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六方贵金属中的异常各向同性电子输运与弱电子-声子相互作用

Anomalously Isotropic Electron Transport and Weak Electron-Phonon Interactions in Hexagonal Noble Metals.

作者信息

Li Shouhang, Tong Zhen, Shao Cheng, Bao Hua, Frauenheim Thomas, Liu Xiangjun

机构信息

Institute of Micro/Nano Electromechanical System, College of Mechanical Engineering, Donghua University, Shanghai 201620, China.

Shenzhen JL Computational Science and Applied Research Institute, Shenzhen 518131, China.

出版信息

J Phys Chem Lett. 2022 May 19;13(19):4289-4296. doi: 10.1021/acs.jpclett.2c00425. Epub 2022 May 9.

Abstract

The electrical transport properties of typical hexagonal metals are anisotropic because of their anisotropic lattice structures. Unexpectedly, we show that the electron transport properties in hexagonal close-packed () noble metals are almost isotropic. Although the electron transport properties of an individual electronic band are highly anisotropic, the total contributions are almost equal in different crystalline orientations because of the complementary contributions of different bands. The electron transport is severely limited by phonons for metals with multisheet Fermi surfaces and optical phonon polarizations. However, it is found the electron-phonon interactions are weak in noble metals, although their Fermi surfaces and phonon spectra are complicated. The electronic structure acts as a phonon filter, resulting in small electron-phonon scattering rates. The weak electron-phonon interactions are beneficial to electron and thermal transport, indicating noble metals have great potential to be used in electronics and solar cells.

摘要

典型的六角形金属因其各向异性的晶格结构而具有各向异性的电输运性质。出乎意料的是,我们发现六方密排(hcp)贵金属中的电子输运性质几乎是各向同性的。尽管单个电子能带的电子输运性质高度各向异性,但由于不同能带的互补贡献,不同晶体取向的总贡献几乎相等。对于具有多片费米面和光学声子极化的金属,电子输运受到声子的严重限制。然而,发现hcp贵金属中的电子 - 声子相互作用较弱,尽管它们的费米面和声子谱很复杂。电子结构起到声子滤波器的作用,导致小的电子 - 声子散射率。弱的电子 - 声子相互作用有利于电子和热输运,表明hcp贵金属在电子学和太阳能电池中有很大的应用潜力。

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