Flat bands, electron interactions, and magnetic order in magic-angle mono-trilayer graphene

Zachary A. H. Goodwin, Lennart Klebl, Valerio Vitale, Xia Liang, Vivek Gogtay, Xavier van Gorp, Dante M. Kennes, Arash A. Mostofi, and Johannes Lischner
Phys. Rev. Materials 5, 084008 – Published 24 August 2021

Abstract

Starting with twisted bilayer graphene, graphene-based moiré materials have recently been established as a new platform for studying strong electron correlations. In this paper, we study twisted graphene monolayers on trilayer graphene and demonstrate that this system can host flat bands when the twist angle is close to the magic angle of 1.16. When monolayer graphene is twisted on ABA trilayer graphene, the flat bands are not isolated, but are intersected by a Dirac cone with a large Fermi velocity. In contrast, graphene twisted on ABC trilayer graphene (denoted AtABC) exhibits a gap between flat and remote bands. Since ABC trilayer graphene and twisted bilayer graphene are known to host broken-symmetry phases, we further investigate the ostensibly similar magic-angle AtABC system. We study the effect of electron-electron interactions in AtABC using both Hartree theory and an atomic Hubbard theory to calculate the magnetic phase diagram as a function of doping, twist angle, and perpendicular electric field. Our analysis reveals a rich variety of magnetic orderings, including ferromagnetism and ferrimagnetism, and demonstrates that a perpendicular electric field makes AtABC more susceptible to magnetic ordering.

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  • Received 9 June 2021
  • Revised 19 July 2021
  • Accepted 27 July 2021

DOI:https://doi.org/10.1103/PhysRevMaterials.5.084008

©2021 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Zachary A. H. Goodwin1,*, Lennart Klebl2,*, Valerio Vitale1, Xia Liang1, Vivek Gogtay1, Xavier van Gorp1, Dante M. Kennes2,3, Arash A. Mostofi1, and Johannes Lischner1

  • 1Departments of Materials and Physics and the Thomas Young Centre for Theory and Simulation of Materials, Imperial College London, South Kensington Campus, London SW7 2AZ, United Kingdom
  • 2Institute for Theory of Statistical Physics, RWTH Aachen University, and JARA Fundamentals of Future Information Technology, 52062 Aachen, Germany
  • 3Max Planck Institute for the Structure and Dynamics of Matter, Center for Free Electron Laser Science, Luruper Chaussee 149, 22761 Hamburg, Germany

  • *These authors contributed equally to this work.

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Vol. 5, Iss. 8 — August 2021

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