Journal of South China University of Technology (Natural Science Edition) ›› 2014, Vol. 42 ›› Issue (12): 133-140.doi: 10.3969/j.issn.1000-565X.2014.12.020

• Mechanics • Previous Articles     Next Articles

Molecular Dynamics Simulation of Axial Compressive Properties of Carbon Nanotubes with Cracks

Han Qiang Wang Cai-hong Yao Xiao-hu   

  1. School of Civil Engineering and Transportation,South China University of Technology,Guangzhou 510640,Guangdong,China
  • Received:2014-03-21 Revised:2014-04-04 Online:2014-12-25 Published:2014-11-17
  • Contact: 韩强(1963-),男,教授,博士生导师,主要从事非线性动力学研究. E-mail:emqhan@scut.edu.cn
  • About author:韩强(1963-),男,教授,博士生导师,主要从事非线性动力学研究.
  • Supported by:

    国家自然科学基金资助项目(11272123);华南理工大学中央高校基金滚动项目(2014ZG0033);新世纪优秀人才支持计划项目(NCET13-0218)

Abstract:

In this paper,based on the molecular dynamics method,the axial compressive properties of armchaircarbon nanotubes with cracks are investigated through the AIREBO potential function,and the effects of the crackand tube lengths on the axial compressive properties of carbon nanotubes are analyzed.Then,the stress-strain curveand the potential curve are described,and the typical deformed structures in the axial compression process are ob-tained.The results show that (1) for the carbon nanotubes of different crack dip angles,the critical bucklingstrength decreases with the increase of the crack length; (2) for the carbon nanotubes with a crack dip angle of90°,there are hollows and dislocation in the crack region under the axial compressive load; (3) for the carbonnanotubes with a crack dip angle of 30°,there are hollows around the crack and twists in the crack edges; (4) forthe carbon nanotubes of two different crack dip angles,there is no resilience around the crack in the whole axialcompressive process; and (5) the axial bearing capacity of the carbon nanotube with different cracks decreases withthe increase of the tube length.

Key words: carbon nanotubes, molecular dynamics, buckling, crack

CLC Number: