新型室温全斯勒热电材料Li2TlSb
Siqi Guo1, Jincheng Yue1, Junda Li1
1Institute of High Pressure Physics, School of Physical Science and Technology, Ningbo University, Ningbo 315211, China. liuyanhui@nbu.edu.cn.
Physical chemistry chemical physics : PCCP
|February 7, 2024
概括
研究人员开发了Li2TlSb,这是一种全新的Heusler半导体,实现了超低的导热率和1.77的高ZT值. 这种材料对高效的室温热电应用具有前景.
科学领域:
- 材料科学 材料科学 材料科学
- 固态物理 固态物理
- 热力学是一种热力学.
背景情况:
- 在全斯勒 (FH) 半导体中,高晶格导热率阻碍了优良的热电特性.
- 强大的原子间键和有序的晶体结构有助于应对这一挑战.
研究的目的:
- 提出和研究一种基于的新型FH化合物Li2TlSb,以提高热电性能.
- 使用先进的理论方法探索Li2TlSb的传输和热电特性.
主要方法:
- 使用自相一致的声子 (SCP) 理论和博尔兹曼运输方程进行计算.
- 研究了电子 - 声子散射机制.
- 从理论上分析机械性能和环境适应能力.
主要成果:
- 2TlSb具有出色的机械性能和极端环境的适应性.
- 由于Tl原子和共振结合,实现了超低的晶格导热率 (0.79 W m-1 K-1 在300 K) .
- 在p型系统中,高功率因子是由于高空间退化和轻电子分散导致的.
结论:
- 在300K时达到1.77的p型热电功率 (ZT) 的最大值,超过了传统的热电材料.
- 2TlSb是室温热电应用的有希望的候选物.
- 这项研究为设计新的FH热电材料提供了洞察力.
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