A chemical potential equalization model for treating polarization in molecular mechanical force fields

Molecular Physics

Volumn 98, Issue 11, 2000, Pages 751-763

  Bret, Céline ^a   Field, Martin J ^a   Hemmingsen, Lars ^b  

^a INSTITUT DE BIOLOGIE STRUCTURALE   (France)

^b UNIVERSITY OF COPENHAGEN   (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; CHARGE CARRIERS; CHLORINE; COMPUTER SIMULATION; ELECTRON ENERGY LEVELS; MATHEMATICAL MODELS; METHANE; MOLECULES; NEGATIVE IONS; NUMERICAL ANALYSIS; POLARIZATION; WATER;

CHARGE DISTRIBUTION; CHEMICAL POTENTIAL EQUALIZATION; ELECTRONEGATIVITY; MOLECULAR MECHANICAL FORCE FIELDS; MOLECULAR SIMULATION;

MOLECULAR PHYSICS;

EID: 0034630796     PISSN: 00268976     EISSN: None     Source Type: Journal    
DOI: 10.1080/002689700162108     Document Type: Article

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