Application of efficient algorithm for solving six-dimensional molecular Ornstein-Zernike equation

Journal of Chemical Physics

Volumn 136, Issue 11, 2012, Pages

  Ishizuka, R ^a   Yoshida, N ^b  

^a University of Texas Medical Branch School of Medicine   (United States)

^b KYUSHU UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

CORRELATION FUNCTION; DIRECT INVERSION; EFFICIENT ALGORITHM; EXCESS CHEMICAL POTENTIALS; INITIAL GUESS; INTEGRAL-EQUATION THEORY; NUMBER OF GRIDS; ORNSTEIN-ZERNIKE EQUATIONS; REFERENCE INTERACTION SITE MODELS;

MOLECULAR ORIENTATION;

ALGORITHMS;

ION; WATER;

ALGORITHM; ARTICLE; CHEMISTRY; MOLECULAR DYNAMICS; SOLUBILITY;

ALGORITHMS; IONS; MOLECULAR DYNAMICS SIMULATION; SOLUBILITY; WATER;

EID: 84859233363     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3693623     Document Type: Article

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