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A QM/MD Coupling Method to Model the Ion-Induced Polarization of Graphene (2020)

First Author: Elliott J

Attributed to: Rethinking the models of charge transport in polymeric semiconductors funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jctc.0c00239

PubMed Identifier: 32644791

Publication URI: http://europepmc.org/abstract/MED/32644791

Type: Journal Article/Review

Parent Publication: Journal of Chemical Theory and Computation

Issue: 8

ISSN: 1549-9618