An experimentally validated neural-network potential energy surface for H-atom on free-standing graphene in full dimensionality

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Authors: Sebastian Wille, Hongyan Jiang, Oliver Bünermann, Alec M. Wodtke, Jörg Behler, Alexander Kandratsenka

Journal title: Physical Chemistry Chemical Physics

Journal number: 22/45

Journal publisher: Royal Society of Chemistry

Published year: 2020

Published pages: 26113-26120

DOI identifier: 10.1039/d0cp03462b

ISSN: 1463-9076