| Electronic band structure of carbon honeycombs | |
Pang ZQ(庞振乾); Gu, Xiaokun2; Wei YJ(魏宇杰) ; Yang, Ronggui3,4
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| Source Publication | MATERIALS TODAY PHYSICS
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| 2018-07 | |
| Volume | 5Pages:72-77 |
| ISSN | 2542-5293 |
| Abstract | In this article, we present the electronic properties of various carbon honeycombs (C-honeycombs) with different cell sizes and junction types based on ab initio calculations. Among the three typical C-honeycombs with junctions connected via the zigzag edge, the armchair edge, or the hybrid edges of graphene nanoribbons, it is found that the zigzag C-honeycombs and the hybrid ones exhibit metallic properties. However, the armchair C-honeycombs are metallic only if the number of atomic planes N of the graphene nanoribbon in the C-honeycomb sidewall follows N = 3p+1, with p as an integer and are semiconducting for other N. For those semiconducting ones, the bandgap of the C-honeycomb is about 1.19 eV with the narrowest sidewall (5.2 angstrom) and monotonically -12reases to about 0.15 eV when the width is increased to 34.8 angstrom. The semiconducting nature of such C-honeycombs with nanometer size pores may be used for lightweight semiconductor in electronic devices or supercapacitor energy storage. As a comparison, we show that all boron honeycombs are metallic, and their electronic properties are independent of sidewall widths. (C) 2018 Elsevier Ltd. All rights reserved. |
| Keyword | Ultralight weight sp(3) hybridization Semiconductor Band gap Boron-honeycomb Phonon dispersion |
| Subject Area | Materials Science, Multidisciplinary ; Physics, Applied |
| DOI | 10.1016/j.mtphys.2018.06.003 |
| Indexed By | SCI ; EI |
| Language | 英语 |
| WOS ID | WOS:000440069100008 |
| Funding Organization | National Natural Science Foundation of China (NSFC) [11425211] |
| Classification | 一类 |
| Ranking | 1 |
| Contributor | Wei, YJ (corresponding author), Chinese Acad Sci, Inst Mech, LNM, Beijing 100190, Peoples R China. ; Yang, RG (corresponding author), Univ Colorado, Mat Sci & Engn Program, Boulder, CO 80309 USA. |
| Citation statistics | |
| Document Type | 期刊论文 |
| Identifier | http://dspace.imech.ac.cn/handle/311007/90238 |
| Collection | 非线性力学国家重点实验室 |
| Affiliation | 1.Chinese Acad Sci, Inst Mech, LNM, Beijing 100190, Peoples R China 2.Univ Chinese Acad Sci, Sch Engn Sci, Beijing, Peoples R China 3.Shanghai Jiao Tong Univ, Inst Engn Thermophys, Shanghai, Peoples R China 4.Univ Colorado, Mat Sci & Engn Program, Boulder, CO 80309 USA 5.Univ Colorado, Dept Mech Engn, Boulder, CO 80309 USA |
| Recommended Citation GB/T 7714 | Pang ZQ,Gu, Xiaokun,Wei YJ,et al. Electronic band structure of carbon honeycombs[J]. MATERIALS TODAY PHYSICS,2018,5:72-77.Rp_Au:Wei, YJ (corresponding author), Chinese Acad Sci, Inst Mech, LNM, Beijing 100190, Peoples R China., Yang, RG (corresponding author), Univ Colorado, Mat Sci & Engn Program, Boulder, CO 80309 USA. |
| APA | 庞振乾,Gu, Xiaokun,魏宇杰,&Yang, Ronggui.(2018).Electronic band structure of carbon honeycombs.MATERIALS TODAY PHYSICS,5,72-77. |
| MLA | 庞振乾,et al."Electronic band structure of carbon honeycombs".MATERIALS TODAY PHYSICS 5(2018):72-77. |
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| FA020.pdf（2637KB） | 期刊论文 | 出版稿 | 开放获取 | CC BY-NC-SA | View Download | |
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