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

Goodwin, Z. A. H., Klebl, L., Vitale, V., Liang, X., Gogtay, V., van Gorp, X., et al. (2021). Flat bands, electron interactions, and magnetic order in magic-angle mono-trilayer graphene. Physical Review Materials, 5(8): 084008. doi:10.1103/PhysRevMaterials.5.084008.

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PhysRevMaterials.5.084008.pdf (Publisher version), 12MB
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PhysRevMaterials.5.084008.pdf
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2021
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© American Physical Society

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https://arxiv.org/abs/2105.12641 (Preprint)
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 Creators:
Goodwin, Z. A. H.1, Author
Klebl, L.2, Author
Vitale, V.1, Author
Liang, X.1, Author
Gogtay, V.1, Author
van Gorp, X.1, Author
Kennes, D. M.2, 3, 4, Author           
Mostofi, A. A.1, Author
Lischner, J.1, Author
Affiliations:
1Departments of Materials and Physics and the Thomas Young Centre for Theory and Simulation of Materials, Imperial College London, ou_persistent22              
2Institute for Theory of Statistical Physics, RWTH Aachen University, and JARA Fundamentals of Future Information Technology, ou_persistent22              
3Theory Group, Theory Department, Max Planck Institute for the Structure and Dynamics of Matter, Max Planck Society, ou_2266715              
4Center for Free Electron Laser Science, ou_persistent22              

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 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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Language(s): eng - English
 Dates: 2021-07-192021-06-092021-07-272021-08-24
 Publication Status: Published online
 Pages: -
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 Table of Contents: -
 Rev. Type: Peer
 Identifiers: arXiv: 2105.12641
DOI: 10.1103/PhysRevMaterials.5.084008
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Project name : Z.A.H.G. was supported through a studentship at the Centre for Doctoral Training on Theory and Simulation of Materials at Imperial College London funded by the EPSRC (Grant No. EP/L015579/1). We acknowledge funding from EPSRC Grant No. EP/S025324/1 and the Thomas Young Centre under Grant No. TYC-101. We acknowledge the Imperial College London Research Computing Service (DOI:10.14469/hpc/2232) for the computational resources used in carrying out this work. The Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) is acknowledged for support through RTG 1995, within the Priority Program SPP 2244 2DMP and under Germany's Excellence Strategy-Cluster of Excellence Matter and Light for Quantum Computing (ML4Q) EXC2004/1 - 390534769. We acknowledge support from the Max Planck-New York City Center for Non-Equilibrium Quantum Phenomena. Spin susceptibility calculations were performed with computing resources granted by RWTH Aachen University under projects rwth0496 and rwth0589.
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Title: Physical Review Materials
  Abbreviation : Phys. Rev. Mater.
Source Genre: Journal
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Publ. Info: College Park, MD : American Physical Society
Pages: - Volume / Issue: 5 (8) Sequence Number: 084008 Start / End Page: - Identifier: ISSN: 2475-9953
CoNE: https://pure.mpg.de/cone/journals/resource/2475-9953