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首页> 外文期刊>Il Nuovo Cimento della Societa Italiana di Fisica, B. General physics, relativity, astronomy and mathematical physics and methods >Schrodinger equation in the space with cylindrical geometric defect and possible application to multi-wall nanotubes
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Schrodinger equation in the space with cylindrical geometric defect and possible application to multi-wall nanotubes

机译:具有圆柱形几何缺陷的空间中的薛定inger方程及其在多壁纳米管中的应用

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The recently invented cylindrical geometric space defect is applied to the electron behaviour in the system which can be regarded as a simplified model of a double-wall nanotube. By solving the Schrodinger equation in the region of space with cylindrical geometric defect we explore the influence of such geometric defect on the energy gap and charge distribution. The effect is qualitatively similar to the one obtained earlier by means of traditional simulation methods. In general, the geometric approach cannot compete with the known methods of theoretical study of the nanostructures, such as molecular dynamics. However it may be useful for better qualitative understanding of the electronic properties of the nanosystems.
机译:最近发明的圆柱形几何空间缺陷被应用于系统中的电子行为,该系统可以被视为双壁纳米管的简化模型。通过求解具有圆柱形几何缺陷的空间区域中的薛定inger方程,我们探索了这种几何缺陷对能隙和电荷分布的影响。该效果在质量上与之前通过传统仿真方法获得的效果相似。通常,几何方法无法与纳米结构理论研究的已知方法相抗衡,例如分子动力学。然而,对于更好地定性理解纳米系统的电子性质可能是有用的。

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