Spatial assignment of symmetry adapted perturbation theory interaction energy components: The atomic SAPT partition

Journal of Chemical Physics

Volumn 141, Issue 4, 2014, Pages

  Parrish, Robert M ^a   Sherrill, C David ^a  

^a Georgia Institute of Techonology   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL EFFICIENCY; IONS; ITERATIVE METHODS; MOLECULAR PHYSICS;

COMPUTATIONAL COSTS; COMPUTATIONAL TRACTABILITY; INTERACTION ENERGIES; INTERMOLECULAR INTERACTIONS; MANY-BODY INTERACTIONS; MATHEMATICAL FORMS; NON-COVALENT INTERACTION; SYMMETRY ADAPTED PERTURBATION THEORY;

ATOMS;

EID: 84905669391     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4889855     Document Type: Article

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