Citation: Wang-Yang DUAN, Yue-Huan CHENG, Ji-Song HU, Xin-Guo MA, Ling PEI. Schottky barrier of blue phosphorus/graphene heterostructure regulated by the adsorption of oxygen atoms[J]. Chinese Journal of Inorganic Chemistry, ;2023, 39(10): 1980-1990. doi: 10.11862/CJIC.2023.161 shu

Schottky barrier of blue phosphorus/graphene heterostructure regulated by the adsorption of oxygen atoms

Wang-Yang DUAN ^{1, 2} ,
Yue-Huan CHENG ³ ,
Ji-Song HU ³ ,
Xin-Guo MA ^{1, 2} ,
Ling PEI ^{1, 2,,}

1.
School of Science, Hubei University of Technology, Wuhan 430068, China
2.
Hubei Engineering Technology Research Center of Energy Photoelectric Device and System Hubei University of Technology, Wuhan 430068, China
3.
School of optical and electronic information, Huazhong University of Science & Technology, Wuhan 430068, China

Corresponding author: Ling PEI, 47160162@qq.com
Received Date: 9 March 2023
Revised Date: 16 September 2023

Figures(8)

Controlling the p-type transmission operation of nanoelectronics remains a major challenge in lowering the Schottky barrier. To solve this problem, we systematically investigated the effects of O atoms adsorption doped on the interlayer interactions and electronic properties of the BP/graphene (BP=blue phosphorus) heterostructures by first-principles calculations incorporating a semiempirical dispersion-correction scheme. The results show that the interfacial binding can be enhanced by O atom adsorption doped inside the interface. The height of the Schottky barrier can be adjusted by changing the concentration of O atom adsorption doped inside the interface. It is further found that by increasing the concentration of O atoms inside the interface, a low p - type Schottky barrier can be obtained, thereby achieving efficient charge transfer. Finally, it is confirmed that the redistribution of the interfacial charge leads to the movement of the Fermi level, which determines the height of the Schottky barrier.
- blue phosphorus,
- graphene,
- oxygen adsorption,
- Schottky barrier,
- heterojunction
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