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Data publication: Describing chain-like assembly of ethoxygroup-functionalized organic molecules on Au(111) using high-throughput simulations

Lokamani, Mani; Kelling, Jeffrey; Ohmann, Robin; Meyer, Jörg; Kühne, Tim; Cuniberti, Gianaurello; Wolf, Jannic; Juckeland, Guido; Huhn, Thomas; Zahn, Peter; Moresco, Francesca; Gemming, Sibylle


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  <dc:creator>Lokamani, Mani</dc:creator>
  <dc:creator>Kelling, Jeffrey</dc:creator>
  <dc:creator>Ohmann, Robin</dc:creator>
  <dc:creator>Meyer, Jörg</dc:creator>
  <dc:creator>Kühne, Tim</dc:creator>
  <dc:creator>Cuniberti, Gianaurello</dc:creator>
  <dc:creator>Wolf, Jannic</dc:creator>
  <dc:creator>Juckeland, Guido</dc:creator>
  <dc:creator>Huhn, Thomas</dc:creator>
  <dc:creator>Zahn, Peter</dc:creator>
  <dc:creator>Moresco, Francesca</dc:creator>
  <dc:creator>Gemming, Sibylle</dc:creator>
  <dc:date>2022-01-12</dc:date>
  <dc:description>Bei diesem Datensatz handelt es sich um die Grundzustandsstruktur von PEEB auf Au(111) und die Inputdatei für DFTB+.</dc:description>
  <dc:identifier>https://rodare.hzdr.de/record/1375</dc:identifier>
  <dc:identifier>10.14278/rodare.1375</dc:identifier>
  <dc:identifier>oai:rodare.hzdr.de:1375</dc:identifier>
  <dc:relation>url:https://www.hzdr.de/publications/Publ-32816</dc:relation>
  <dc:relation>url:https://www.hzdr.de/publications/Publ-33955</dc:relation>
  <dc:relation>doi:10.14278/rodare.1374</dc:relation>
  <dc:relation>url:https://rodare.hzdr.de/communities/rodare</dc:relation>
  <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
  <dc:rights>https://creativecommons.org/licenses/by/4.0/legalcode</dc:rights>
  <dc:subject>DFTB</dc:subject>
  <dc:subject>1,4-bis(phenylethynyl)-2,5-bis(ethoxy)benzene (PEEB)</dc:subject>
  <dc:subject>STM</dc:subject>
  <dc:subject>High-Throughput</dc:subject>
  <dc:subject>Meta-Structures</dc:subject>
  <dc:title>Data publication: Describing chain-like assembly of ethoxygroup-functionalized organic molecules on Au(111) using high-throughput simulations</dc:title>
  <dc:type>info:eu-repo/semantics/other</dc:type>
  <dc:type>dataset</dc:type>
</oai_dc:dc>
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