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Multiscale modeling and simulation of nanotube-based torsional oscillators

机译:基于纳米管的扭转振荡器的多尺度建模与仿真

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摘要

In this paper, we propose the first numerical study of nanotube-based torsional oscillators via developing a new multiscale model. The edge-to-edge technique was employed in this multiscale method to couple the molecular model, i.e., nanotubes, and the continuum model, i.e., the metal paddle. Without losing accuracy, the metal paddle was treated as the rigid body in the continuum model. Torsional oscillators containing (10,0) nanotubes were mainly studied. We considered various initial angles of twist to depict linearonlinear characteristics of torsional oscillators. Furthermore, effects of vacancy defects and temperature on mechanisms of nanotube-based torsional oscillators were discussed.
机译:在本文中,我们通过开发新的多尺度模型,提出了基于纳米管的扭转振荡器的首次数值研究。在这种多尺度方法中采用了边缘到边缘技术,以耦合分子模型(即纳米管)和连续体模型(即金属桨)。在不损失精度的情况下,金属桨在连续模型中被视为刚体。主要研究了包含(10,0)纳米管的扭转振荡器。我们考虑了各种初始扭转角来描述扭转振荡器的线性/非线性特性。此外,讨论了空位缺陷和温度对基于纳米管的扭转振荡器机理的影响。

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