Two-dimensional layered MSi2N4 (M = Mo, W) as promising thermal management materials: a comparative study

doi:10.1039/d1cp03941e

IMR OpenIR

	Two-dimensional layered MSi2N4 (M = Mo, W) as promising thermal management materials: a comparative study
	Shen, Chen 1; Wang, Lei 2,3; Wei, Donghai 4; Zhang, Yixuan 1; Qin, Guangzhao 4; Chen, Xing-Qiu 2,3; Zhang, Hongbin 1
通讯作者	Qin, Guangzhao() ; Chen, Xing-Qiu() ; Zhang, Hongbin()
	2021-12-16
发表期刊	PHYSICAL CHEMISTRY CHEMICAL PHYSICS
ISSN	1463-9076
页码	8
摘要	With the miniaturization and integration of nanoelectronic devices, efficient heat removal becomes a key factor affecting their reliable operation. Two-dimensional (2D) materials, with high intrinsic thermal conductivity, good mechanical flexibility, and precisely controllable growth, are widely accepted as ideal candidates for thermal management materials. In this work, by solving the phonon Boltzmann transport equation (BTE) based on first-principles calculations, we investigated the thermal conductivity of novel 2D layered MSi2N4 (M = Mo, W). Our results point to a competitive thermal conductivity as large as 162 W m(-1) K-1 of monolayer MoSi2N4, which is around two times larger than that of WSi2N4 and seven times larger than that of monolayer MoS2 despite their similar non-planar structures. It is revealed that the high thermal conductivity arises mainly from its large group velocity and low anharmonicity. Our result suggests that MoSi2N4 could be a potential candidate for 2D thermal management materials.
资助者	National Science Fund for Distinguished Young Scholars ; Fundamental Research Funds for the Central Universities ; National Natural Science Foundation of China ; Changsha Municipal Natural Science Foundation ; TU Darmstadt
DOI	10.1039/d1cp03941e
收录类别	SCI
语种	英语
资助项目	National Science Fund for Distinguished Young Scholars[51725103] ; Fundamental Research Funds for the Central Universities[531118010471] ; National Natural Science Foundation of China[52006057] ; Changsha Municipal Natural Science Foundation[kq2014034] ; TU Darmstadt
WOS研究方向	Chemistry ; Physics
WOS类目	Chemistry, Physical ; Physics, Atomic, Molecular & Chemical
WOS记录号	WOS:000743624600001
出版者	ROYAL SOC CHEMISTRY
引用统计	被引频次：32[WOS] [WOS记录] [WOS相关记录]
文献类型	期刊论文
条目标识符	http://ir.imr.ac.cn/handle/321006/173751
专题	中国科学院金属研究所
通讯作者	Qin, Guangzhao; Chen, Xing-Qiu; Zhang, Hongbin
作者单位	1.Tech Univ Darmstadt, Inst Mat Wissench, D-64287 Darmstadt, Germany 2.Chinese Acad Sci, Inst Met Res, Shenyang Natl Lab Mat Sci, Shenyang 110016, Peoples R China 3.Univ Sci & Technol China, Sch Mat Sci & Engn, Shenyang 110016, Peoples R China 4.Hunan Univ, Coll Mech & Vehicle Engn, State Key Lab Adv Design & Mfg Vehicle Body, Changsha 410082, Hunan, Peoples R China
推荐引用方式 GB/T 7714	Shen, Chen,Wang, Lei,Wei, Donghai,et al. Two-dimensional layered MSi2N4 (M = Mo, W) as promising thermal management materials: a comparative study[J]. PHYSICAL CHEMISTRY CHEMICAL PHYSICS,2021:8.
APA	Shen, Chen.,Wang, Lei.,Wei, Donghai.,Zhang, Yixuan.,Qin, Guangzhao.,...&Zhang, Hongbin.(2021).Two-dimensional layered MSi2N4 (M = Mo, W) as promising thermal management materials: a comparative study.PHYSICAL CHEMISTRY CHEMICAL PHYSICS,8.
MLA	Shen, Chen,et al."Two-dimensional layered MSi2N4 (M = Mo, W) as promising thermal management materials: a comparative study".PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2021):8.