• 文献标题:   Novel graphene-like two-dimensional bilayer germanene dioxide: electronic structure and optical properties
  • 文献类型:   Article
  • 作  者:   DOU YM, ZHANG CW, LI P, WANG PJ
  • 作者关键词:  
  • 出版物名称:   RSC ADVANCES
  • ISSN:   2046-2069
  • 通讯作者地址:   Univ Jinan
  • 被引频次:   0
  • DOI:   10.1039/c9ra00450e
  • 出版年:   2019

▎ 摘  要

Using ab initio calculations, we present a two-dimensional (2D) -2D-germanene dioxide material with an ideal sp(3) bonding network which possesses a large band gap up to 2.50 eV. The phonon dispersion curves and molecular dynamics (MD) simulation under the chosen parameters suggest that the novel 2D structure is stable. The dielectric function and absorption spectrum also show the consistent band gap within the electronic structure diagram, suggesting possible application as an ultraviolet light optical detector. The calculated carrier mobility of 4.09 x 10(3) cm(2) V-1 s(-1) can be observed along the x direction, which is much higher than that of MoS2 (approximate to 3.0 cm(2) V-1 s(-1)). Finally, we found that -2D-germanene dioxide could potentially act as an ideal monolayer insulator in so-called van der Waals (vdW) heterostructure devices. These findings expand the potential applications of the emerging field of 2D -2D-germanene dioxide materials in nanoelectronics.