The ONETEP linear-scaling density functional theory program. (2020)
Attributed to:
Application of large-scale quantum mechanical simulation to the development of future drug therapies
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1063/5.0004445
PubMed Identifier: 32384832
Publication URI: http://europepmc.org/abstract/MED/32384832
Type: Journal Article/Review
Volume: 152
Parent Publication: The Journal of chemical physics
Issue: 17
ISSN: 0021-9606