摘要
The stacking effects on the electronic structure of van der Waals heterostructures consisting of silicene and hexagonal boron nitride are investigated by first-principles calculations. It is shown that the stacking is fundamental for the details of the dispersion relation in the vicinity of the Fermi energy (gapped, non-gapped, linear, parabolic) despite small differences in the total energy. It is also demonstrated that the tight-binding model of bilayer graphene is able to capture most of these features of the van der Waals heterostructures, and the limitations of the model are identified.
源语言 | 英语 |
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文章编号 | 1800083 |
期刊 | Advanced Theory and Simulations |
卷 | 1 |
期 | 11 |
DOI | |
出版状态 | 已出版 - 1 11月 2018 |