Nanoscale finite element models for vibrations of single-walled carbon nanotubes：atomistic versus continuum.pdfVIP

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Nanoscale finite element models for vibrations of single-walled carbon nanotubes：atomistic versus continuum.pdf

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Nanoscale finite element models for vibrations of single-walled carbon nanotubes：atomistic versus continuum.pdf

Appl. Math. Mech. -Engl. Ed., 34(10), 1187–1200 (2013) Applied Mathematics DOI 10.1007/s10483-013-1738-9 and Mechanics c Shanghai University and Springer-Verlag Berlin Heidelberg 2013 (English Edition) Nanoscale ﬁnite element models for vibrations of single-walled carbon nanotubes: atomistic versus continuum∗ 1 2 1 R. ANSARI , S. ROUHI , M. ARYAYI (1. Department of Mechanical Engineering, University of Guilan, Rasht 3756, Iran; 2. Young Researchers Club, Langroud Branch, Islamic Azad University, Langroud 44715-1333, Iran) Abstract By the atomistic and continuum ﬁnite element models, the free vibration behavior of single-walled carbon nanotubes (SWCNTs) is studied. In the atomistic ﬁnite element model, the bonds and atoms are modeled by the beam and point mass elements, respectively. The molecular mechanics is linked to structural mechanics to determine the elastic properties of the mentioned beam elements. In the continuum ﬁnite element approach, by neglecting the discrete nature of the atomic structure of the nanotubes, they are modeled with shell elements. By both models, the natural frequencies of SWCNTs are computed, and the eﬀects of the geometrical parameters, the atomic structure, and the boundary conditions are investigated. The accuracy of the utilized methods is veriﬁed in comparison with molecular dynamic simulations. The molecular structural model leads to more reliable results, especially for lower aspect ratios. The present analysis provides valuable informatio