First principle study of multilayered graphene/MoS2 heterostructures for photodetectors

被引:10
作者
Mustafa, Hina [1 ]
Irfan, Muhammad [2 ,3 ]
Sattar, Abdul [1 ]
Amjad, Raja Junaid [1 ]
Latif, Hamid [4 ]
Usman, Arslan [1 ]
Ahmad, M. Ashfaq [1 ]
Qin, Shengyong [2 ,3 ]
机构
[1] COMSATS Univ Islamabad, Dept Phys, Lahore Campus,Def Rd, Lahore 54000, Pakistan
[2] Univ Sci & Technol China, Int Ctr Quantum Design Funct Mat ICQD, Hefei 230026, Peoples R China
[3] Univ Sci & Technol China, Dept Phys, CAS Key Lab Strongly Coupled Quantum Matter Phys, Hefei 230026, Peoples R China
[4] Univ Lahore, Dept Phys, Forman Christin Coll, Lahore 54000, Pakistan
来源
MATERIALS SCIENCE AND ENGINEERING B-ADVANCED FUNCTIONAL SOLID-STATE MATERIALS | 2023年 / 289卷
关键词
Photodetectors; van der Waals heterostructures; Two-dimension materials; Direct bandgap; Graphene; Molybdenum disulfide; Density functional theory; DER-WAALS HETEROSTRUCTURES; ABSORPTION;
D O I
10.1016/j.mseb.2022.116205
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Graphene/MoS2 based heterostructures are one of the most promising candidates for future electronic and optoelectronic devices due to their unique electronic and optical properties. Here, we systematically constructed atomically thin graphene/MoS2, graphene/MoS2/graphene, and graphene/MoS2/graphene/MoS2/graphene heterostructures and performed comprehensive Density Functional Theory calculations to explore their electronic and optical properties, where GGA and HSE06 functionals were employed to explain electron transfer mechanism. Our results revealed the band gap of multilayered MoS2/graphene narrows at K point in Brillouin zone, and can be tuned for up to 36.3 meV. Furthermore, the absorption properties of those heterostructures are the exceptional from visible to ultraviolet region, making the multilayered graphene/MoS2 based heterostructures ideal candidate for photodetectors and optoelectronic applications.
引用
收藏
页数:7
相关论文
共 50 条
[21]   Nonvolatile Memory Cells Based on MoS2/Graphene Heterostructures [J].
Bertolazzi, Simone ;
Krasnozhon, Daria ;
Kis, Andras .
ACS NANO, 2013, 7 (04) :3246-3252
[22]   A first principle study of the structural, electronic, and temperature-dependent thermodynamic properties of graphene/MoS2 heterostructure [J].
Md. Tanver Hossain ;
Md. Ashiqur Rahman .
Journal of Molecular Modeling, 2020, 26
[23]   A first principle study of the structural, electronic, and temperature-dependent thermodynamic properties of graphene/MoS2 heterostructure [J].
Hossain, Md Tanver ;
Rahman, Md Ashiqur .
JOURNAL OF MOLECULAR MODELING, 2020, 26 (02)
[24]   Vertical heterostructures based on SnSe2/MoS2 for high performance photodetectors [J].
Zhou, Xing ;
Zhou, Nan ;
Li, Chao ;
Song, Hongyue ;
Zhang, Qi ;
Hu, Xiaozong ;
Gan, Lin ;
Li, Huiqiao ;
Lu, Jingtao ;
Luo, Jun ;
Xiong, Jie ;
Zhai, Tianyou .
2D MATERIALS, 2017, 4 (02)
[25]   First Principles Study on Electronic and Optical Properties of Graphene/MoS2 for Optoelectronic Application [J].
Halim, Siti Nabilah Mohd ;
Zuikafly, Siti Nur Fatin ;
Taib, Mohamad Fariz Mohamad ;
Ahmad, Fauzan .
2020 IEEE INTERNATIONAL CONFERENCE ON SEMICONDUCTOR ELECTRONICS (ICSE 2020), 2020, :29-32
[26]   Two-Dimensional Material Photodetectors: High Responsivities and Short Response Times of Graphene/Multilayer MoS2 Heterostructures [J].
Huang, Yu-Han ;
Chen, Cheng-Yu ;
Chiang, Yi-Tien ;
Wu, Chao-Hsin ;
Chang, Shoou-Jinn ;
Lin, Shih-Yen .
ACS APPLIED ELECTRONIC MATERIALS, 2025, 7 (09) :3947-3954
[27]   In Situ TEM Study of Electrical Property and Mechanical Deformation in MoS2/Graphene Heterostructures [J].
Giri, Suresh ;
Sharma, Subash ;
Mahyavanshi, Rakesh D. ;
Kalita, Golap ;
Yang, Yong ;
Tanemura, Masaki .
NANOMATERIALS, 2025, 15 (02)
[28]   STUDY OF POTASSIUM INTERCALATION IN TO THE GRAPHENE/MoS2 STRUCTURE [J].
Chepkasov, I. V. .
PHYSICAL AND CHEMICAL ASPECTS OF THE STUDY OF CLUSTERS NANOSTRUCTURES AND NANOMATERIALS, 2021, (13) :639-645
[29]   In-depth first-principle study on novel MoS2 polymorphs [J].
Eidsvag, Hakon ;
Rasukkannu, Murugesan ;
Velauthapillai, Dhayalan ;
Vajeeston, Ponniah .
RSC ADVANCES, 2021, 11 (06) :3759-3769
[30]   A first principle Comparative study of electronic and optical properties of 1H - MoS2 and 2H - MoS2 [J].
Kumar, Ashok ;
Ahluwalia, P. K. .
MATERIALS CHEMISTRY AND PHYSICS, 2012, 135 (2-3) :755-761