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离子液体混合物电导率的晶格空洞理论:在离子液体+水混合物中的应用。

A lattice-hole theory for conductivity in ionic liquid mixtures: application to ionic liquid + water mixtures.

机构信息

School of Physical Environmental and Mathematical Sciences, University College, University of NSW, Australian Defence Force Academy, ACT 2600, Canberra, Australia.

出版信息

Phys Chem Chem Phys. 2010 Feb 7;12(5):1172-6. doi: 10.1039/b919835k. Epub 2009 Dec 10.

Abstract

We derive a new expression for the conductivity of ionic liquid-solvent mixtures. The underlying theory is based on a lattice-hole model, which incorporates the concept of site availability in order to model decreasing mobility in the mixture, as the ionic liquid concentration increases. We compare with aqueous ionic liquid mixtures, as water is a solvent which best fulfills the approximations inherent in our theory. The conductivity expression is couched in terms of a single-fitting parameter and is able to reproduce a range of conductivity data with good accuracy.

摘要

我们推导出了一个新的离子液体-溶剂混合物电导率表达式。该理论基于晶格空洞模型,其中包含了位阻可用性的概念,以便在离子液体浓度增加时,对混合物中迁移率降低进行建模。我们将其与水合离子液体混合物进行了比较,因为水是一种最能满足我们理论内在近似的溶剂。电导率表达式采用单个拟合参数,能够以较高的精度再现一系列电导率数据。

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