§Electrical and Computer Engineering Department, University of Massachusetts Amherst, Amherst, Massachusetts 01003, United States.
∥Department of Civil and Material Engineering, University of Illinois at Chicago, Chicago, Illinois 60607, United States.
Nano Lett. 2015 Jul 8;15(7):4532-40. doi: 10.1021/acs.nanolett.5b01100. Epub 2015 Jun 8.
Graphene has served as the model 2D system for over a decade, and the effects of grain boundaries (GBs) on its electrical and mechanical properties are very well investigated. However, no direct measurement of the correlation between thermal transport and graphene GBs has been reported. Here, we report a simultaneous comparison of thermal transport in supported single crystalline graphene to thermal transport across an individual graphene GB. Our experiments show that thermal conductance (per unit area) through an isolated GB can be up to an order of magnitude lower than the theoretically anticipated values. Our measurements are supported by Boltzmann transport modeling which uncovers a new bimodal phonon scattering phenomenon initiated by the GB structure. In this novel scattering mechanism, boundary roughness scattering dominates the phonon transport in low-mismatch GBs, while for higher mismatch angles there is an additional resistance caused by the formation of a disordered region at the GB. Nonequilibrium molecular dynamics simulations verify that the amount of disorder in the GB region is the determining factor in impeding thermal transport across GBs.
石墨烯作为二维系统模型已经有十多年了,其晶界(GB)对其电学和力学性能的影响已经得到了很好的研究。然而,尚未有关于热传输与石墨烯晶界之间相关性的直接测量报道。在这里,我们报告了在支撑的单晶石墨烯中热传输与穿过单个石墨烯晶界的热传输的同时比较。我们的实验表明,通过单个晶界的热导率(单位面积)可以低至理论预期值的一个数量级。我们的测量结果得到了玻尔兹曼输运模型的支持,该模型揭示了由晶界结构引发的新的双模态声子散射现象。在这种新的散射机制中,边界粗糙度散射在低失配晶界中主导声子输运,而对于更高的失配角度,由于在晶界处形成无序区域,会产生额外的阻力。非平衡分子动力学模拟验证了晶界区域的无序程度是阻碍晶界热传输的决定因素。