Mutually polarizable QM/MM model with in situ optimized localized basis functions. (2019)

First Author: Dziedzic J
Attributed to:  Tier 2 Hub in Materials and Molecular Modelling funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1063/1.5080384

PubMed Identifier: 30795653

Publication URI: http://europepmc.org/abstract/MED/30795653

Type: Journal Article/Review

Volume: 150

Parent Publication: The Journal of chemical physics

Issue: 7

ISSN: 0021-9606