Strain-induced bandgap engineering in 2D ψ-graphene materials: a first-principles study

被引:0
|
作者
Kumar, Kamal [1 ]
de Leeuw, Nora H. [2 ,3 ]
Adam, Jost [4 ,5 ]
Mishra, Abhishek Kumar [1 ]
机构
[1] Department of Physics, Applied Science Cluster, School of Advanced Engineering, University of Petroleum and Energy Studies (UPES), Bidholi via Premnagar, Uttarakhand, Dehradun,248007, India
[2] School of Chemistry, University of Leeds, Leeds,LS2 9JT, United Kingdom
[3] Department of Earth Sciences, Utrecht University, Utrecht,3584 CB, Netherlands
[4] Computational Materials and Photonics, Electrical Engineering and Computer Science (FB 16), Institue of Physics (FB 10), University of Kassel, Wilhelmshöher Allee 71, Kassel,34121, Germany
[5] Center for Interdisciplinary Nanostructure Science and Technology, University of Kassel, Heinrich-Plett-Straße 40, Kassel,34132, Germany
关键词
Kamal Kumar (KK) and AKM acknowledge the University of Kassel; Germany; for visiting scholar positions and computational resources. Parts of this work have been performed using the Danish National Life Science Supercomputing Centre; Computerome. This work has also used the ARCHER2 UK National Supercomputing Service (https://www.archer2.ac.uk). Dr. Abhishek Kumar Mishra (AKM) acknowledges the Science and Engineering Research Board (SERB) for a state university research excellence (SURE) grant (SUR/2022/004935);
D O I
10.3762/BJNANO.15.116
中图分类号
学科分类号
摘要
引用
收藏
页码:1440 / 1452
相关论文
共 50 条
  • [1] Strain-induced bandgap engineering in 2D ψ-graphene materials: a first-principles study
    Kumar, Kamal
    de Leeuw, Nora H.
    Adam, Jost
    Mishra, Abhishek Kumar
    BEILSTEIN JOURNAL OF NANOTECHNOLOGY, 2024, 15 : 1440 - 1452
  • [2] Strain-induced enhancement of 2D electron gas density in AlGaN/GaN heterojunction: a first-principles study
    Cao, Yuelong
    Guan, Qi
    He, Yang
    Wang, Xinmei
    Zhang, Lin
    Li, Enling
    Jia, Wanli
    JOURNAL OF PHYSICS D-APPLIED PHYSICS, 2024, 57 (14)
  • [3] First-principles Study of Strain-Induced Magnetism in Defective Arsenene
    Xiao-ou Zhang
    Journal of Superconductivity and Novel Magnetism, 2019, 32 : 1735 - 1740
  • [4] First-principles Study of Strain-Induced Magnetism in Defective Arsenene
    Zhang, Xiao-ou
    JOURNAL OF SUPERCONDUCTIVITY AND NOVEL MAGNETISM, 2019, 32 (06) : 1735 - 1740
  • [5] First-principles study of strain-induced modulation of energy gaps of graphene/BN and BN bilayers
    Zhong, Xiaoliang
    Yap, Yoke Khin
    Pandey, Ravindra
    Karna, Shashi P.
    PHYSICAL REVIEW B, 2011, 83 (19):
  • [6] Strain-induced bandgap engineering in CsGeX3 (X = I, Br or Cl) perovskites: insights from first-principles calculations
    Xiang, Guangbiao
    Wu, Yanwen
    Zhang, Man
    Leng, Jiancai
    Cheng, Chen
    Ma, Hong
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 24 (09) : 5448 - 5454
  • [7] First-Principles Study on Strain-Induced Modulation of Electronic Properties in Indium Phosphide
    Yan, Libin
    Chen, Zhongcun
    Bai, Yurong
    Liu, Wenbo
    He, Huan
    He, Chaohui
    NANOMATERIALS, 2024, 14 (21)
  • [8] Strain-induced effects on the electronic properties of 2D materials
    Postorino, Sara
    Grassano, Davide
    D'Alessandro, Marco
    Pianetti, Andrea
    Pulci, Olivia
    Palummo, Maurizia
    NANOMATERIALS AND NANOTECHNOLOGY, 2020, 10
  • [9] First-principles study of strain-induced charge polarization in a molybdenum disulfide monolayer
    Salami, N.
    Shokri, A. A.
    SCIENTIA IRANICA, 2017, 24 (03) : 1724 - 1733
  • [10] Engineering graphene by oxidation: a first-principles study
    Xu, Zhiping
    Xue, Kun
    NANOTECHNOLOGY, 2010, 21 (04)