Ground state properties of twisted multilayer graphene
ORAL
Abstract
Multi-layer Moiré materials offer a tunable platform for realizing electronic systems with strong electron correlations and topologically nontrivial states. We focus here on magic angle twisted bilayer and trilayer graphene, each exhibiting a flat band around the Fermi energy. In this work we determine the electronic properties of both platforms using an ab initio based, multi-million atomistic pz tight-binding model [1]. The electron-electron interactions are accounted for on the mean field level, using self-consistent Hartree-Fock (HF) method and realistic Coulomb matrix elements. The HF orbitals are obtained by expanding them in Bloch function for each sublattice containing a carbon atom in a unit cell and diagonalising the large Hamiltonian matrix for each allowed wavevector self-consistently. This enables us to determine the magnetic and topological properties of these systems as a function of the filling factor, interaction strength, vertical electric field and presence of an hBN substrate. From Berry curvature of HF orbitals we determine plausible conditions for the system to exhibit integer and fractional topological phases [2] and compare the bilayer and tri-layer results.
*AWR, DM, PH were supported by the AQC-004 project of the Applied Quantum Computing Program at the National Research Council of Canada, NSERC Discovery Grant No. RGPIN 2019-05714, NSERC Alliance Quantum Grant No. ALLRP/578466-2022, the QSP-078 project of the Quantum Sensors Program at the National Research Council of Canada, University of Ottawa Research Chair in Quantum Theory of Materials, Nanostructures, and Devices, and Digital Research Alliance Canada with computing resources.MB acknowledges support from the National Science Centre, Poland, under Grant No. 2021/43/D/ST3/01989.
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Publication:[1] A. Wania Rodrigues, M. Bieniek, P. Potasz, D. Miravet, R. Thomale, M. Korkusinski, and P. Hawrylak. Phys. Rev. B 109 (2024) [2] A. Wania Rodrigues, M. Bieniek, D. Miravet, and P. Hawrylak. In preparation (2024)