Advances in Scalable Computational Chemistry. NWChem

Annual Reports in Computational Chemistry

Volumn 7, Issue , 2011, Pages 151-177

  Straatsma, T P ^a   Bylaska, E J ^a   van Dam, H J J ^a   Govind, N ^a   de Jong, W A ^a   Kowalski, K ^a   Valiev, M ^a  

^a PACIFIC NORTHWEST NATIONAL LABORATORY   (United States)

Author keywords

Classical statistical mechanics; Coupled cluster CCSD(T); Density functional theory; Molecular dynamics simulation; NWChem; Plane wave methods; Quantum chemistry methods

Indexed keywords

EID: 80054041787     PISSN: 15741400     EISSN: None     Source Type: Book Series    
DOI: 10.1016/B978-0-444-53835-2.00007-9     Document Type: Article

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