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分子膜厚度对跨固体膜界面热传导的影响。

Effect of molecular film thickness on thermal conduction across solid-film interfaces.

作者信息

Liang Zhi, Tsai Hai-Lung

机构信息

Department of Mechanical and Aerospace Engineering, Missouri University of Science and Technology, Rolla, Missouri 65409, USA.

出版信息

Phys Rev E Stat Nonlin Soft Matter Phys. 2011 Jun;83(6 Pt 1):061603. doi: 10.1103/PhysRevE.83.061603. Epub 2011 Jun 10.

Abstract

The Brownian motion and aggregation of particles in nanofluids often lead to the formation of solid-film-solid structures. The molecular thin film confined between nanoparticles may have non-negligible effects on thermal conduction among nanoparticles. Using nonequilibrium molecular dynamics simulations, we study thermal conduction across the Ag particle-Ar thin-film interface. If the film contains only one molecular layer, we find that the solid-film interfacial thermal resistance R(SF) is about 1 order of magnitude smaller than the solid-liquid (bulk) interfacial thermal resistance R(SL). If there are two or more molecular layers in the film, it is shown that R(SF) increases rapidly toward R(SL) as film thickness increases. By comparing the vibrational density of states of Ag atoms and Ar molecules in the film, we demonstrate that the low thermal resistance in the monolayer film case is caused by the resonant thermal transport between Ag particles and Ar thin films.

摘要

纳米流体中颗粒的布朗运动和聚集常常导致固膜-固结构的形成。限制在纳米颗粒之间的分子薄膜可能对纳米颗粒之间的热传导产生不可忽略的影响。利用非平衡分子动力学模拟,我们研究了跨越银颗粒-氩薄膜界面的热传导。如果薄膜仅包含一个分子层,我们发现固膜界面热阻R(SF)比固液(体相)界面热阻R(SL)小约1个数量级。如果薄膜中有两个或更多分子层,结果表明随着薄膜厚度增加,R(SF)迅速向R(SL)增大。通过比较薄膜中银原子和氩分子的振动态密度,我们证明了单层薄膜情况下的低热阻是由银颗粒和氩薄膜之间的共振热输运引起的。

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