Type-II Dirac cones and electron-phonon interaction in monolayer biphenylene from first-principles calculations

Peng-Fei Liu, Jingyu Li, Chi Zhang, Xin-Hai Tu, Junrong Zhang, Ping Zhang, Bao-Tian Wang, and David J. Singh
Phys. Rev. B 104, 235422 – Published 16 December 2021

Abstract

We report a first-principles investigation of electronic structure, topological bands, and electron-phonon interactions in metallic biphenylene sheets. Biphenylene is a recently synthesized sp2-bonded carbon allotrope. We find coupling of electrons at the Fermi surface to very high frequency carbon-derived phonons, analogous to superconducting MgB2. This leads to low-temperature weak coupling superconductivity due to an unusual combination of exceptionally large logarithmically averaged phonon frequency ωlog=1369 K and moderate electron-phonon coupling. The electronic structure shows a two-band Fermi surface dominated by C pz orbitals and a pair of type-II tilted Dirac cones along the Γ-Y line at the Brillouin zone boundary. Berry curvature and edge-state calculations show that monolayer biphenylene is a two-dimensional Z2 topological material. Thus, monolayer biphenylene is predicted to be a topological superconductor based on C p orbitals and high-frequency phonons.

  • Figure
  • Figure
  • Figure
  • Figure
  • Figure
  • Figure
  • Figure
2 More
  • Received 25 October 2021
  • Accepted 8 December 2021

DOI:https://doi.org/10.1103/PhysRevB.104.235422

©2021 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Peng-Fei Liu1,2, Jingyu Li3,4, Chi Zhang5, Xin-Hai Tu1,2, Junrong Zhang1,2, Ping Zhang6,7, Bao-Tian Wang1,2,8,*, and David J. Singh9,10

  • 1Institute of High Energy Physics, Chinese Academy of Sciences, Beijing 100049, China
  • 2Spallation Neutron Source Science Center, Dongguan 523803, China
  • 3Key Laboratory of Materials Physics, Institute of Solid State Physics, HFIPS, Chinese Academy of Sciences, Hefei 230031, China
  • 4Foshan (Southern China) Institute for New Materials, Foshan 528200, Guangdong, China
  • 5College of Electrical Engineering, Henan University of Technology, Zhengzhou 450001, China
  • 6School of Physics and Physical Engineering, Qufu Normal University, Qufu 273165, China
  • 7LCP, Institute of Applied Physics and Computational Mathematics, Beijing 100088, China
  • 8Collaborative Innovation Center of Extreme Optics, Shanxi University, Taiyuan, Shanxi 030006, China
  • 9Department of Physics and Astronomy, University of Missouri, Columbia, Missouri 65211, USA
  • 10Department of Chemistry, University of Missouri, Columbia, Missouri 65211, USA

  • *wangbt@ihep.ac.cn

Article Text (Subscription Required)

Click to Expand

References (Subscription Required)

Click to Expand
Issue

Vol. 104, Iss. 23 — 15 December 2021

Reuse & Permissions
Access Options
CHORUS

Article Available via CHORUS

Download Accepted Manuscript
Author publication services for translation and copyediting assistance advertisement

Authorization Required


×
×

Images

×

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
×