STUDIES IN HYDROGEN-BONDING - SIMULATION OF THE CRYSTALLINE SOLIDS OF ICE, AMMONIA, AND AMMONIA HYDRATE

被引：3

作者：

BRINK, G

GLASSER, L

机构：

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1987年 / 160卷 / 3-4期

关键词：

D O I：

10.1016/0022-2860(87)80076-5

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：357 / 364

页数：8

共 38 条

[1]

BRINK G, 1981, J COMPUT CHEM, V2, P177, DOI 10.1002/jcc.540020207

[2] STUDIES IN HYDROGEN-BONDING - ASSOCIATION IN METHANOL USING AN EMPIRICAL POTENTIAL [J].

BRINK, G ;

GLASSER, L .

JOURNAL OF COMPUTATIONAL CHEMISTRY, 1981, 2 (01) :14-19

[3] STUDIES IN HYDROGEN-BONDING - ASSOCIATION WITHIN MIXED DIMERS OF WATER, METHANOL, AMMONIA, AND METHYLAMINE USING THE EMPIRICAL POTENTIAL EPEN [J].

BRINK, G ;

GLASSER, L .

JOURNAL OF COMPUTATIONAL CHEMISTRY, 1982, 3 (01) :47-52

[4]

BRINK G, 1981, S AFR J CHEM, V34, P18

[5]

BRINK G, 1981, J MOL STRUCT, V85, P317

[6] NEW APPROACH TO EMPIRICAL INTERMOLECULAR AND CONFORMATIONAL POTENTIAL-ENERGY FUNCTIONS .3. APPLICATION OF EPEN TO CONFORMATIONAL-ANALYSIS OF 1,2-DISUBSTITUTED ETHANES [J].

BURGESS, AW ;

SHIPMAN, LL ;

NEMENOFF, RA ;

SCHERAGA, HA .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1976, 98 (01) :23-29

[7]

Busing W.R., 1981, ORNL5747

[8] NONADDITIVITY OF INTERACTION IN WATER TRIMERS [J].

CLEMENTI, E ;

KOLOS, W ;

LIE, GC ;

RANGHINO, G .

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1980, 17 (03) :377-398

[9]

Clementi E., 1976, DETERMINATION LIQUID, P2

[10] COMPUTER-SIMULATION OF HEXAGONAL ICE [J].

COTA, E ;

HOOVER, WG .

JOURNAL OF CHEMICAL PHYSICS, 1977, 67 (08) :3839-3840

← 1 2 3 4 →