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Unfolding energy spectra of multi-periodicity materials

Materials Science 2018-01-31 v1

Abstract

We propose a new unfolding scheme to analyze energy spectra of complex large-scale systems which are inherently of multi-periodicity. Considering twisted bilayer graphene (tBLG) as an example, we first show that the conventional unfolding scheme in the past using a single primitive-cell representation causes serious problems in analyses of the energy spectra. We then introduce our multi-space representation scheme in the unfolding method and clarify its validity for tBLG. Velocity renormalization of Dirac electrons in tBLG is elucidated in the present unfolding scheme.

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Cite

@article{arxiv.1706.05921,
  title  = {Unfolding energy spectra of multi-periodicity materials},
  author = {Yu-ichiro Matsushita and Hirofumi Nishi and Jun-ichi Iwata and Taichi Kosugi and Atsushi Oshiyama},
  journal= {arXiv preprint arXiv:1706.05921},
  year   = {2018}
}

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