Generalization of the Gaussian electrostatic model: Extension to arbitrary angular momentum, distributed multipoles, and speedup with reciprocal space methods

Journal of Chemical Physics

Volumn 125, Issue 18, 2006, Pages

  Cisneros, G Andŕs ^a   Piquemal, Jean Philip ^a,b   Darden, Thomas A ^a  

^a NATIONAL INSTITUTE OF ENVIRONMENTAL HEALTH SCIENCES   (United States)

^b SORBONNE UNIVERSITÉ   (France)

Author keywords

[No Author keywords available]

Indexed keywords

CARRIER CONCENTRATION; COMPUTER SIMULATION; COULOMB BLOCKADE; FAST FOURIER TRANSFORMS; GAUSSIAN NOISE (ELECTRONIC); PROBABILITY DENSITY FUNCTION;

ARBITRARY ANGULAR MOMENTUM; FAST FOURIER-POISSON (FFP) METHODS; GAUSSIAN ELECTROSTATIC MODEL; HERMITE GAUSSIAN FUNCTIONS;

ELECTROSTATICS;

ARTICLE; CHEMICAL MODEL; ELECTRICITY; NORMAL DISTRIBUTION;

ELECTROSTATICS; MODELS, CHEMICAL; NORMAL DISTRIBUTION;

EID: 33750980661     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2363374     Document Type: Article

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