Exact constraints and appropriate norms in machine-learned exchange-correlation functionals

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Authors: Kanun Pokharel, James W. Furness, Yi Yao, Volker Blum, Tom J. P. Irons, Andrew M. Teale, Jianwei Sun

Journal title: Journal of Chemical Physics

Journal publisher: American Institute of Physics

Published year: 2022

Published pages: 174106

DOI identifier: 10.1063/5.0111183

ISSN: 0021-9606