Tuning Electronic Structures of BN and C Double‐Wall Hetero‐Nanotubes Article Swipe

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Xueran Liu , Minglian Han , Xinjiang Zhang , Haijun Hou , Shaoping Pang , Qisheng Wu ·

YOU? · · 2015 · Open Access · · DOI: https://doi.org/10.1155/2015/326294

First principle calculations based on density functional theory with the generalized gradient approximation were carried out to investigate the energetic and electronic properties of carbon and boron nitride double‐wall hetero‐nanotubes (C/BN‐DWHNTs) with different chirality and size, including an armchair ( n , n ) carbon nanotube (CNT) enclosed in ( m , m ) boron nitride nanotube (BNNT) and a zigzag ( n , 0) CNT enclosed in ( m , 0) BNNT. The electronic structure of these DWHNTs under a transverse electric field was also investigated. The ability to tune the band gap with changing the intertube distance ( d i ) and imposing an external electric field ( F ) of zigzag DWHNTs provides the possibility for future electronic and electrooptic nanodevice applications.

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Condensed Matter Physics

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Zigzag Materials science Boron nitride Electric field Carbon nanotube Nanodevice Nanotube Electronic structure Density functional theory Condensed matter physics Band gap Graphene First principle Nanotechnology Molecular physics Computational chemistry Optoelectronics Quantum mechanics Physics Mathematics Chemistry Geometry

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Type: article
Language: en
Landing Page: https://doi.org/10.1155/2015/326294
PDF: https://downloads.hindawi.com/journals/jnm/2015/326294.pdf
OA Status: hybrid
Cited By: 3
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DOI: https://doi.org/10.1155/2015/326294

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Title: Tuning Electronic Structures of BN and C Double‐Wall Hetero‐Nanotubes

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Language: en

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Publication year: 2015

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Publication date: 2015-01-01

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Authors: Xueran Liu, Minglian Han, Xinjiang Zhang, Haijun Hou, Shaoping Pang, Qisheng Wu

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Landing page: https://doi.org/10.1155/2015/326294

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Concepts: Zigzag, Materials science, Boron nitride, Electric field, Carbon nanotube, Nanodevice, Nanotube, Electronic structure, Density functional theory, Condensed matter physics, Band gap, Graphene, First principle, Nanotechnology, Molecular physics, Computational chemistry, Optoelectronics, Quantum mechanics, Physics, Mathematics, Chemistry, Geometry

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Cited by: 3

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