Highly Efficient, Linear-Scaling Seminumerical Exact-Exchange Method for Graphic Processing Units.
Journal
Journal of chemical theory and computation
ISSN: 1549-9626
Titre abrégé: J Chem Theory Comput
Pays: United States
ID NLM: 101232704
Informations de publication
Date de publication:
10 Mar 2020
10 Mar 2020
Historique:
pubmed:
14
2
2020
medline:
14
2
2020
entrez:
14
2
2020
Statut:
ppublish
Résumé
We present a highly efficient and asymptotically linear-scaling graphic processing unit accelerated seminumerical exact-exchange method (sn-LinK). We go beyond our previous central processing unit-based method (Laqua, H.; Kussmann, J.; Ochsenfeld, C.
Identifiants
pubmed: 32053375
doi: 10.1021/acs.jctc.9b00860
doi:
Types de publication
Journal Article
Langues
eng
Sous-ensembles de citation
IM