Performances of Density Functional Tight-Binding Methods for Describing Ground and Excited State Geometries of Organic Molecules
Fihey, Arnaud, Jacquemin, DenisJournal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.9b00688
Date:
October, 2019
File:
PDF, 1.21 MB
2019