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NCN Nanoelectronics: Simulation Tools for Education

CNTbands

This resource has a 9.0 Ranking

Ranking is calculated from a formula comprised of user reviews and usage statistics. Learn more ›

Usage Stats
Overall Period: Updated 19 Jul, 2008
Users: 1875
Jobs: 17809
Avg. exec. time: 27 secs
Reviews & Citations
Google/IEEE: updated 28 Apr, 2008
Avg. Review: 4.5 out of 5 stars
Citations: 10

1875 users, detailed statistics

3 reviews (Review this)

10 citations

0 questions (Ask a question)

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This tool is closed source.

Available Versions

Version 2.1 - published on 10 Jan, 2008
Contributor(s) Youngki Yoon
University of Florida

Diego Kienle
Purdue University, West Lafayette

James K Fodor
University of Florida

Gengchiau Liang
Purdue University, West Lafayette

Akira Matsudaira
University of Illinois at Urbana Champaign

Gerhard Klimeck
Purdue University, West Lafayette

Jing Guo
University of Florida
At a glance CNTbands v2.0 can simulate electronic band structure and density-of-states for carbon nanotubes (CNTs) and carbon nanoribbons (CNRs). It also computes some basic parameters, such as nanotube diameter, number of hexagons in the unit cell, band gap, etc. Users may select the CNR structure to be simulated by selecting a starting point and components for a chiral vector. CNTs are simulated either with a simple Pz orbital model or Extended Huckel theory. The Extended Huckel model can deliver ...
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  • Demo #1
Description

CNTbands v2.0 can simulate electronic band structure and density-of-states for carbon nanotubes (CNTs) and carbon nanoribbons (CNRs). It also computes some basic parameters, such as nanotube diameter, number of hexagons in the unit cell, band gap, etc.

Users may select the CNR structure to be simulated by selecting a starting point and components for a chiral vector.

CNTs are simulated either with a simple Pz orbital model or Extended Huckel theory. The Extended Huckel model can deliver more accurate simulation results, especially for small-diameter CNTs.

Credits

Thanks to the following people for their contributions to this work:

Youngki Yoon ... CNR Simulation Scripts
Diego Kienle ... Extended Huckel Theory Script
James Fodor ... Documentation
Jing Guo ... CNTbands
Akira Matsudaira ... Rappture code for CNTbands 1.0

This project was funded by the NSF Network for Computational Nanotechnology.

The original CNTbands 1.0 was written in 2002 by J. Guo of Purdue University. It was based on a script by M. P. Anantram of NASA Ames Research Center and the paper, L. Yang, M. P. Anantram, and J. P. Lu, "Band-gap change of carbon nanotubes: Effect of small uniaxial and torsional strain," Physical Review B, vol. 60, no. 29, pp. 13874-13878, 1999.

References
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  • Simulation services for results presented here were provided by the Network for Computational Nanotechnology (NCN) at nanoHUB.org

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  1. 4.0 out of 5 stars 

    Posted on 07 July, 2008 by abbas

    the CNTBands tool is very usefull, specialy to appreciate the geometrics and electronics properties. I think that it's a very important tool to use in both cases ( education and research).
    It's gives an excellent introduction to the carbon Nanotubes with a explicit 3D graphics, without forgotten the possibility to compare the properties of many CNTs in the same time. however,
    there are some problems like the incapacity to simulate some CNTs such as (26,18) chirality.
    but mainly I think that the CNTBands is very powerful tool.

  2. 5.0 out of 5 stars 

    Posted on 04 January, 2008 by Gerhard Klimeck

    Provides an excellent introduction to the visualization of a 3D carbon nanotube as a function of chirality. Different geometries can be overlaid and compared.
    Simple calculations such as dispersions and density of states can be performed. Insigt into the semiconducting versus metallic carbon nanotubes can be gained.

  3. 4.0 out of 5 stars 

    Posted on 29 January, 2007 by Anonymous

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  • 5.1 Ranking Series Part of: NCN Nanoelectronics: Simulation Tools for Research

    NCN Nanoelectronics: Simulation Tools for Research

    Type Series
    Date 28 Nov, 2007
    Avg. Rating 0.0 out of 5 stars  (0)
    Rate this

    Many simulation tools are available on the nanoHUB. The tools have been well-tested and here include supporting materials so that they can be effectively used for education or intelligently used for research. The research tools include a first time users guide and supporting publications and …

  • 0.0 Ranking Series Part of: NCN Nanoelectronics: Simulation Tools for Education

    NCN Nanoelectronics: Simulation Tools for Education

    Type Series
    Date 28 Nov, 2007
    Avg. Rating 0.0 out of 5 stars  (0)
    Rate this

    Many simulation tools are available on the nanoHUB. The tools have been well-tested and here include supporting materials so that they can be effectively used for education or intelligently used for research. The educational tools include example a first time users guide and example homework …

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