Improvement of semiempirical response properties with charge-dependent response density

Journal of Chemical Physics

Volumn 123, Issue 16, 2005, Pages

  Giese, Timothy J ^a   York, Darrin M ^a  

^a University of Minnesota   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHARGE-DEPENDENT POLARIZABILITY; MOLECULAR MECHANICAL SIMULATIONS; POLARIZABILITY ERRORS; QUANTUM MODELS;

CHARGE TRANSFER; COMPUTER SIMULATION; DYNAMIC RESPONSE; HAMILTONIANS; MATHEMATICAL MODELS; MOLECULAR STRUCTURE;

POLARIZATION;

ANION; CATION; ION; SODIUM; WATER;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; METHODOLOGY; PHYSICAL CHEMISTRY; QUANTUM THEORY; STATISTICAL MODEL; THEORETICAL MODEL;

ANIONS; CATIONS; CHEMISTRY, PHYSICAL; IONS; MODELS, STATISTICAL; MODELS, THEORETICAL; MOLECULAR CONFORMATION; MOLECULAR STRUCTURE; QUANTUM THEORY; SODIUM; WATER;

EID: 33747593804     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2080007     Document Type: Article

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