Coupled cluster calculations in solution with the polarizable continuum model of solvation

Journal of Physical Chemistry Letters

Volumn 1, Issue 15, 2010, Pages 2369-2373

  Caricato, Marco ^a   Scalmani, Giovanni ^a   Trucks, Gary W ^a   Frisch, Michael J ^a  

^a GAUSSIAN INC   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CONTINUUM MECHANICS; SOLVATION; SOLVENTS;

ATOMISTIC REPRESENTATION; CHEMICAL PHENOMENAS; COMPUTATIONAL COSTS; COUPLED-CLUSTER CALCULATIONS; COUPLED-CLUSTER SINGLES AND DOUBLES; COUPLED-CLUSTER THEORY; EFFICIENT IMPLEMENTATION; GAS-PHASE SPECIES; GROUND-STATE ENERGIES; MOLECULAR PROPERTIES; MUTUAL POLARIZATION; POLARIZABLE CONTINUUM MODEL; SOLVENT EFFECTS; SOLVENT MOLECULES;

CLUSTER ANALYSIS;

EID: 84961985394     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/jz1007593     Document Type: Article

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