Coupling quantum Monte Carlo to a nonlinear polarizable continuum model for spherical solutes

Journal of Physical Chemistry B

Volumn 110, Issue 51, 2006, Pages 26225-26231

  Amovilli, Claudio ^a   Filippi, Claudia ^b   Floris, Franca Maria ^a  

^a UNIVERSITY OF PISA   (Italy)

^b UNIVERSITEIT LEIDEN   (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

CONTINUUM MECHANICS; DIELECTRIC PROPERTIES; ELECTRONIC DENSITY OF STATES; POLARIZATION; PROBABILITY DENSITY FUNCTION; QUANTUM CRYPTOGRAPHY; SOLVENTS;

NONLINEAR POLARIZABLE CONTINUUM MODEL; POLARIZATION CONTRIBUTION; QUANTUM CHEMICAL METHODS; QUANTUM MECHANICAL TREATMENT;

MONTE CARLO METHODS;

EID: 84961986745     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp066006d     Document Type: Article

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