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Bending buckling behaviors of single- and multi-walled carbon nanotubes

机译:单壁和多壁碳纳米管的弯曲屈曲行为

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The bending buckling behaviors of single- (SWCNTs), double- (DWCNTs) and multi-walled carbon nanotubes (MWCNTs) are investigated employing a modified finite element method (FEM). Extensive finite element simulations are carried out to investigate the buckling behaviors of SWCNTs, DWCNTs and MWCNTs under bending deformation. The computed results for SWCNTs agree well with atomistic simulations in the literature and the validation of the present modified FEM is confirmed successfully. Explicit relationships are established between the critical bending buckling curvature and the diameter of carbon nanotubes (CNTs). The variations of the bending load with the bending angle or curvature for CNTs with different geometrical parameters, such as tube diameter, length and chirality, are revealed amply. And the results are correlated with the buckled geometrical configurations. The significant influence of interlayer van der Waals (vdW) forces on the bending properties of MWCNTs is examined. And finally, the effects of the number of layers on the buckling load and critical bending angle of MWCNTs are also examined. A number of significant conclusions drawn from the extensive simulations are presented. It is shown that the present modified FEM is computationally fast and is an alternative efficient way to study the buckling and postbuckling of CNTs. (C) 2008 Elsevier B.V. All rights reserved.
机译:采用改进的有限元方法(FEM)研究了单壁(SWCNTs),双壁(DWCNTs)和多壁碳纳米管(MWCNTs)的弯曲屈曲行为。进行了广泛的有限元模拟,研究了SWCNTs,DWCNTs和MWCNTs在弯曲变形下的屈曲行为。单壁碳纳米管的计算结果与文献中的原子模拟非常吻合,并成功证实了本改进的有限元方法的有效性。在临界弯曲屈曲曲率和碳纳米管(CNT)的直径之间建立了明确的关系。对于具有不同几何参数(例如管直径,长度和手性)的CNT,弯曲载荷随弯曲角度或曲率的变化被充分揭示。结果与弯曲的几何构型相关。研究了层间范德华力(vdW)对MWCNTs弯曲性能的重大影响。最后,还研究了层数对MWCNT的屈曲载荷和临界弯曲角的影响。从广泛的仿真中得出了许多重要的结论。结果表明,本改进的有限元方法计算速度快,是研究碳纳米管屈曲和后屈曲的另一种有效方法。 (C)2008 Elsevier B.V.保留所有权利。

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