Air-Stable Monolayer Cu<sub>2</sub>Se Exhibits a Purely Thermal Structural Phase Transition

ORAL

Abstract

Materials possessing structural phase transformations exhibit a rich set of physical and chemical properties that can be used for various applications. However, stoichiometry-preserving, purely thermal, reversible phase transitions have not been observed. Here, we report a purely thermal structural phase transition in a new 2D material, monolayer Cu2Se by using scanning tunneling microscopy, scanning transmission electron microscopy, and density functional theory (DFT) calculations. DFT calculations trace the phase-transition mechanism via the existence/absence of imaginary (unstable) phonon modes at low and high temperatures. In addition, DFT calculations show that a degeneracy at the Γ point of the energy bands of the high-temperature phase is lifted in the low-temperature phase, confirmed by the angle resolved photoemission spectra. The variable-temperature low-energy electron diffraction patterns indicate that the phase transition occurs across the whole sample at ≈147 K. This work provides a new platform for future investigations of such phase transitions in 2D materials. [Adv. Mater. 32, 1908314, (2020)]

*This work was supported by grants from the National Natural Science Foundation of China, the Chinese Academy of Sciences and the U.S. Department of Energy through grant.

Presenters

  • Yang Song

    • Institute of Physics, Chinese Academy of Sciences

Authors

  • Yang Song

    • Institute of Physics, Chinese Academy of Sciences
  • Kai Qian

    • Institute of Physics, Chinese Academy of Sciences
  • Lei Gao

    • Institute of Physics, Chinese Academy of Sciences
  • Xiya Chen

    • Institute of Physics, Chinese Academy of Sciences
  • Yu-Yang Zhang

    • Chinese Academy of Sciences,Institute of Physics
    • University of Chinese Academy of Sciences
    • Institute of Physics and University of Chinese Academy of Sciences, Chinese Academy of Sciences, Beijing 100190, China
    • School of physical sciences, Institute of Physics and University of Chinese Academy of Sciences
    • Institute of Physics, Chinese Academy of Sciences
    • Institute of Physics & University of Chinese Academy of Sciences, Chinese Academy of Sciences
  • Xiao Lin

    • Institute of Physics, Chinese Academy of Sciences
  • Shixuan Du

    • Chinese Academy of Sciences,Institute of Physics
    • Institute of Physics and University of Chinese Academy of Sciences, Chinese Academy of Sciences, Beijing 100190, China
    • School of physical sciences, Institute of Physics and University of Chinese Academy of Sciences
    • Institute of Physics, Chinese Academy of Sciences
    • Chinese Academy of Science
    • Chinese Academy of Sciences, Institute of Physics
    • Institute of Physics & University of Chinese Academy of Sciences, Chinese Academy of Sciences
  • Min Ouyang

    • Institute of High Energy Physics, Chinese Academy of Sciences
    • University of Maryland
  • Sokrates T Pantelides

    • Department of Physics and Engineering, Vanderbilt University
    • Department of Physics and Astronomy, Vanderbilt Univ
    • Department of Physics and Astronomy, Vanderbilt University
    • Vanderbilt Univ
    • Department of Physics and Astronomy, Vanderbilt University, Nashville, TN 37235, USA
    • Institute of Physics, Chinese Academy of Sciences
    • Department of Physics and Astronomy & Department of Electrical Engineering and Computer Science, Vanderbilt University
    • Department of Physics and Astronomy and Department of Electrical Engineering and Computer Science, Vanderbilt University, Nashville, TN
    • Department of Electrical Engineering and Computer Science, Vanderbilt University
    • Department of Physics and Astronomy and Department of Electrical Engineering and Computer Science, Vanderbilt University
    • Vanderbilt University
  • Hongjun Gao

    • Chinese Academy of Sciences,Institute of Physics
    • Institute of Physics, Chinese Academy of Sciences
    • Chinese Academy of Sciences, Institute of Physics