The resolution of identity and chain of spheres approximations for the LPNO-CCSD singles Fock term

Molecular Physics

Volumn 110, Issue 19-20, 2012, Pages 2413-2417

  Izsák, Róbert ^a   Hansen, Andreas ^a   Neese, Frank ^a  

^a Max Planck Institut Fr Bioanorganische Chemie   (Germany)

Author keywords

coupled cluster theory; local methods; LPNO CCSD; RIJCOSX

Indexed keywords

ANALYTIC CALCULATIONS; BASIS SETS; CHAIN-OF-SPHERES; CLOSED SHELLS; COUPLED-CLUSTER THEORY; LOCAL METHODS; LPNO-CCSD; REACTION ENERGY; RIJCOSX; SINGLE PROCESSORS; SINGLE-POINT ENERGY; TOTAL SPEEDUPS;

MOLECULAR PHYSICS; RESEARCH;

ERRORS;

EID: 84868376776     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268976.2012.687466     Document Type: Article

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