SOLVATION OF MULTIPLY CHARGED IONS - PREDICTIONS USING THE REFERENCE INTERACTION SITE METHOD WITH HYPERNETTED CHAIN CLOSURE

被引：22

作者：

KUHARSKI, RA ^{[1
]}

CHANDLER, D ^{[1
]}

机构：

[1] UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720

来源：

JOURNAL OF PHYSICAL CHEMISTRY | 1987年 / 91卷 / 11期

关键词：

D O I：

10.1021/j100295a066

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

页码：2978 / 2981

页数：4

共 23 条

[1]

Berendsen HJC, 1981, INTERMOLECULAR FORCE, P331, DOI DOI 10.1007/978-94-015-7658-1_21

[2] OPTIMIZED CLUSTER EXPANSIONS FOR CLASSICAL FLUIDS .2. THEORY OF MOLECULAR LIQUIDS [J].

CHANDLER, D ;

ANDERSEN, HC .

JOURNAL OF CHEMICAL PHYSICS, 1972, 57 (05) :1930-+

[3] DENSITY FUNCTIONAL THEORY OF NONUNIFORM POLYATOMIC SYSTEMS .2. RATIONAL CLOSURES FOR INTEGRAL-EQUATIONS [J].

CHANDLER, D ;

MCCOY, JD ;

SINGER, SJ .

JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (10) :5977-5982

[4] DENSITY FUNCTIONAL THEORY OF NONUNIFORM POLYATOMIC SYSTEMS .1. GENERAL FORMULATION [J].

CHANDLER, D ;

MCCOY, JD ;

SINGER, SJ .

JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (10) :5971-5976

[5]

CHANDLER D, 1982, LIQUID STATE MATTER

[6] SN2 REACTION PROFILES IN THE GAS-PHASE AND AQUEOUS-SOLUTION [J].

CHANDRASEKHAR, J ;

SMITH, SF ;

JORGENSEN, WL .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1984, 106 (10) :3049-3050

[7] EVALUATION OF REACTION FREE-ENERGY SURFACES IN AQUEOUS-SOLUTION - AN INTEGRAL-EQUATION APPROACH [J].

CHILES, RA ;

ROSSKY, PJ .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1984, 106 (22) :6867-6868

[8] AUXILIARY SITES IN THE RISM APPROXIMATION FOR MOLECULAR FLUIDS [J].

CUMMINGS, PT ;

GRAY, CG ;

SULLIVAN, DE .

JOURNAL OF PHYSICS A-MATHEMATICAL AND GENERAL, 1981, 14 (06) :1483-1512

[9] NEW METHOD OF SOLVING THE LIQUID STRUCTURE INTEGRAL-EQUATIONS [J].

GILLAN, MJ .

MOLECULAR PHYSICS, 1979, 38 (06) :1781-1794

[10] AN EXTENDED RISM EQUATION FOR MOLECULAR POLAR FLUIDS [J].

HIRATA, F ;

ROSSKY, PJ .

CHEMICAL PHYSICS LETTERS, 1981, 83 (02) :329-334

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