Cage versus prism: Electronic energies of the water hexamer

Journal of Physical Chemistry A

Volumn 117, Issue 30, 2013, Pages 6712-6716

  Foley, Jonathan J ^a,b   Mazziotti, David A ^a  

^a UNIVERSITY OF CHICAGO   (United States)

^b ARGONNE NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRONIC ENERGIES; ELECTRONIC STRUCTURE CALCULATIONS; INTER-MOLECULAR FORCES; MOLECULAR SYSTEMS; MULTIPLE CONFIGURATIONS; REDUCED-DENSITY MATRIX; RELATIVE ENERGIES; WAVE FUNCTION METHOD;

ELECTRONIC STRUCTURE; EXPERIMENTS; HYDROGEN BONDS; ISOMERS; WAVE FUNCTIONS;

PRISMS;

EID: 84881153365     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp405739d     Document Type: Article

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