A geometric model for cold water and liquid-liquid transitions

被引:13
作者
Guisoni, N [1 ]
Henriques, VB [1 ]
机构
[1] Univ Sao Paulo, Inst Fis, BR-05315970 Sao Paulo, Brazil
关键词
D O I
10.1063/1.1395565
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
Water is an associated liquid in which the main intermolecular interaction is the hydrogen bond (HB) which is limited to four per atom, independently of the number of neighbors. We have considered a hydrogen bond net superposed on Bernal's geometric model for liquids, which allows for different local environments for the liquid particles. In this study, a mean-field treatment of the two-dimensional version of the model is discussed. Under pressure the model exhibits three phases of different densities and a coexistence line ending in a critical point between low and high density phases. Entropy of the HB network plays an essential role in defining the slope of the coexistence line. The model behavior might be of interest in describing supercooled water and liquid-liquid transitions of other substances. (C) 2001 American Institute of Physics.
引用
收藏
页码:5238 / 5243
页数:6
相关论文
共 56 条
[1]   DENSITY-DRIVEN LIQUID-LIQUID PHASE-SEPARATION IN THE SYSTEM AL2O3-Y2O3 [J].
AASLAND, S ;
MCMILLAN, PF .
NATURE, 1994, 369 (6482) :633-636
[2]   SUPERCOOLED WATER [J].
ANGELL, CA .
ANNUAL REVIEW OF PHYSICAL CHEMISTRY, 1983, 34 :593-630
[3]   Is there a liquid-liquid phase transition in supercooled water? [J].
Bellissent-Funel, MC .
EUROPHYSICS LETTERS, 1998, 42 (02) :161-166
[4]   A NEUTRON-SCATTERING STUDY OF LIQUID D2O UNDER PRESSURE AND AT VARIOUS TEMPERATURE [J].
BELLISSENTFUNEL, MC ;
BOSIO, L .
JOURNAL OF CHEMICAL PHYSICS, 1995, 102 (09) :3727-3735
[5]   GEOMETRICAL APPROACH TO THE STRUCTURE OF LIQUIDS [J].
BERNAL, JD .
NATURE, 1959, 183 (4655) :141-147
[6]   GEOMETRY OF THE STRUCTURE OF MONATOMIC LIQUIDS [J].
BERNAL, JD .
NATURE, 1960, 185 (4706) :68-70
[7]   CONNECTIVITY OF HYDROGEN-BONDS IN LIQUID WATER [J].
BLUMBERG, RL ;
STANLEY, HE ;
GEIGER, A ;
MAUSBACH, P .
JOURNAL OF CHEMICAL PHYSICS, 1984, 80 (10) :5230-5241
[8]   EMPIRICAL POTENTIAL FOR HYDROCARBONS FOR USE IN SIMULATING THE CHEMICAL VAPOR-DEPOSITION OF DIAMOND FILMS [J].
BRENNER, DW .
PHYSICAL REVIEW B, 1990, 42 (15) :9458-9471
[9]   DIRECT CONVERSION OF GRAPHITE TO DIAMOND IN STATIC PRESSURE APPARATUS [J].
BUNDY, FP .
JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (03) :631-&
[10]   DIAMOND-GRAPHITE EQUILIBRIUM LINE FROM GROWTH AND GRAPHITIZATION OF DIAMOND [J].
BUNDY, FP ;
STRONG, HM ;
BOVENKERK, HP ;
WENTORF, RH .
JOURNAL OF CHEMICAL PHYSICS, 1961, 35 (02) :383-&