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3-X Structural Model and Common Characteristics of Anomalous Thermal Transport: The Case of Two-Dimensional Boron Carbides

  • 发布时间:2022-07-18
  • 点击次数:

  • 影响因子:6.888
  • DOI码:10.1021/acs.jpclett.1c03248
  • 所属单位:中国矿业大学
  • 教研室:材料与物理学院
  • 发表刊物:The Journal of Physical Chemistry Letters
  • 刊物所在地:美国
  • 项目来源:国家自然科学基金
  • 关键字:Anharmonicity; 3-X structural model; 2D BN
  • 摘要:Improving the reliability of electronic devices requires effective heat management, and the key is the relationship between the thermal transport and temperature. Inspired by synthesized T-carbon and H-boron, the 3-X structural models are proposed to unify the two-dimensional (2D) multitriangle materials. Employing structural searches, we identify the stability of the 3-X configuration in 2D boron carbides as 3-9 BC3 monolayer, which, unexpectedly, exhibits a linear thermal conductivity versus temperature, not the traditional ∼1/T trend. We summarize the common characteristics and explore why this behavior is absent in 3-9 AlC3 and graphene via investigating the optical modes. We show that the linear behavior is a direct consequence of the special oscillation modes by the 3-X model associated with the largest group velocity. We find that 2D materials with such behavior usually share a relatively low thermal conductivity. Our work paves the way to deeply understand the lattice thermal transport and to widen nanoelectronic applications.
  • 备注:Hanpu Liang, Hongzhen Zhong, Sheng Huang, and Yifeng Duan*
  • 论文类型:期刊论文
  • 学科门类:理学
  • 一级学科:物理学
  • 卷号:12
  • 期号:45
  • 页面范围:10975–10980
  • ISSN号:1948-7185
  • 是否译文:
  • 发表时间:2021-11-03
  • 收录刊物:SCI
  • 发布期刊链接:https://pubs.acs.org/doi/10.1021/acs.jpclett.1c03248?ref=pdf

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