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p型CuMnInTe(x = 0, 0.2, 0.3)的合成、输运性质及电子结构

Synthesis, transport properties and electronic structure of p-type CuMnInTe (x = 0, 0.2, 0.3).

作者信息

Hobbis Dean, Shi Wencong, Popescu Adrian, Wei Kaya, Baumbach Ryan E, Wang Hsin, Woods Lilia M, Nolas George S

机构信息

Department of Physics, University of South Florida, Tampa, FL 33620, USA.

出版信息

Dalton Trans. 2020 Feb 21;49(7):2273-2279. doi: 10.1039/c9dt04069b. Epub 2020 Feb 4.

Abstract

The synthesis, electronic structure and temperature dependent transport properties of polycrystalline CuMnInTe (x = 0, 0.2, 0.3) are reported for the first time. These quaternary chalcogenides were synthesized by direct reaction of the elements, followed by solid state annealing and hot press densification. The thermal conductivity is low for all specimens and intrinsic to the material system. Furthermore, the off-stoichiometry specimens illustrate the sensitivity of the transport properties to stoichiometry, with a greater than two-orders-of magnitude increase in carrier concentration with increased Cu content. First principles calculations of the electronic structure are also reported, and are in agreement with the experimental data. This fundamental investigation shows the potential towards further optimization of the electrical properties that, in addition to the intrinsically low thermal conductivity, provides a basis for further research into the viability of this material system for potential energy-related applications.

摘要

首次报道了多晶CuMnInTe(x = 0, 0.2, 0.3)的合成、电子结构及与温度相关的输运性质。这些四元硫族化合物通过元素直接反应合成,随后进行固态退火和热压致密化处理。所有样品的热导率都很低,这是材料体系所固有的。此外,非化学计量比样品表明输运性质对化学计量比很敏感,随着铜含量的增加,载流子浓度增加了两个多数量级。还报道了电子结构的第一性原理计算结果,其与实验数据相符。这项基础研究表明了进一步优化电学性质的潜力,除了其固有的低热导率外,还为进一步研究该材料体系在潜在能源相关应用中的可行性提供了基础。

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