Random Structure Searching with Orbital-Free Density Functional Theory. (2021)
Attributed to:
Peta-5: A National Facility for Petascale Data Intensive Computation and Analytics
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1021/acs.jpca.0c11030
PubMed Identifier: 33586978
Publication URI: http://europepmc.org/abstract/MED/33586978
Type: Journal Article/Review
Volume: 125
Parent Publication: The journal of physical chemistry. A
Issue: 7
ISSN: 1089-5639