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(8, 0)碳纳米管/碳化硅纳米管异质结输运特性的研究
引用本文:刘红霞,张鹤鸣,张志勇. (8, 0)碳纳米管/碳化硅纳米管异质结输运特性的研究[J]. 半导体学报, 2009, 30(5): 052002-4
作者姓名:刘红霞  张鹤鸣  张志勇
作者单位:Laboratory;Ministry;Education;Wide;Band-Gap;Semiconductor;Materials;Devices;School;Microelectronics;Xidian;University;Institute;Information;Science;Technology;Northwest;
基金项目:supported by the Pre-Research Foundation from the National Ministries and Commissions(No.51308040203)
摘    要:
A two-probe system of the heterojunction formed by an (8, 0) carbon nanotube (CNT) and an (8, 0) silicon carbide nanotube (SiCNT) was established based on its optimized structure. By using a method combining nonequilibrium Green's function (NEGF) with density functional theory (DFF), the transport properties of the het-erojunction were investigated. Our study reveals that the highest occupied molecular orbital (HOMO) has a higher electron density on the CNT section and the lowest unoccupied molecular orbital (LUMO) mainly concentrates on the interface and the SiCNT section. The positive and negative threshold voltages are +1.8 and -2.2 V, respectively.

关 键 词:电子输运性质  硅纳米管  异质结  碳化  分子轨道  密度泛函理论  碳纳米管  探针系统
收稿时间:2008-11-09

Electronic transport properties of an (8, 0) carbon/silicon-carbide nanotube heterojunction
Liu Hongxi,Zhang Heming and Zhang Zhiyong. Electronic transport properties of an (8, 0) carbon/silicon-carbide nanotube heterojunction[J]. Chinese Journal of Semiconductors, 2009, 30(5): 052002-4
Authors:Liu Hongxi  Zhang Heming  Zhang Zhiyong
Affiliation:Key Laboratory of the Ministry of Education for Wide Band-Gap Semiconductor Materials and Devices, School of Microelectronics, Xidian University, Xi'an 710071, China;Key Laboratory of the Ministry of Education for Wide Band-Gap Semiconductor Materials and Devices, School of Microelectronics, Xidian University, Xi'an 710071, China;Institute of Information Science and Technology, Northwest University, Xi'an 710069, China
Abstract:
A two-probe system of the heterojunction formed by an (8, 0) carbon nanotube (CNT) and an (8, 0) silicon carbide nanotube (SiCNT) was established based on its optimized structure. By using a method combining nonequilibrium Green's function (NEGF) with density functional theory (DFT), the transport properties of the het-erojunction were investigated. Our study reveals that the highest occupied molecular orbital (HOMO) has a higher electron density on the CNT section and the lowest unoccupied molecular orbital (LUMO) mainly concentrates on the interface and the SiCNT section. The positive and negative threshold voltages are +1.8 and -2.2 V, respectively.
Keywords:carbon/silicon carbide nanotube heterojunction   nonequilibrium Green's function   transport properties
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