ONIOM(QM:QM') Electrostatic Embedding Schemes for Photochemistry in Molecular Crystals (2019)

First Author: Rivera M
Attributed to:  Towards the Computational Design of Highly Emissive Organic-Single Crystals funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jctc.8b01180

PubMed Identifier: 30865452

Publication URI: http://europepmc.org/abstract/MED/30865452

Type: Journal Article/Review

Parent Publication: Journal of Chemical Theory and Computation

Issue: 4

ISSN: 1549-9618