UNIVERISTY of WISCONSIN-MADISON

Department of Chemistry

College of Letters & Science
Thu, 08/27/2020 - 10:55am -- aandrea
TitleFull-quantum descriptions of molecular systems from constrained nuclear-electronic orbital density functional theory
Publication TypeJournal Article
Year of Publication2020
AuthorsXu, X, Yang, Y
JournalJournal of Chemical Physics
Volume153
Pagination074106
DOI10.1063/5.0014001