Location via proxy:   [ UP ]  
[Report a bug]   [Manage cookies]                

Chemically exfoliated MoS2 layers: Spectroscopic evidence for the semiconducting nature of the dominant trigonal metastable phase

Banabir Pal, Anjali Singh, Sharada G., Pratibha Mahale, Abhinav Kumar, S. Thirupathaiah, H. Sezen, M. Amati, Luca Gregoratti, Umesh V. Waghmare, and D. D. Sarma
Phys. Rev. B 96, 195426 – Published 20 November 2017
PDFHTMLExport Citation

Abstract

A metastable trigonal phase, existing only as small patches on a chemically exfoliated few-layered, thermodynamically stable 1H phase of MoS2, is believed to critically influence the properties of MoS2-based devices. The electronic structure of this metastable phase is little understood in the absence of a direct experimental investigation of its electronic properties, complicated further by conflicting claims from theoretical investigations. We address this issue by investigating the electronic structure of this minority phase in chemically exfoliated MoS2 few-layered systems by enhancing its contributions with the use of highly spatially resolved (120 nm resolution) photoemission spectroscopy and Raman spectroscopy in conjunction with state-of-the-art electronic structure calculations. Based on these results, we establish that the ground state of this phase, arrived at by the chemical exfoliation of MoS2 using the usual Li intercalation technique, is a small gap (90±40meV) semiconductor in contrast to most claims in the literature; we also identify the specific trigonal structure it has among many suggested ones.

  • Figure
  • Figure
  • Figure
  • Figure
  • Received 27 July 2017
  • Revised 19 October 2017

DOI:https://doi.org/10.1103/PhysRevB.96.195426

©2017 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Banabir Pal1, Anjali Singh2, Sharada G.1, Pratibha Mahale1, Abhinav Kumar1, S. Thirupathaiah1, H. Sezen3, M. Amati3, Luca Gregoratti3, Umesh V. Waghmare2, and D. D. Sarma1,*

  • 1Solid State and Structural Chemistry Unit, Indian Institute of Science, Bengaluru 560012, India
  • 2Jawaharlal Nehru Centre for Advanced Scientific Research, Jakkur, Bengaluru 560064, India
  • 3Elettra-Sincrotrone Trieste S.C.p.A., SS14, km 163.5 in AREA Science Park, 34149 Basovizza, Trieste, Italy

  • *Also at Jawaharlal Nehru Centre for Advanced Scientific Research, Jakkur, Bengaluru, India; sarma@sscu.iisc.ernet.in

Article Text (Subscription Required)

Click to Expand

Supplemental Material (Subscription Required)

Click to Expand

References (Subscription Required)

Click to Expand
Issue

Vol. 96, Iss. 19 — 15 November 2017

Reuse & Permissions
Access Options
Author publication services for translation and copyediting assistance advertisement

Authorization Required


×

Images

  • Figure 1
    Figure 1

    Top view of MoS2:1H, 1T, and various distorted 1T structures (1T, 1T, and 1T). 1T can be described in terms of two different unit cells corresponding to 2a×a and 3a×a supercells. The unit cells are enclosed by solid lines.

    Reuse & Permissions
  • Figure 2
    Figure 2

    Room-temperature Raman spectra from different spots on (a) pure 1H (meMoS2) and (b) mixed phase (ceMoS2) samples.

    Reuse & Permissions
  • Figure 3
    Figure 3

    Spectral features and intensity maps of the Mo 3d region from samples investigated. (a) Mo 3d spectra of the meMoS2 sample (blue dots), representing the pure 1H signal, and ceMoS2 sample (black open circles), representing a combination of signals from the stable 1H and the metastable trigonal phase. (b) Map of Mo 3d5/2 signal intensity over the energy range of 228–230 eV in the ceMoS2 sample. (c) Map of the intensity ratio I/II over respective energy windows shown in (a) for the total intensity map in (b). (d) Mo 3d spectrum (open circles) from the ceMoS2 sample and the fitting of this spectrum (solid line) with two contributions (dashed and dotted lines). The S 2s contribution is also shown.

    Reuse & Permissions
  • Figure 4
    Figure 4

    Experimentally and theoretically obtained valence band spectra from pure 1H (meMoS2 sample), mixed phase (ceMoS2 sample), and contributions from the metastable phase alone. (a) Experimental (blue open triangle) and calculated (dashed-dotted line) valence band spectra of the pure 1H sample along with the partial densities of states of Mo 4d (solid line) and S 3p (dotted line) states. (b) Contributions from the pure 1H phase (blue open triangles) and the substrate (black solid line) were subtracted from the total valence band spectrum of the mixed phase sample (green open squares) to obtain the spectral features (red open circles) of the metastable phase. The inset shows a comparison between valence band spectra of mixed phase (ceMoS2, solid line) and pure 1H (meMoS2, circles) samples near the Fermi energy (EF), exhibiting negligible intensity at EF. (c) Experimentally obtained spectral features of the metastable phase (red open circles) compared with that obtained from the calculation of the electronic structure of the metastable 1T phase of MoS2 (dashed-dotted line) along with the partial densities of states of Mo 4d (solid line) and S 3p (dotted line) states from GW calculations.

    Reuse & Permissions
×

Sign up to receive regular email alerts from Physical Review B

Log In

Cancel
×

Search


Article Lookup

Paste a citation or DOI

Enter a citation
×