January 16, 2024 Dataset Open Access

Barnowsky, Tom; Curtarolo, Stefano; Krasheninnikov, Arkady; Heine, Thomas; Friedrich, Rico

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  "identifier": "https://doi.org/10.14278/rodare.2751", 
  "@id": "https://doi.org/10.14278/rodare.2751", 
  "description": "<p>This dataset includes the primary research data for the publication &quot;Magnetic State Control of Non-van der Waals 2D Materials by Hydrogenation&quot;.</p>", 
  "creator": [
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      "@id": "https://orcid.org/0000-0003-1626-4644", 
      "name": "Barnowsky, Tom", 
      "@type": "Person", 
      "affiliation": "Theoretical Chemistry, Technische Universit\u00e4t Dresden, 01062 Dresden, Germany & Institute of Ion Beam Physics and Materials Research, Helmholtz-Zentrum Dresden-Rossendorf, 01328 Dresden, Germany"
    }, 
    {
      "@id": "https://orcid.org/0000-0003-0570-8238", 
      "name": "Curtarolo, Stefano", 
      "@type": "Person", 
      "affiliation": "Center for Autonomous Materials Design, Duke University, Durham, NC 27708, USA & Materials Science, Electrical Engineering, and Physics, Duke University, Durham, NC 27708, USA"
    }, 
    {
      "@id": "https://orcid.org/0000-0003-0074-7588", 
      "name": "Krasheninnikov, Arkady", 
      "@type": "Person", 
      "affiliation": "Institute of Ion Beam Physics and Materials Research, Helmholtz-Zentrum Dresden-Rossendorf, 01328 Dresden, Germany & Department of Applied Physics, Aalto University, Aalto 00076, Finland"
    }, 
    {
      "@id": "https://orcid.org/0000-0003-2379-6251", 
      "name": "Heine, Thomas", 
      "@type": "Person", 
      "affiliation": "Theoretical Chemistry, Technische Universit\u00e4t Dresden, 01062 Dresden, Germany & Institute of Resource Ecology, Helmholtz-Zentrum Dresden-Rossendorf, 04318 Leipzig, Germany"
    }, 
    {
      "@id": "https://orcid.org/0000-0002-4066-3840", 
      "name": "Friedrich, Rico", 
      "@type": "Person", 
      "affiliation": "Theoretical Chemistry, Technische Universit\u00e4t Dresden, 01062 Dresden, Germany & Institute of Ion Beam Physics and Materials Research, Helmholtz-Zentrum Dresden-Rossendorf, 01328 Dresden, Germany & Center for Autonomous Materials Design, Duke University, Durham, NC 27708, USA"
    }
  ], 
  "url": "https://rodare.hzdr.de/record/2751", 
  "keywords": [
    "2D materials", 
    "magnetism", 
    "non-van der Waals compounds", 
    "passivation", 
    "data-driven research", 
    "computational materials science", 
    "high-throughput computing"
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  "@type": "Dataset", 
  "distribution": [
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      "contentUrl": "https://rodare.hzdr.de/api/files/dff75ecb-2d8d-4478-a75c-a5874b56479f/Data_non_vdW_2D_hydrogenation_RODARE.zip", 
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  "citation": [
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      "@type": "CreativeWork", 
      "@id": "https://doi.org/10.17815/jlsrf-3-159"
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  "version": "4", 
  "sameAs": [
    "https://www.hzdr.de/publications/Publ-37642"
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  "datePublished": "2024-01-16", 
  "license": "https://creativecommons.org/licenses/by/4.0/legalcode", 
  "name": "Data publication: Magnetic State Control of Non-van der Waals 2D Materials by Hydrogenation", 
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