Long-range dispersion-inclusive machine learning potentials for structure search and optimization of hybrid organic-inorganic interfaces. (2022)

First Author: Westermayr J
Attributed to:  HIGH END COMPUTING MATERIALS CHEMISTRY CONSORTIUM funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1039/d2dd00016d

PubMed Identifier: 36091414

Publication URI: http://europepmc.org/abstract/MED/36091414

Type: Journal Article/Review

Volume: 1

Parent Publication: Digital discovery

Issue: 4

ISSN: 2635-098X