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Anisotropic in-plane thermal conductivity in multilayer silicene
Authors:Yang Zhou  Zhi-Xin Guo  Shi-You Chen  Hong-Jun Xiang  Xin-Gao Gong
Affiliation:1. Key Laboratory for Computational Physical Science (Ministry of Education), State Key Laboratory of Surface Physics and Department of Physics, Fudan University, Shanghai 200433, China;2. Department of Physics, Xiangtan University, Xiangtan 411105, China;3. Collaborative Innovation Center of Advanced Microstructures, Nanjing 210093, Jiangsu, China
Abstract:We systematically study thermal conductivity of multilayer silicene by means of Boltzmann Transportation Equation (BTE) method. We find that their thermal conductivity strongly depends on the surface structures. Thermal conductivity of bilayer silicene varies from 3.31 W/mK to 57.9 W/mK with different surface structures. Also, the 2×1 surface reconstruction induces unusual large thermal conductivity anisotropy, which reaches 70% in a four-layer silicene. We also find that the anisotropy decreases with silicene thickness increasing, owing to the significant reduction of thermal conductivity in the zigzag direction and its slight increment in the armchair direction. Finally, we find that both the phonon-lifetime anisotropy and the phonon-group-velocity anisotropy contribute to the thermal conductivity anisotropy of multilayer silicene. These findings could be helpful in the field of heat management, thermoelectric applications involving silicene and other multilayer nanomaterials with surface reconstructions in the future.
Keywords:Thermal conductivity  Multilayer silicene  Surface reconstruction  Anisotropy
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