ENERGETICS, VIBRATIONS AND THERMODYNAMICS OF (H2O)2(G) REVISED - MCY VERSUS MCY-B POTENTIAL

被引：40

作者：

SLANINA, Z

机构：

来源：

CHEMICAL PHYSICS LETTERS | 1986年 / 127卷 / 01期

关键词：

D O I：

10.1016/S0009-2614(86)80210-X

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：67 / 72

页数：6

共 56 条

[1] LOW-FREQUENCY MOTIONS OF WATER ISOLATED IN LOW-TEMPERATURE MATRICES [J].

BEHRENSGRIESENBACH, A ;

LUCK, WAP .

JOURNAL OF MOLECULAR STRUCTURE, 1982, 80 (1-4) :471-476

[2]

BEYER A, 1984, TOP CURR CHEM, V120, P1

[3] SEMIEMPIRICAL DETERMINATION OF HYDROGEN BOND ENERGY FOR WATER CLUSTERS IN VAPOR PHASE .I. GENERAL THEORY AND APPLICATION TO DIMER [J].

BOLANDER, RW ;

KASSNER, JL ;

ZUNG, JT .

JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (10) :4402-&

[4] AN IMPROVED POTENTIAL FOR NON-RIGID WATER-MOLECULES IN THE LIQUID-PHASE [J].

BOPP, P ;

JANCSO, G ;

HEINZINGER, K .

CHEMICAL PHYSICS LETTERS, 1983, 98 (02) :129-133

[5] A MOLECULAR-DYNAMICS STUDY OF THE STRUCTURE OF AN LICL.4H2O SOLUTION [J].

BOPP, P ;

OKADA, I ;

OHTAKI, H ;

HEINZINGER, K .

ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES, 1985, 40 (02) :116-125

[6] ON THE MCY POTENTIAL FOR LIQUID WATER [J].

BOUNDS, DG .

CHEMICAL PHYSICS LETTERS, 1983, 96 (05) :604-606

[7] ROTATION AND VIBRATION-SPECTRA FOR H2O DIMER - THEORY AND COMPARISON WITH EXPERIMENTAL-DATA [J].

BRAUN, C ;

LEIDECKER, H .

JOURNAL OF CHEMICAL PHYSICS, 1974, 61 (08) :3104-3113

[8] WATER WATER INTERACTION POTENTIAL - AN APPROXIMATION OF THE ELECTRON CORRELATION CONTRIBUTION BY A FUNCTIONAL OF THE SCF DENSITY-MATRIX [J].

CARRAVETTA, V ;

CLEMENTI, E .

JOURNAL OF CHEMICAL PHYSICS, 1984, 81 (06) :2646-2651

[9] THERMODYNAMIC PROPERTIES OF WATER DIMER [J].

CHAO, J ;

WILHOIT, RC ;

ZWOLINSK.BJ .

JOURNAL OF CHEMICAL THERMODYNAMICS, 1971, 3 (02) :195-+

[10] A NEW 2-BODY WATER WATER POTENTIAL [J].

CLEMENTI, E ;

HABITZ, P .

JOURNAL OF PHYSICAL CHEMISTRY, 1983, 87 (15) :2815-2820

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