December 2, 2022 Dataset Open Access

Sequeira, Miguel; Djurabekova, Flyura; Nordlund, Kai; Mattei, Jean-Gabriel; Monnet, Isabelle; Grygiel, Clara; Alves, Eduardo; Lorenz, Katharina

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  <identifier identifierType="DOI">10.14278/rodare.1991</identifier>
  <creators>
    <creator>
      <creatorName>Sequeira, Miguel</creatorName>
      <givenName>Miguel</givenName>
      <familyName>Sequeira</familyName>
      <nameIdentifier nameIdentifierScheme="ORCID" schemeURI="http://orcid.org/">0000-0002-0389-6143</nameIdentifier>
    </creator>
    <creator>
      <creatorName>Djurabekova, Flyura</creatorName>
      <givenName>Flyura</givenName>
      <familyName>Djurabekova</familyName>
      <affiliation>Department of Physics, University of Helsinki, Helsinki, Finland</affiliation>
    </creator>
    <creator>
      <creatorName>Nordlund, Kai</creatorName>
      <givenName>Kai</givenName>
      <familyName>Nordlund</familyName>
      <affiliation>Department of Physics, University of Helsinki, Helsinki, Finland</affiliation>
    </creator>
    <creator>
      <creatorName>Mattei, Jean-Gabriel</creatorName>
      <givenName>Jean-Gabriel</givenName>
      <familyName>Mattei</familyName>
      <affiliation>CIMAP, Normandie University, CEA, CNRS, UNICAEN, ENSICAEN-BP5133, Caen Cedex 5, France</affiliation>
    </creator>
    <creator>
      <creatorName>Monnet, Isabelle</creatorName>
      <givenName>Isabelle</givenName>
      <familyName>Monnet</familyName>
      <affiliation>CIMAP, Normandie University, CEA, CNRS, UNICAEN, ENSICAEN-BP5133, Caen Cedex 5, France</affiliation>
    </creator>
    <creator>
      <creatorName>Grygiel, Clara</creatorName>
      <givenName>Clara</givenName>
      <familyName>Grygiel</familyName>
      <affiliation>CIMAP, Normandie University, CEA, CNRS, UNICAEN, ENSICAEN-BP5133, Caen Cedex 5, France</affiliation>
    </creator>
    <creator>
      <creatorName>Alves, Eduardo</creatorName>
      <givenName>Eduardo</givenName>
      <familyName>Alves</familyName>
      <affiliation>IPFN, Instituto Superior Técnico, Campus Tecnológico e Nuclear, Lisbon, Portugal</affiliation>
    </creator>
    <creator>
      <creatorName>Lorenz, Katharina</creatorName>
      <givenName>Katharina</givenName>
      <familyName>Lorenz</familyName>
      <affiliation>INESC MN, Rua Alves Redol 9, 1000-029 Lisbon, Portugal</affiliation>
    </creator>
  </creators>
  <titles>
    <title>Data publication: Examining different regimes of ionization-induced damage in GaN through atomistic simulations</title>
  </titles>
  <publisher>Rodare</publisher>
  <publicationYear>2022</publicationYear>
  <subjects>
    <subject>Defects</subject>
    <subject>GaN</subject>
    <subject>Molecular Dynamics</subject>
    <subject>Radiation</subject>
    <subject>Recrystallization</subject>
    <subject>Two-Temperature Model</subject>
  </subjects>
  <dates>
    <date dateType="Issued">2022-12-02</date>
  </dates>
  <resourceType resourceTypeGeneral="Dataset"/>
  <alternateIdentifiers>
    <alternateIdentifier alternateIdentifierType="url">https://rodare.hzdr.de/record/1991</alternateIdentifier>
  </alternateIdentifiers>
  <relatedIdentifiers>
    <relatedIdentifier relatedIdentifierType="DOI" relationType="IsReferencedBy">10.1002/smll.202102235</relatedIdentifier>
    <relatedIdentifier relatedIdentifierType="URL" relationType="IsIdenticalTo">https://www.hzdr.de/publications/Publ-35645</relatedIdentifier>
    <relatedIdentifier relatedIdentifierType="URL" relationType="IsReferencedBy">https://www.hzdr.de/publications/Publ-35270</relatedIdentifier>
    <relatedIdentifier relatedIdentifierType="DOI" relationType="IsVersionOf">10.14278/rodare.1990</relatedIdentifier>
    <relatedIdentifier relatedIdentifierType="URL" relationType="IsPartOf">https://rodare.hzdr.de/communities/fwi</relatedIdentifier>
    <relatedIdentifier relatedIdentifierType="URL" relationType="IsPartOf">https://rodare.hzdr.de/communities/rodare</relatedIdentifier>
  </relatedIdentifiers>
  <rightsList>
    <rights rightsURI="https://creativecommons.org/licenses/by/4.0/legalcode">Creative Commons Attribution 4.0 International</rights>
    <rights rightsURI="info:eu-repo/semantics/openAccess">Open Access</rights>
  </rightsList>
  <descriptions>
    <description descriptionType="Abstract">&lt;p&gt;Two Temperature Model - Molecular Dynamics (TTM-MD) simulations describing the interaction of Swift Heavy Ions (0.35-0.54 MeV/amu Xe, 0.6 and 5.8 MeV/amu Pb, and 3.8 MeV/amu U ions. The simulations are discussed in:&lt;/p&gt;

&lt;p&gt;Sequeira, M. C., Djurabekova, F., Nordlund, K., Mattei, J.-G., Monnet, I., Grygiel, C., Alves, E., Lorenz, K., Examining Different Regimes of Ionization-Induced Damage in GaN Through Atomistic Simulations. Small 2022, 2102235. &lt;a href="http://doi.org/10.1002/smll.202102235"&gt;https://doi.org/10.1002/smll.202102235&lt;/a&gt;&lt;/p&gt;

&lt;p&gt;Each zip file contains the input and output corresponding to each ion simulation. The input and output files are those used and generated by PARCAS 5.22 (https://gitlab.com/acclab/parcas). The radial energy profile deposited by the ion, as calculated within the TTM, can be found in the in/track.in file. The file contains two columns: one with the distance to the ion trajectory (in Angstrom) and another with the energy per atom (in eV/atom). For additional information on the simulations (e.g. bulk vs surface), please refer to the methods section of the reference above.&lt;/p&gt;</description>
  </descriptions>
</resource>