MOLECULAR-DYNAMICS INVESTIGATION OF EXPANDED WATER AT ELEVATED-TEMPERATURES

被引:108
作者
MOUNTAIN, RD
机构
关键词
D O I
10.1063/1.456028
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
收藏
页码:1866 / 1870
页数:5
相关论文
共 25 条
[1]   SOME MULTISTEP METHODS FOR USE IN MOLECULAR-DYNAMICS CALCULATIONS [J].
BEEMAN, D .
JOURNAL OF COMPUTATIONAL PHYSICS, 1976, 20 (02) :130-139
[2]   A THEORETICAL-STUDY OF THE STRUCTURE OF SHOCKED WATER [J].
CALEF, DF ;
PETTITT, BM .
CHEMICAL PHYSICS LETTERS, 1987, 139 (02) :129-133
[3]   SINGULARITY FREE ALGORITHM FOR MOLECULAR-DYNAMICS SIMULATION OF RIGID POLYATOMICS [J].
EVANS, DJ ;
MURAD, S .
MOLECULAR PHYSICS, 1977, 34 (02) :327-331
[4]  
FRANCK EU, 1967, DISCUSS FARADAY SOC, V43, P108
[5]  
Haar L., 1984, NBS NRC STEAM TABLES, P9
[6]   MOLECULAR-DYNAMICS STUDIES OF THE STRUCTURE OF WATER AT HIGH-TEMPERATURES AND DENSITY [J].
IMPEY, RW ;
KLEIN, ML ;
MCDONALD, IR .
JOURNAL OF CHEMICAL PHYSICS, 1981, 74 (01) :647-652
[7]   COMPARISON OF SIMPLE POTENTIAL FUNCTIONS FOR SIMULATING LIQUID WATER [J].
JORGENSEN, WL ;
CHANDRASEKHAR, J ;
MADURA, JD ;
IMPEY, RW ;
KLEIN, ML .
JOURNAL OF CHEMICAL PHYSICS, 1983, 79 (02) :926-935
[8]   TEMPERATURE AND SIZE DEPENDENCE FOR MONTE-CARLO SIMULATIONS OF TIP4P WATER [J].
JORGENSEN, WL ;
MADURA, JD .
MOLECULAR PHYSICS, 1985, 56 (06) :1381-1392
[10]   THE ICE WATER INTERFACE [J].
KARIM, OA ;
HAYMET, ADJ .
CHEMICAL PHYSICS LETTERS, 1987, 138 (06) :531-534