THE VISCOSITY OF SPC AND SPC/E WATER AT 277-K AND 300-K

被引：175

作者：

SMITH, PE

VANGUNSTEREN, WF

机构：

[1] Department of Physical Chemistry, Swiss Federal Institute of Technology Zürich, ETH-Zentrum

来源：

CHEMICAL PHYSICS LETTERS | 1993年 / 215卷 / 04期

关键词：

D O I：

10.1016/0009-2614(93)85720-9

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：

The shear viscosity of the SPC and SPC/E water models at 277 and 300 K has been determined using equilibrium molecular dynamics. Good agreement with experiment was obtained for the SPC/E model at both temperatures. The viscosity of the SPC model was lower than the experimental value at both temperatures and displayed only a small temperature dependence. The effect of using a reaction field treatment for the long-range electrostatic interaction was also investigated and found to be negligible.

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页码：315 / 318

页数：4

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