Effect of compression on the electronic, optical and transport properties of MoS2/graphene-based junctions

Research output: Contribution to journalResearch articleContributedpeer-review

Contributors

  • Mahdi Ghorbani-Asl - , University of Cambridge, Jacobs University Bremen, Helmholtz-Zentrum Dresden-Rossendorf (Author)
  • Paul D. Bristowe - , University of Cambridge (Author)
  • K. Koziol - , University of Cambridge (Author)
  • Thomas Heine - , Jacobs University Bremen, Leipzig University (Author)
  • Agnieszka Kuc - , Jacobs University Bremen, Leipzig University (Author)

Abstract

Electronic, optical and transport properties of the MoS2/graphene heterostructure have been investigated as function of applied uniaxial compression normal to the interface plane using first principles calculations and a non-equilibrium Green's function approach. The results show that a small compressive load (∼1 GPa) can open up the band gap (∼12 meV), reduce the optical absorption coefficient (∼7%), redshift the absorption spectrum, and create non-Ohmic I-V characteristics that depend on the magnitude of applied bias. This suggests that graphene/MoS2 heterostructure can be suitable for electromechanical and photomechanical devices where the electronic, optical and transport properties can be tuned by an appropriate application of bias and mechanical deformations.

Details

Original languageEnglish
Article number025018
Journal2D materials
Volume3
Issue number2
Publication statusPublished - 29 Apr 2016
Peer-reviewedYes
Externally publishedYes

Keywords

Keywords

  • DFT, Interlayer compression, MoS/graphene heterojunction, NEGF, Transport properties