TEMPERATURE AND SIZE DEPENDENCE FOR MONTE-CARLO SIMULATIONS OF TIP4P WATER

被引:760
作者
JORGENSEN, WL
MADURA, JD
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D O I
10.1080/00268978500103111
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 ;
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页码:1381 / 1392
页数:12
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[1]   THE ROLE OF LONG RANGED FORCES IN DETERMINING THE STRUCTURE AND PROPERTIES OF LIQUID WATER [J].
ANDREA, TA ;
SWOPE, WC ;
ANDERSEN, HC .
JOURNAL OF CHEMICAL PHYSICS, 1983, 79 (09) :4576-4584
[2]   HEAT-CAPACITY OF WATER AT EXTREMES OF SUPERCOOLING AND SUPERHEATING [J].
ANGELL, CA ;
OGUNI, M ;
SICHINA, WJ .
JOURNAL OF PHYSICAL CHEMISTRY, 1982, 86 (06) :998-1002
[3]  
Beveridge DL, 1983, ACS AM CHEM SOC ADV, V204, P297
[4]  
CLEMENTI E, 1983, INT J QUANTUM CHEM S, V10, P31
[5]  
DORSEY NE, 1940, PROPERTIES ORDINARY, P258
[6]  
EISENBERG D, 1969, STRUCTURES PROPERTIE
[7]  
Gellatly B.J., 1983, MOL PHYS, V59, P949
[8]  
HAGLER AT, 1985, PEPTIDES
[9]   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