Variationally localized search direction method for constrained optimization of non-orthogonal, localized orbitals in electronic structure calculations (2013)
Attributed to:
A platform for future development and application of the ONETEP software
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1063/1.4826164
PubMed Identifier: 24182007
Publication URI: http://europepmc.org/abstract/MED/24182007
Type: Journal Article/Review
Parent Publication: The Journal of Chemical Physics
Issue: 16
ISSN: 0021-9606