Embedded-cluster calculations in a numeric atomic orbital density-functional theory framework. (2014)

First Author: Berger D
Attributed to:  Scalable Quantum Chemistry with Flexible Embedding Stage 2 funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1063/1.4885816

PubMed Identifier: 25027997

Publication URI: http://europepmc.org/abstract/MED/25027997

Type: Journal Article/Review

Volume: 141

Parent Publication: The Journal of chemical physics

Issue: 2

ISSN: 0021-9606