Consistent Evaluation of Magnetic Exchange Couplings in Multicenter Compounds in KS-DFT: The Recomposition Method

This is a publication. If there is no link to the publication on this page, you can try the pre-formated search via the search engines listed on this page.

Authors: David, Grégoire; Ferré, Nicolas; Le Guennic, Boris

Journal title: Journal of Chemical Theory and Computation

Journal number: 1

Journal publisher: American Chemical Society

Published year: 2022

DOI identifier: 10.1021/acs.jctc.2c01022

ISSN: 1549-9626