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Linear-scaling time-dependent density-functional theory beyond the Tamm-Dancoff approximation: Obtaining efficiency and accuracy with in situ optimised local orbitals. (2015)

First Author: Zuehlsdorff TJ

Attributed to: Development of wide-ranging functionality in ONETEP funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1063/1.4936280

PubMed Identifier: 26627950

Publication URI: http://europepmc.org/abstract/MED/26627950

Type: Journal Article/Review

Volume: 143

Parent Publication: The Journal of chemical physics

Issue: 20

ISSN: 0021-9606