Atomistic potential descriptors and structures of water and silicon phases
- Kývala, Lukáš 1
- Montero de Hijes, Pablo 1
- Dellago, Christoph 1
-
1
University of Vienna
info
Editor: Zenodo
Año de publicación: 2024
Tipo: Dataset
DOI:
10.5281/ZENODO.12744559
lock_openAcceso abierto editor
Resumen
Supportive material to manuscript: Unsupervised identification of local atomic environments from atomistic potential descriptors (arxiv.org: 2405.01320)Descriptors files have format:#AtomIndex #StructureIndex #Descriptors...