Neural network potential for H/Ru(0001).

  1. Loncaric, Ivor 1
  2. Lindner, Steven 2
  3. Vrček, Lovro 3
  4. Alducin, Maite 4
  5. Juaristi, J. I. 5
  6. Saalfrank, Peter 2
  1. 1 Rudjer Boskovic Institute
    info

    Rudjer Boskovic Institute

    Zagreb, Croacia

    ROR https://ror.org/02mw21745

  2. 2 University of Potsdam
    info

    University of Potsdam

    Potsdam, Alemania

    ROR https://ror.org/03bnmw459

  3. 3 Genome Institute of Singapore, A*STAR
  4. 4 Centro de Fisica de Materiales CFM/MPC (CSIC-UPV/EHU)
  5. 5 Universidad del Pais Vasco (UPV/EHU)
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Editor: Zenodo

Año de publicación: 2023

Tipo: Dataset

DOI: 10.5281/ZENODO.7896157 lock_openAcceso abierto editor

Resumen

Neural network potential for H atoms on static Ru(0001) surface in PROPhet (https://github.com/biklooost/PROPhet) LAMMPS format.