Dataset Open Access

Data publication: Van-der-Waals exchange-correlation functionals and their high pressure and warm dense matter applications

Vorberger, Jan; Smith, Gabriel J.; van Benschoten, William Z.; Petras, Hayley R.; Moldabekov, Zhandos; Dornheim, Tobias; Shepherd, James J.

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{
  "DOI": "10.14278/rodare.4364", 
  "publisher": "Rodare", 
  "title": "Data publication: Van-der-Waals exchange-correlation functionals and their high pressure and warm dense matter applications", 
  "type": "dataset", 
  "issued": {
    "date-parts": [
      [
        2026, 
        1, 
        12
      ]
    ]
  }, 
  "author": [
    {
      "family": "Vorberger, Jan"
    }, 
    {
      "family": "Smith, Gabriel J."
    }, 
    {
      "family": "van Benschoten, William Z."
    }, 
    {
      "family": "Petras, Hayley R."
    }, 
    {
      "family": "Moldabekov, Zhandos"
    }, 
    {
      "family": "Dornheim, Tobias"
    }, 
    {
      "family": "Shepherd, James J."
    }
  ], 
  "abstract": "<p>QMC and DFT-MD data for all the figures and additional (unused) DFT-MD data. All input and output files.</p>", 
  "id": "4364"
}
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Publication date:
January 12, 2026
DOI:
10.14278/rodare.4364

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10.14278/rodare.4364

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Keyword(s):
hydrogen liquid-liquid phase transition molecular metallic equation of state van der Waals structure density functional theory
Related identifiers:
Identical to:
https://www.hzdr.de/publications/Publ-42734
Referenced by:
https://www.hzdr.de/publications/Publ-42215
Communities:
License (for files):
Creative Commons Attribution 4.0 International

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Version 1 10.14278/rodare.4364 Jan 12, 2026
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