| First principles study of magnetism induced by topological frustration of bowtie-shaped graphene nanoflake | |
Ge Y; Ji JL; Shen ZZ; Zhang Q ; Jian AQ; Duan QQ; Wang C(王超); Jiang J; Zhang WD; Sang SB
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| Source Publication | CARBON
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| 2018-02-01 | |
| Volume | 127Pages:432-436 |
| ISSN | 0008-6223 |
| Abstract | Fine-tuning magnetic states by understanding topological frustration inducing magnetic mechanism should allow greater flexibility for the design of graphene-based spintronics. Based on first-principles calculations, it is predicted that bowtie-shaped graphene nanoflake (GNF) is of spin-polarized ground state exhibiting antiferromagnetic (AFM) ordering between two individual triangular GNFs. It is demonstrated that strength of antiferromagnetic coupling of both symmetric and asymmetric bowtie-shaped GNF displays strong zero-energy-state-orientated behavior due to non-trivial nature of topological frustration, with implications for designing graphene nanostructures with predefined magnetic states. It also proposes a specific example of structures that can serve as nanoscale molecular logic gates composed by asymmetric bowtie-shaped GNFs units, which augment the special antiferromagnetic function through structural configuration of multi-bowtie-shaped GNFs. (C) 2017 Elsevier Ltd. All rights reserved. |
| DOI | 10.1016/j.carbon.2017.11.005 |
| Indexed By | SCI ; EI |
| Language | 英语 |
| WOS ID | WOS:000417484000049 |
| WOS Keyword | MOLECULAR-ORBITAL METHOD ; QUANTUM DOTS ; ROOM-TEMPERATURE ; ARMCHAIR EDGES ; NANORIBBONS ; ZIGZAG ; SPINTRONICS ; RIBBONS ; FUTURE ; SIZE |
| WOS Research Area | Chemistry ; Materials Science |
| WOS Subject | Chemistry, Physical ; Materials Science, Multidisciplinary |
| Funding Organization | 863 project(2015AA042601) ; National Science Foundation of China(51705354 ; Basic Research Project of Shanxi Province(2015021092) ; Graduate student education innovation project of Shanxi(2017SY062) ; 61471255 ; 61474079 ; 61501316 ; 51505324 ; 51622507) |
| Classification | 一类 |
| Ranking | 5+ |
| Citation statistics | |
| Document Type | 期刊论文 |
| Identifier | http://dspace.imech.ac.cn/handle/311007/72229 |
| Collection | 非线性力学国家重点实验室 |
| Recommended Citation GB/T 7714 | Ge Y,Ji JL,Shen ZZ,et al. First principles study of magnetism induced by topological frustration of bowtie-shaped graphene nanoflake[J]. CARBON,2018,127:432-436. |
| APA | Ge Y.,Ji JL.,Shen ZZ.,Zhang Q.,Jian AQ.,...&Sang SB.(2018).First principles study of magnetism induced by topological frustration of bowtie-shaped graphene nanoflake.CARBON,127,432-436. |
| MLA | Ge Y,et al."First principles study of magnetism induced by topological frustration of bowtie-shaped graphene nanoflake".CARBON 127(2018):432-436. |
| Files in This Item: | Download All | |||||
| File Name/Size | DocType | Version | Access | License | ||
| Jp-2018-004.pdf（1171KB） | 期刊论文 | 出版稿 | 开放获取 | CC BY-NC-SA | View Download | |
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