Dispersion XDM with Hybrid Functionals: Delocalization Error and Halogen Bonding in Molecular Crystals
dc.contributor.author | Otero de la Roza, Alberto | |
dc.contributor.author | LeBlanc, Luc M. | |
dc.contributor.author | Johnson, Erin R. | |
dc.date.accessioned | 2021-05-25T17:55:17Z | |
dc.date.available | 2021-05-25T17:55:17Z | |
dc.date.issued | 2019-08-01 | |
dc.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 | en_US |
dc.identifier.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 | en_US |
dc.identifier.uri | http://hdl.handle.net/10222/80506 | |
dc.publisher | American Chemical Society | en_US |
dc.relation.ispartof | Journal of Chemical Theory and Computation | en_US |
dc.relation.isversionof | https://doi.org/10.1021/acs.jctc.9b00550 | |
dc.title | Dispersion XDM with Hybrid Functionals: Delocalization Error and Halogen Bonding in Molecular Crystals | en_US |
dc.type | Manuscript | en_US |
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