Machine learning enhanced global optimization by clustering local environments to enable bundled atomic energies
Author:
Affiliation:
1. Department of Physics and Astronomy and Interdisciplinary Nanoscience Center (iNANO), Aarhus University, 8000 Aarhus, Denmark
Funder
Villum Fonden
Natur og Univers, Det Frie Forskningsråd
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.5048290
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