硅烯
异质结
光电效应
石墨烯
材料科学
带隙
密度泛函理论
硅
范德瓦尔斯力
纳米技术
光电子学
分子
计算化学
化学
有机化学
作者
Jianpei Wang,Haiying Yang,Ping Yang
标识
DOI:10.1016/j.compositesb.2022.109645
摘要
We investigated the photoelectric properties of Graphene (Gra)/ZnO, Gra/Silicene (Si) and ZnO/Gra/Si heterostructures by using density functional calculations. The results show that ZnO, Gra and Si retain their respective electronic properties, which results from the van der Waals (vdW) interlayer interaction between the heterogeneous interfaces. We also can find that the band gap of ZnO: ZnO (1.67 eV) < Gra/ZnO (1.74 eV) < ZnO/Gra/Si (1.76 eV). ZnO/Gra/Si with sandwich structure has the best photoelectric performance.
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