Unusually high thermal conductivity in suspended monolayer MoSi<sub>2</sub>N<sub>4</sub>.

He, Chengjian; Xu, Chuan; Chen, Chen; Tong, Jinmeng; Zhou, Tianya; Sun, Su; Liu, Zhibo; Cheng, Hui-Ming et al. · Nat Commun · 2024

basic_science · Level V

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Abstract

Two-dimensional semiconductors with high thermal conductivity and charge carrier mobility are of great importance for next-generation electronic and optoelectronic devices. However, constrained by the long-held Slack's criteria, the reported two-dimensional semiconductors such as monolayers of MoS<sub>2</sub>, WS<sub>2</sub>, MoSe<sub>2</sub>, WSe<sub>2</sub> and black phosphorus suffer from much lower thermal conductivity than silicon (~142 W·m<sup>-1</sup>·K<sup>-1</sup>) because of the complex crystal structure, large average atomic mass and relatively weak chemical bonds. Despite the more complex crystal structure, the recently emerging monolayer MoSi<sub>2</sub>N<sub>4</sub> semiconductor has been predicted to have high thermal conductivity and charge carrier mobility simultaneously. In this work, using a noncontact optothermal Raman technique, we experimentally measure a high thermal conductivity of ~173 W·m<sup>-1</sup>·K<sup>-1</sup> at room temperature for suspended monolayer MoSi<sub>2</sub>N<sub>4</sub> grown by chemical vapor deposition. First-principles calculations reveal that such unusually high thermal conductivity benefits from the high Debye temperature and small Grüneisen parameter of MoSi<sub>2</sub>N<sub>4</sub>, both of which are strongly dependent on the high Young's modulus induced by the outmost Si-N bilayers. Our study not only establishes monolayer MoSi<sub>2</sub>N<sub>4</sub> as a benchmark 2D semiconductor for next-generation electronic and optoelectronic devices, but also provides an insight into the design of 2D materials for efficient heat conduction.