2.3k citations · 16.8k across the 81 of their papers we have counts for
Showing 2021 · cond-mat.mtrl-sciShow all
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cond-mat.mtrl-sci2021★ 26 cited
Colossal Atomic Force Response in van der Waals Materials Arising From Electronic Correlations
Paul Hauseux, Alberto Ambrosetti, Stéphane P. A. Bordas +1
Understanding static and dynamic phenomena in complex materials at different length scales requires reliably accounting for van der Waals (vdW) interactions, which stem from long-r…
cond-mat.mtrl-sci2021★ 76 cited
BIGDML: Towards Exact Machine Learning Force Fields for Materials
Huziel E. Sauceda, Luis E. Gálvez-González, Stefan Chmiela +3
Machine-learning force fields (MLFF) should be accurate, computationally and data efficient, and applicable to molecules, materials, and interfaces thereof. Currently, MLFFs often…