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Electronic structure, carrier mobility and device properties for mixed-edge phagraphene nanoribbon by hetero-atom doping

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成果类型:
期刊论文
作者:
Luo, A. Y.;Hu, R.;Fan, Z. Q.;Zhang, H. L.;Yuan, J. H.;...
通讯作者:
Zhang, Z. H.
作者机构:
[Yuan, J. H.; Luo, A. Y.; Zhang, H. L.; Fan, Z. Q.; Zhang, Z. H.; Hu, R.; Yang, C. H.] Changsha Univ Sci & Technol, Inst Nanomat & Nanostruct, Changsha 410114, Hunan, Peoples R China.
通讯机构:
[Zhang, Z. H.] C
Changsha Univ Sci & Technol, Inst Nanomat & Nanostruct, Changsha 410114, Hunan, Peoples R China.
语种:
英文
关键词:
Atoms;Carrier mobility;Charge transfer;Electronic properties;Electronic structure;Nanoribbons;Structural properties;Carbon allotropes;Device properties;Geometric stability;Heteroatoms;Hybridized bands;IV characteristics;Negative differential resistance characteristics;Orders of magnitude;Hole mobility
期刊:
Organic Electronics
ISSN:
1566-1199
年:
2017
卷:
51
页码:
277-286
基金类别:
This work was supported by the National Natural Science Foundation of China (Grant Nos. 61371065 and 51604042 ), the Hunan Provincial Natural Science Foundation of China (Grant Nos. 12JJ3004 , 2015JJ3002 , 2015JJ2009 , 2015JJ2013 ), and Project supported by the scientific research project of the Education Department of Hunan Province (Grant No. 16C0029 ).
机构署名:
本校为第一且通讯机构
院系归属:
物理与电子科学学院
摘要:
Phagraphene, a new carbon allotrope, was proposed recently. We here select a mixed-edge phagraphene ribbon to study B-, N-, and BN-doping effects respectively on the geometric stability, electronic structure, carrier mobility, and device property. Calculations show that the energetic and thermal stability for these ribbons are very high. With different doping types and doping sites, the bandgap size of a ribbon may be nearly unchanged, increased, or decreased as compared with the intrinsic ribbon, and even become a metal, thus presenting fully ...

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