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Numerical solution of the Dirac equation for an armchair graphene nanoribbon in the presence of a transversally variable potential

机译:存在横向可变势的扶手椅石墨烯纳米带Dirac方程的数值解

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We compute, using a continuum model based on the Dirac equation, the transverse modes and the longitudinal wave vectors in an armchair ribbon, in the presence of a transversally variable external potential. We show that the application of a standard finite difference method to this problem is not effective, since it can lead to the appearance of spurious solutions and to poor precision. We show how an approach based on Fourier analysis allows to overcome this difficulty and to drastically speed up the calculations, using well-established FFT algorithms.
机译:我们使用基于Dirac方程的连续模型,在存在横向可变外部电势的情况下,在扶手椅状带中计算横向模式和纵向波矢量。我们表明,将标准有限差分方法应用于此问题是无效的,因为它可能导致出现虚假解并降低精度。我们将展示基于傅立叶分析的方法如何使用成熟的FFT算法克服这一困难并大大加快计算速度。

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