Electronic-Structure Properties from Atom-Centered Predictions of the Electron Density

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Authors: Andrea Grisafi; Alan M. Lewis; Mariana Rossi; Michele Ceriotti

Journal title: Journal of Chemical Theory and Computation

Journal number: 19

Journal publisher: American Chemical Society

Published year: 2023

Published pages: 4451

DOI identifier: 10.1021/acs.jctc.2c00850

ISSN: 1549-9618