Tunable electronic properties of arsenene and transition-metal dichalcogenides heterostructures: A first principles calculation
发布时间：2025-04-30
点击次数：
- 发布时间：
- 2025-04-30
- 论文名称：
- Tunable electronic properties of arsenene and transition-metal dichalcogenides heterostructures: A first principles calculation
- 发表刊物：
- Journal of Physical Chemistry C
- 摘要：
- The structural and electronic properties of arsenene and monolayer transition-metal dichalcogenides (β-
As/MX2) heterostructures have been systematically investigated by density functional theory. It is found that all β-As/ MX2 heterostructures with little lattice mismatch possess considerable band gaps. Their electronic properties can be effectively tuned via (biaxial or uniaxial) strain and electric field, but the variation trends are different. The band gaps of the β-As/MX2 heterostructures decrease linearly as the strain arises, while there is a Stark effect of the band gap under suitable electric field due to the spontaneous electric polarization in the heterostructures. Meanwhile, a series change of the semiconductor types of the β-As/MX2 heterostructures could also be obtained by the strain and electric field. These diverse electronic properties may provide a potential application in nanodevices based on arsenene and transition-metal dichalcogenides.
- 合写作者：
- M. M. Dong, C. He*. W. X. Zhang,*
- 卷号：
- 121, 22040
- 页面范围：
- 121, 22040
- 是否译文：
- 否
- 发表时间：
- 2017-12-12