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We provide a systematic real space derivation of the continuum Hamiltonian for a graphene bilayer starting from a microscopic lattice theory, allowing for an arbitrary inhomogeneous smooth lattice deformation, including a twist. Two…

Strongly Correlated Electrons · Physics 2023-02-24 Oskar Vafek , Jian Kang

We provide a method for the generation of effective continuum Hamiltonians that goes beyond the well known k.p method in being equally effective in both high, and low (or no) symmetry situations. Our approach is based on a surprising exact…

Mesoscale and Nanoscale Physics · Physics 2019-07-10 N. Ray , F. Rost , D. Weckbecker , M. Vogl , S. Sharma , R. Gupta , O. Pankratov , S. Shallcross

Using the method developed in the companion paper, we construct the effective continuum theories for two different microscopic tight binding models of the twisted bilayer graphene at the twist angle of $1.05^\circ$, one Slater-Koster based…

Strongly Correlated Electrons · Physics 2023-02-24 Jian Kang , Oskar Vafek

We review the electronic properties of bilayer graphene, beginning with a description of the tight-binding model of bilayer graphene and the derivation of the effective Hamiltonian describing massive chiral quasiparticles in two parabolic…

Mesoscale and Nanoscale Physics · Physics 2013-04-23 Edward McCann , Mikito Koshino

In this paper we consider the interaction of electrons in bilayer graphene with a constant homogeneous magnetic field which is orthogonal to the bilayer surface. Departing from the energy eigenstates of the effective Hamiltonian, the…

Quantum Physics · Physics 2020-07-07 David J. Fernández C. , Dennis I. Martínez-Moreno

We derive electronic structure models for weakly interacting bilayers such as graphene-graphene and graphene-hexagonal boron nitride, based on density functional theory calculations followed by Wannier transformation of electronic states.…

Mesoscale and Nanoscale Physics · Physics 2016-06-28 Shiang Fang , Efthimios Kaxiras

One- and two-dimensional bilayer systems are examples of ultra-tunable quantum materials that are considered as the basis for the new generation of electronic and photonic devices. Here we develop a general theory of the electron band…

Mesoscale and Nanoscale Physics · Physics 2022-06-22 D. V. Chalin , D. I. Levshov , A. E. Myasnikova , S. B. Rochal

We consider the problem of numerically computing the quantum dynamics of an electron in twisted bilayer graphene. The challenge is that atomic-scale models of the dynamics are aperiodic for generic twist angles because of the…

Mathematical Physics · Physics 2024-02-27 Tianyu Kong , Diyi Liu , Mitchell Luskin , Alexander B. Watson

We address a simple but fundamental issue arising in the study of graphene, as well as of other systems that have a crystalline structure with more than one atom per unit cell. For these systems, the choice of the tight-binding basis is not…

Mesoscale and Nanoscale Physics · Physics 2010-04-15 Cristina Bena , Gilles Montambaux

We construct an analytic continuum model to describe the electronic structure and the electron-phonon interaction in twisted bilayer graphenes with arbitrary lattice deformation. Starting from the tight-binding model, we derive the…

Mesoscale and Nanoscale Physics · Physics 2020-05-20 Mikito Koshino , Nguyen N. T. Nam

We derive a material-realistic real-space many-body Hamiltonian for twisted bilayer graphene from first principles, including both single-particle hopping terms for $p_z$ electrons and long-range Coulomb interactions. By disentangling low-…

Mesoscale and Nanoscale Physics · Physics 2022-01-24 Tom Westerhout , Mikhail I. Katsnelson , Malte Rösner

We introduce a minimum tight-binding model with only three parameters extracted from graphene and untwisted bilayer graphene. This model reproduces quantitatively the electronic structure of not only these two systems and bulk graphite near…

Mesoscale and Nanoscale Physics · Physics 2018-09-12 Xianqing Lin , David Tománek

We describe a method for deriving effective low-energy theories of electronic interactions at graphene edges. Our method is applicable to general edges of honeycomb lattices (zigzag, chiral, and even disordered) as long as localized…

Strongly Correlated Electrons · Physics 2013-07-22 Manuel J. Schmidt , Michael Golor , Thomas C. Lang , Stefan Wessel

We present efficient angle-dependent low-energy Hamiltonians to describe the properties of the twisted bilayer graphene (tBLG) heterostructure, based on {\it ab initio} calculations of mechanical relxation and electronic structure. The…

Mesoscale and Nanoscale Physics · Physics 2019-08-02 Shiang Fang , Stephen Carr , Ziyan Zhu , Daniel Massatt , Efthimios Kaxiras

Twisted graphene bilayers show a complex electronic structure, further modified by interaction effects. The main features can be obtained from effective models, which make use a few phenomenological parameters. We analyze the influence of…

Strongly Correlated Electrons · Physics 2019-03-04 Niels R. Walet , Francisco Guinea

The electronic bands of twisted bilayer graphene (TBLG) with a large-period moir\'e superlattice fracture to form narrow Bloch minibands that are spectrally isolated by forbidden energy gaps from remote dispersive bands. When these gaps are…

Mesoscale and Nanoscale Physics · Physics 2020-10-28 Vo Tien Phong , E. J. Mele

Although the strongly interacting flat bands in twisted bilayer graphene (TBG) have been approached using the minimal Bistritzer-MacDonald (BM) Hamiltonian, there is mounting evidence that strain and lattice relaxation are essential in…

Mesoscale and Nanoscale Physics · Physics 2025-09-26 Jonah Herzog-Arbeitman , Jiabin Yu , Dumitru Călugăru , Haoyu Hu , Nicolas Regnault , Oskar Vafek , Jian Kang , B. Andrei Bernevig

Twisted bilayer graphene (TBLG) has emerged as an important platform for studying correlated phenomena, including unconventional superconductivity, in two-dimensional systems. The complexity of the atomic-scale structures in TBLG has made…

Strongly Correlated Electrons · Physics 2019-11-07 Stephen Carr , Shiang Fang , Hoi Chun Po , Ashvin Vishwanath , Efthimios Kaxiras

We introduce a complete physical model for the single-particle electronic structure of twisted bilayer graphene (tBLG), which incorporates the crucial role of lattice relaxation. Our model, based on $k \cdot p$ perturbation theory, combines…

Mesoscale and Nanoscale Physics · Physics 2019-08-14 Stephen Carr , Shiang Fang , Ziyan Zhu , Efthimios Kaxiras

We review analytical and numerical studies of correlated insulating states in twisted bilayer graphene, focusing on real-space lattice models constructions and their unbiased quantum many-body solutions. We show that by constructing…

Strongly Correlated Electrons · Physics 2021-01-12 Yuan Da Liao , Xiao Yan Xu , Zi Yang Meng , Jian Kang
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