Optimizing Molecular Geometries in Strong Magnetic Fields.
J Chem Theory Comput. 2021 Apr 13;17(4):2166-2185. doi: 10.1021/acs.jctc.0c01297. Epub 2021 Mar 16.
J Chem Theory Comput. 2021.
PMID: 33724812
Free PMC article.