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非平衡态热力学中的约束:一般框架及其在多组分扩散中的应用。

Constraints in nonequilibrium thermodynamics: General framework and application to multicomponent diffusion.

作者信息

Ottinger Hans Christian

机构信息

Department of Materials, Polymer Physics, ETH Zurich, HCI H 543, CH-8093 Zurich, Switzerland.

出版信息

J Chem Phys. 2009 Mar 21;130(11):114904. doi: 10.1063/1.3088847.

Abstract

We elaborate how holonomic constraints can be incorporated into the general equation for the nonequilibrium reversible-irreversible coupling (GENERIC) framework of nonequilibrium thermodynamics. Dirac's ideas for constructing constrained Poisson brackets are extended to dissipative brackets. The construction is presented such that it can be put into practice most readily. We illustrate the procedure by developing a symmetric thermodynamic description of diffusion in multicomponent systems and, as a further example, we impose an incompressibility constraint. As a consequence of its more elaborate and restrictive structure, GENERIC removes the ambiguities occurring in the classical thermodynamics of irreversible processes when one works with redundant variables.

摘要

我们阐述了如何将完整约束纳入非平衡热力学的非平衡可逆-不可逆耦合(GENERIC)框架的一般方程中。狄拉克构建约束泊松括号的思想被扩展到耗散括号。所给出的构建方式使其能最容易地付诸实践。我们通过给出多组分系统中扩散的对称热力学描述来说明该过程,并且,作为进一步的例子,我们施加了不可压缩性约束。由于其结构更为精细和严格,当使用冗余变量时,GENERIC消除了不可逆过程经典热力学中出现的模糊性。

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