Exploring atomic defects in molybdenum disulphide monolayers

Exploring atomic defects in molybdenum disulphide monolayers

19 Feb 2015 | Jinhua Hong, Zhixin Hu, Matt Probert, Kun Li, Danhui Lv, Xinan Yang, Lin Gu, Nannan Mao, Qingliang Feng, Liming Xie, Jin Zhang, Dianzhong Wu, Zhiyong Zhang, Chuanhong Jin, Wei Ji, Xixiang Zhang, Jun Yuan & Ze Zhang
This article explores atomic defects in monolayer molybdenum disulphide (MoS₂) and their impact on the material's electronic and optical properties. Using a combination of experimental techniques and theoretical calculations, the study identifies and quantifies point defects in MoS₂ samples prepared by mechanical exfoliation (ME), physical vapour deposition (PVD), and chemical vapour deposition (CVD). The results show that the dominant type of defect varies depending on the preparation method: sulphur vacancies are prevalent in ME and CVD samples, while molybdenum antisite defects are dominant in PVD samples. The defect density in PVD samples reaches up to 3.5 × 10¹³ cm⁻², which is significantly higher than in ME and CVD samples. The study also investigates the influence of these defects on the electronic structure and charge-carrier mobility of MoS₂. Ab-initio calculations predict the electronic and magnetic properties of MoS₂ with antisite defects, and the results show that antisite defects can induce a magnetic moment of 2μB. The presence of these defects affects the carrier mobility, with phonon-limited mobility reduced by up to three times in samples with antisite defects. The study highlights the importance of minimizing point defects, particularly antisites, for high-performance electronic applications. The research also discusses the potential of defects in tailoring the properties of MoS₂ for optoelectronic and nanoelectronic applications. The findings suggest that controlling the density and type of defects could lead to novel magnetic and electronic properties in MoS₂. The study provides a comprehensive understanding of the role of point defects in MoS₂ and their impact on the material's performance, which is crucial for the development of high-quality, scalable MoS₂-based electronic devices.This article explores atomic defects in monolayer molybdenum disulphide (MoS₂) and their impact on the material's electronic and optical properties. Using a combination of experimental techniques and theoretical calculations, the study identifies and quantifies point defects in MoS₂ samples prepared by mechanical exfoliation (ME), physical vapour deposition (PVD), and chemical vapour deposition (CVD). The results show that the dominant type of defect varies depending on the preparation method: sulphur vacancies are prevalent in ME and CVD samples, while molybdenum antisite defects are dominant in PVD samples. The defect density in PVD samples reaches up to 3.5 × 10¹³ cm⁻², which is significantly higher than in ME and CVD samples. The study also investigates the influence of these defects on the electronic structure and charge-carrier mobility of MoS₂. Ab-initio calculations predict the electronic and magnetic properties of MoS₂ with antisite defects, and the results show that antisite defects can induce a magnetic moment of 2μB. The presence of these defects affects the carrier mobility, with phonon-limited mobility reduced by up to three times in samples with antisite defects. The study highlights the importance of minimizing point defects, particularly antisites, for high-performance electronic applications. The research also discusses the potential of defects in tailoring the properties of MoS₂ for optoelectronic and nanoelectronic applications. The findings suggest that controlling the density and type of defects could lead to novel magnetic and electronic properties in MoS₂. The study provides a comprehensive understanding of the role of point defects in MoS₂ and their impact on the material's performance, which is crucial for the development of high-quality, scalable MoS₂-based electronic devices.
Reach us at info@study.space