Neural network potential for H/Ru(0001).
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Loncaric, Ivor
1
- Lindner, Steven 2
- Vrček, Lovro 3
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Alducin, Maite
4
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Juaristi, J. I.
5
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Saalfrank, Peter
2
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1
Rudjer Boskovic Institute
info
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2
University of Potsdam
info
- 3 Genome Institute of Singapore, A*STAR
- 4 Centro de Fisica de Materiales CFM/MPC (CSIC-UPV/EHU)
- 5 Universidad del Pais Vasco (UPV/EHU)
Argitaletxea: Zenodo
Argitalpen urtea: 2023
Mota: Dataset
Laburpena
Neural network potential for H atoms on static Ru(0001) surface in PROPhet (https://github.com/biklooost/PROPhet) LAMMPS format.
Finantzaketari buruzko informazioa
Finantzatzaile
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Hrvatska Zaklada za Znanost
- Extending length and time scales of first principles material modelling via machine learning