Accurate and efficient representation of intramolecular energy in ab initio generation of crystal structures. II. Smoothed intramolecular potentials. (2019)

First Author: Sugden IJ
Attributed to:  Support for the UKCP consortium funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1107/s2052520619005778

PubMed Identifier: 32830664

Publication URI: http://europepmc.org/abstract/MED/32830664

Type: Journal Article/Review

Volume: 75

Parent Publication: Acta crystallographica Section B, Structural science, crystal engineering and materials

Issue: Pt 3

ISSN: 2052-5192