiliation>
    </creator>
  </creators>
  <titles>
    <title>srmnitc/pyscal: 2.10.13</title>
  </titles>
  <publisher>Zenodo</publisher>
  <publicationYear>2021</publicationYear>
  <dates>
    <date dateType="Issued">2021-03-05</date>
  </dates>
  <resourceType resourceTypeGeneral="Software"/>
  <alternateIdentifiers>
    <alternateIdentifier alternateIdentifierType="url">https://zenodo.org/record/4585666</alternateIdentifier>
  </alternateIdentifiers>
  <relatedIdentifiers>
    <relatedIdentifier relatedIdentifierType="URL" relationType="IsSupplementTo">https://github.com/srmnitc/pyscal/tree/2.10.13</relatedIdentifier>
    <relatedIdentifier relatedIdentifierType="DOI" relationType="IsVersionOf">10.5281/zenodo.3522376</relatedIdentifier>
  </relatedIdentifiers>
  <version>2.10.13</version>
  <rightsList>
    <rights rightsURI="info:eu-repo/semantics/openAccess">Open Access</rights>
  </rightsList>
  <descriptions>
    <description descriptionType="Abstract">Changes
&lt;ul&gt;
&lt;li&gt;If species is not specified, output in poscar format will use pyscal function instead of ase backend&lt;/li&gt;
&lt;/ul&gt;</description>
  </descriptions>
</resource>
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