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arXiv 2201.06430cond-mat.mes-hall
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扭曲hBN双层膜的两种极限情形及其激子响应

Two limit cases of twisted hBN bilayers and their excitonic response

J. C. G. Henriques, B. Amorim, R. M. Ribeiro, N. M. R. Peres

摘要:

本文讨论了AB和AA '两种hBN双层膜的激子效应引起的光学响应。了解这些双层的属性是非常有用的任意角度的扭曲双层的研究,因为这两种配置对应于0和60度旋转的极限情况。为了获得激子响应,我们提出了一种方法来解决一个四带Bethe-Salpeter方程,通过铸造成一个一维的问题,从而大大减少了计算的数值负担相比,严格的二维方法。我们发现的结果与从头计算已经发表在文献中的AA'双层,并预测AB双层,这在很大程度上仍然是未研究的激子电导率。这两种类型的双层的电导率的主要区别是一个小的外观,但很好地解决,在AB配置的两个较大的之间的共振。这种共振主要是由于层间激子,并且在AA'双层中不存在。此外,AB双层的导电性是由于层内和层间激子两者,并且由p态主导,而层内态是AA'构型的相关态,如在单层中。本文还讨论了在AA ′双层膜中引入偏压的影响。

英文摘要:

In this paper we discuss the optical response due to the excitonic effect of two types of hBN bilayers: AB and AA'. Understanding the properties of these bilayers is of great utility to the study of twisted bilayers at arbitrary angles, since these two configurations correspond to the limit cases of 0 and 60 degree rotation. To obtain the excitonic response we present a method to solve a four-band Bethe-Salpeter equation, by casting it into a 1D problem, thus greatly reducing the numerical burden of the calculation when compared with strictly 2D methods. We find results in good agreement with ab initio calculations already published in the literature for the AA' bilayer, and predict the excitonic conductivity of the AB bilayer, which remains largely unstudied. The main difference in the conductivity of these two types of bilayers is the appearance of a small, yet well resolved, resonance between two larger ones in the AB configuration. This resonance is due to a mainly interlayer exciton, and is absent in the AA' bilayer. Also, the conductivity of the AB bilayer is due to both intralayer and interlayer excitons and is dominated by p-states, while intralayer states are the relevant ones for the AA' configuration, like in a monolayer. The effect of introducing a bias in the AA' bilayer is also discussed.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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