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硅纳米晶结构中声子传播的终极限制。

Ultimate Confinement of Phonon Propagation in Silicon Nanocrystalline Structure.

机构信息

Department of Mechanical Engineering, The University of Tokyo, 7-3-1 Hongo, Bunkyo, Tokyo 113-8656, Japan.

Graduate School of Engineering Science, Osaka University, 1-3 Machikaneyama, Toyonaka, Osaka 560-8531, Japan.

出版信息

Phys Rev Lett. 2018 Jan 26;120(4):045901. doi: 10.1103/PhysRevLett.120.045901.

Abstract

Temperature-dependent thermal conductivity of epitaxial silicon nanocrystalline (SiNC) structures composed of nanometer-sized grains separated by ultrathin silicon-oxide (SiO_{2}) films (∼0.3  nm) is measured by the time domain thermoreflectance technique in the range from 50 to 300 K. The thermal conductivity of SiNC structures with a grain size of 3 and 5 nm is anomalously low at the entire temperature range, significantly below the values of bulk amorphous Si and SiO_{2}. The phonon gas kinetic model, with intrinsic transport properties obtained by first-principles-based anharmonic lattice dynamics and phonon transmittance across ultrathin SiO_{2} films obtained by atomistic Green's function, reproduces the measured thermal conductivity without any fitting parameters. The analysis reveals that mean free paths of acoustic phonons in the SiNC structures are equivalent or even below half the phonon wavelength, i.e., the minimum thermal conductivity scenario. The result demonstrates that the nanostructures with extremely small length scales and a controlled interface can give rise to ultimate classical confinement of thermal phonon propagation.

摘要

采用时域热反射技术,在 50 至 300 K 的温度范围内,测量了由纳米级晶粒组成的外延硅纳米晶(SiNC)结构的热导率,这些晶粒由超薄的氧化硅(SiO_{2})薄膜(约 0.3 nm)隔开。晶粒尺寸为 3 和 5 nm 的 SiNC 结构的热导率在整个温度范围内均异常低,明显低于非晶硅和 SiO_{2}的体值。基于第一性原理的非谐晶格动力学获得的本征输运性质和原子格林函数获得的超薄 SiO_{2}薄膜的声子透射率的声子气体动力学模型,在没有任何拟合参数的情况下再现了测量的热导率。分析表明,SiNC 结构中声学声子的平均自由程与声子波长相等甚至更短,即达到了最小热导率的情况。该结果表明,具有极小长度尺度和受控界面的纳米结构可以导致热声子传播的最终经典限制。

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