首页> 外文期刊>The journal of physical chemistry, C. Nanomaterials and interfaces >Test of Universal Scaling Law for Molecular Diffusion of Liquids in Bulk and Nanotube Confinement
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Test of Universal Scaling Law for Molecular Diffusion of Liquids in Bulk and Nanotube Confinement

机译:散装液体分子扩散的通用缩放法检测

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摘要

The task of observing and understanding the relationship between transport and thermodynamic properties of atomic and molecular fluids has been a continuing open problem in condensed matter. The problem becomes more complex and challenging when the fluids are confined in nanoscale dimensions. In order to address this complex problem, a scaling law has been established by linking the molecular diffusivity and excess entropy of molecular liquids and liquid mixtures both in bulk and under nanoconfinement, which is found to be quite universal and also reproduces the earlier scaling law for atomic diffusion [Nature (London) 1996, 381, 137]. The excess entropy, which is central to this universal scaling law, has been estimated using a robust and very fast "two phase thermodynamic" (2PT) method, where density of states (DOS) has been employed, which may also be obtained from power spectrum of diffusing liquids using scattering experiments thus offers an indirect route to determine the molecular diffusivity. The present scaling law would contribute to the deeper understanding of molecular transport in bulk and through CNTs, which might be very supportive for various related fields of liquid filtration, biological applications, and nanotechnologies.
机译:观察和了解运输和原子和分子的流体热力学性质之间的关系的任务一直是凝聚态一个持续开放的问题。这个问题变得更加复杂,当流体在纳米尺度被限制挑战。为了解决这个复杂的问题,一个标度律已被连接的分子扩散和分子液体和无论是在体积和下nanoconfinement,被发现液体混合物过剩熵是相当普遍建立,也再现了早期的标度律为原子扩散[自然(伦敦)1996年,381,137]。过量的熵,这是中央这种普遍比例定律,已经使用一个强大的和非常快速的“两分相的热力学”(二点)的方法,其中状态(DOS)的密度已经采用,这也可以从电源获得的估计使用漫射散射实验液体的光谱从而提供了一个间接路线,以确定分子扩散率。本标度律,将有助于在体积和通过碳纳米管分子运输,这可能是液体过滤的各个相关领域,生物应用,和纳米技术非常支持的更深层次的理解。

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