在高压下,软声模式导致基于Ag的石英石的导热率被抑制
Kunpeng Yuan1, Xiaoliang Zhang2, Yufei Gao2
1College of New Energy, China University of Petroleum (East China), Qingdao 266580, China.
Physical chemistry chemical physics : PCCP
|September 8, 2023
概括
施加压力显著降低了基于银的石英石的导热率. 这种由独特的结合和声子行为驱动的效应,提供了一种调整热电材料的新方法.
科学领域:
- 凝聚物质物理学 凝聚物质物理学
- 材料科学 材料科学 材料科学
- 热电学是一种热电学.
背景情况:
- 了解压力对材料性能的影响对于设计先进材料至关重要.
- 热电材料有效地将热转化为电力,但它们的性能通常受到热传输的限制.
研究的目的:
- 研究压力对AgXY2 (X = Al,Ga,In;Y = S,Se,Te) 热电材料的晶格导热率的影响.
- 阐明了压力诱导的热传输变化的潜在物理机制.
主要方法:
- 第一个原则计算计算.
- 波顿·博尔兹曼运输理论
主要成果:
- 在压力下,基于Ag的石墨矿的晶格导热率被大大抑制.
- 由非定位电子和软声子特征的元价联结被确定为一个关键因素.
- 增加的压力增强了声无和性和声光声联,导致了更大的声散射.
结论:
- 压力有效调整了基于Ag的石灰岩的热传输特性.
- 这些发现提供了关于高压下异常热传输的见解.
- 这项工作开辟了通过压力应用优化基于Ag的热电学的途径.
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