Water 16-mers and hexamers: Assessment of the three-body and electrostatically embedded many-body approximations of the correlation energy or the nonlocal energy as ways to include cooperative effects

Journal of Physical Chemistry A

Volumn 117, Issue 21, 2013, Pages 4486-4499

  Qi, Helena W ^a   Leverentz, Hannah R ^a   Truhlar, Donald G ^a  

^a University of Minnesota   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CO-OPERATIVE EFFECTS; CORRELATION FUNCTIONALS; COUPLED-CLUSTER THEORY; DENSITY FUNCTIONALS; EMBEDDED INTERACTION; EXCHANGE FUNCTIONAL; MANY-BODY EXPANSION; MEAN UNSIGNED ERRORS;

DIMERS;

EMBEDDED SYSTEMS;

EID: 84878350581     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp401463f     Document Type: Article

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