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Unusual electronic and vibrational properties in the colossal thermopower material FeSb2

机译:巨大的热电材料FeSb2中异常的电子和振动特性

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摘要

The iron antimonide FeSb2 possesses an extraordinarily high thermoelectric power factor at low temperature, making it a leading candidate for cryogenic thermoelectric cooling devices. However, the origin of this unusual behavior is controversial, having been variously attributed to electronic correlations as well as the phonon-drag effect. The optical properties of a material provide information on both the electronic and vibrational properties. The optical conductivity reveals an anisotropic response at room temperature; the low-frequency optical conductivity decreases rapidly with temperature, signalling a metal-insulator transition. One-dimensional semiconducting behavior is observed along the b axis at low temperature, in agreement with first-principle calculations. The infrared-active lattice vibrations are also symmetric and extremely narrow, indicating long phonon relaxation times and a lack of electron-phonon coupling. Surprisingly, there are more lattice modes along the a axis than are predicted from group theory; several of these modes undergo significant changes below about 100 K, hinting at a weak structural distortion or phase transition. While the extremely narrow phonon line shapes favor the phonon-drag effect, the one-dimensional behavior of this system at low temperature may also contribute to the extraordinarily high thermopower observed in this material.
机译:锑铁FeSb2在低温下具有异常高的热电功率因数,使其成为低温热电冷却装置的主要候选材料。然而,这种不正常行为的起源是有争议的,已被不同程度地归因于电子相关以及声子拖曳效应。材料的光学特性可提供有关电子特性和振动特性的信息。光电导率在室温下显示出各向异性响应;低频光导率随温度迅速降低,表明金属-绝缘体转变。与第一性原理计算一致,在低温下沿b轴观察到一维半导体行为。红外活性晶格振动也对称且极窄,这表明声子弛豫时间长且缺乏电子-声子耦合。出乎意料的是,沿着a轴的晶格模式比从群论预测的要多。这些模式中的几种在低于100 K时会发生显着变化,暗示结构变形或相变较弱。尽管极窄的声子线形有利于声子拖曳效应,但该系统在低温下的一维行为也可能有助于在这种材料中观察到非常高的热功率。

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