Accurate global machine learning force fields for molecules with hundreds of atoms

Summary

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Authors: Stefan Chmiela, Valentin Vassilev-Galindo, Oliver T. Unke, Adil Kabylda, Huziel E. Sauceda, Alexandre Tkatchenko, Klaus-Robert Müller

Journal title: arxiv

Journal publisher: arxiv.org

Published year: 2022

DOI identifier: 10.48550/arxiv.2209.14865