How to calculate charge mobility in molecular materials from surface hopping non-adiabatic molecular dynamics - beyond the hopping/band paradigm. (2019)

First Author: Carof A
Attributed to:  HIGH END COMPUTING MATERIALS CHEMISTRY CONSORTIUM funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1039/c9cp04770k

PubMed Identifier: 31793569

Publication URI: http://europepmc.org/abstract/MED/31793569

Type: Journal Article/Review

Volume: 21

Parent Publication: Physical chemistry chemical physics : PCCP

Issue: 48

ISSN: 1463-9076