Machine learning of accurate energy-conserving molecular force fields

Summary

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Authors: Stefan Chmiela, Alexandre Tkatchenko, Huziel E. Sauceda, Igor Poltavsky, Kristof T. Schütt, Klaus-Robert Müller

Journal title: Science Advances

Journal number: 3/5

Journal publisher: American Association for the Advancement of Science

Published year: 2017

Published pages: e1603015

DOI identifier: 10.1126/sciadv.1603015

ISSN: 2375-2548