The boundary fluctuation theory of transport coefficients in the linear-response limit

被引:21
|
作者
Petravic, J [1 ]
Harrowell, P [1 ]
机构
[1] Univ Sydney, Sch Chem, Sydney, NSW 2006, Australia
来源
JOURNAL OF CHEMICAL PHYSICS | 2006年 / 124卷 / 01期
基金
澳大利亚研究理事会;
关键词
D O I
10.1063/1.2140274
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
In this paper we present, for the first time, a linear-response theory of transport coefficients-shear viscosity and thermal conductivity-involving thermal, as opposed to mechanical, fields. The theory involves the explicit treatment of the boundaries and the constraints that are applied to them. Expressions for the shear viscosity and thermal conductivity are obtained in terms of the fluctuations at the boundaries of the variable conjugate to that which is constrained. We explain how the choice of ensemble, as defined by the boundary constraints, determines the form in which the transport coefficients are evaluated. (c) 2006 American Institute of Physics.
引用
收藏
页数:6
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