Dispersion XDM with Hybrid Functionals: Delocalization Error and Halogen Bonding in Molecular Crystals
Date
2019-08-01
Authors
Otero de la Roza, Alberto
LeBlanc, Luc M.
Johnson, Erin R.
Journal Title
Journal ISSN
Volume Title
Publisher
American Chemical Society
Abstract
Description
This document is the unedited Author's version of a Submitted Work that was subsequently accepted for publication in the Journal of Chemical Theory and Computation, copyright © American Chemical Society after peer review. To access the final edited and published work see https://pubs.acs.org/doi/10.1021/acs.jctc.9b00550
Keywords
Citation
A. Otero de la Roza, L. M. LeBlanc, E. R. Johnson, Dispersion XDM with Hybrid Functionals: Delocalization Error and Halogen Bonding in Molecular Crystals, J. Chem. Theory Comput. 15, 4933-4944 (2019). https://doi.org/10.1021/acs.jctc.9b00550