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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

Bilayer crystals, built by stacking crystalline monolayers, generate interlayer potentials that govern excitonic phenomena but are constrained by fixed covalent lattices and orientations. Replacing one layer with an atomically thin…

Twisted heterostructures of van der Waals materials have received much attention for their many remarkable properties. Here, we present a comprehensive theory of the long-range ordered magnetic phases of twisted bilayer $\alpha$-RuCl$_3$…

Materials Science · Physics 2023-10-20 Muhammad Akram , Jesse Kapeghian , Jyotirish Das , Roser Valenti , Antia S. Botana , Onur Erten

Two monolayers of graphene twisted by a small `magic' angle exhibit nearly flat bands leading to correlated electronic states and superconductivity, whose precise nature including possible broken symmetries, remain under debate. Here we…

Strongly Correlated Electrons · Physics 2019-12-13 Jong Yeon Lee , Eslam Khalaf , Shang Liu , Xiaomeng Liu , Zeyu Hao , Philip Kim , Ashvin Vishwanath

Motivated by recent studies on topologically non-trivial moir\'{e} bands in twisted bilayer transition metal dichalcogenides (TMDs), we study MoTe$_2$ bilayer systems subject to pressure, which is applied perpendicular to the material…

Mesoscale and Nanoscale Physics · Physics 2025-10-22 Miftah Hadi Syahputra Anfa , Sabri Elatresh , Hocine Bahlouli , Michael Vogl

The complete lattice-layer entanglement structure of Bernal stacked bilayer graphene is obtained for the quantum system described by a tight-binding Hamiltonian which includes mass and bias voltage terms. Through a suitable correspondence…

Mesoscale and Nanoscale Physics · Physics 2017-05-23 Victor A. S. V. Bittencourt , Alex. E. Bernardini

We study the optical response of the alternating twisted trilayer graphene by making use of a unitary transformation for the trilayer Hamiltonian and the Kubo formulation of linear response theory. The layer-resolved optical conductivities…

Mesoscale and Nanoscale Physics · Physics 2025-01-07 Dionisios Margetis , Guillermo Gómez-Santos , Tobias Stauber

In the era of 2D and quasi-2D quantum materials one needs to model strain at the level of the Hamiltonian as opposed to a semi-classical approach. Corrections to the electronic Hamiltonian due to strain arise from two sources: deformations…

Mesoscale and Nanoscale Physics · Physics 2025-06-24 R. Zemouri , A. R. Champagne , S. Maiti

Twisted double bilayer graphene (tDBLG) is a moir\'e material that has recently generated significant interest because of the observation of correlated phases near the magic angle. We carry out atomistic Hartree theory calculations to study…

At magic twisted angles, Dirac cones in twisted bilayer graphene (TBG) can evolve into flat bands, serving as a critical playground for the study of strongly correlated physics. When chiral symmetry is introduced, rigorous mathematical…

Strongly Correlated Electrons · Physics 2023-10-11 Fan Cui , Congcong Le , Qiang Zhang , Xianxin Wu , Jiangping Hu , Ching-Kai Chiu

The generalized tight-binding model, based on the subenvelope functions of distinct sublattices, is developed to investigate the magnetic quantization in sliding bilayer graphenes. The relative shift of two graphene layers induces a…

Materials Science · Physics 2016-11-18 Yao-Kung Huang , Szu-Chao Chen , Yen-Hung Ho , Chiun-Yan Lin , Ming-Fa Lin

The nature of correlated states in twisted bilayer graphene (TBG) at the magic angle has received intense attention in recent years. We present a numerical study of an interacting Bistritzer-MacDonald (IBM) model of TBG using a suite of…

We apply a multiscale modeling approach to study lattice reconstruction in marginally twisted bilayers of transition metal dichalcogenides (TMD). For this, we develop DFT-parametrized interpolation formulae for interlayer adhesion energies…

Mesoscale and Nanoscale Physics · Physics 2020-05-21 V. V. Enaldiev , V. Zólyomi , C. Yelgel , S. J. Magorrian , V. I. Fal'ko

The structural and electronic properties of twisted bilayer graphene are investigated from first principles and tight binding approach as a function of the twist angle (ranging from the first "magic" angle $\theta=1.08^\circ$ to…

Materials Science · Physics 2020-10-28 G. Cantele , D. Alfè , F. Conte , V. Cataudella , D. Ninno , P. Lucignano

We investigate an interesting interplay of destructive interference due to lattice geometry and band folding due to enlargement of the Brillouin zone in generating and subsequently modifying the band topology in a twisted bilayer…

Mesoscale and Nanoscale Physics · Physics 2025-08-27 Gourab Paul , Srijata Lahiri , Kuntal Bhattacharyya , Saurabh Basu

The interlayer couplings in commensurate and incommensurate bilayer structures of transition metal dichalcogenides are investigated with perturbative treatment. The interlayer coupling in \pm K valleys can be decomposed into a series of…

Mesoscale and Nanoscale Physics · Physics 2017-03-28 Yong Wang , Zhan Wang , Wang Yao , Gui-Bin Liu , Hongyi Yu

We study the electronic properties of twisted bilayers graphene in the tight-binding approximation. The interlayer hopping amplitude is modeled by a function, which depends not only on the distance between two carbon atoms, but also on the…

Mesoscale and Nanoscale Physics · Physics 2015-08-12 A. O. Sboychakov , A. L. Rakhmanov , A. V. Rozhkov , Franco Nori

Twisted multilayer systems, encompassing materials like twisted bilayer graphene (TBG), twisted trilayer graphene, and twisted bilayer transition metal dichalcogenides, have garnered significant attention in condensed matter physics.…

Materials Science · Physics 2025-06-23 Citian Wang , Huaqing Huang

We report the infrared transmission measurement on electrically gated twisted bilayer graphene. The optical absorption spectrum clearly manifests the dramatic changes such as the splitting of inter-linear-band absorption step, the shift of…

Materials Science · Physics 2019-11-11 Kwangnam Yu , Van Luan Nguyen , Tae Soo Kim , Jiwon Jeon , Jiho Kim , Pilkyung Moon , Young Hee Lee , E. J. Choi

We investigate twisted double bilayer graphene (TDBG), a four-layer system composed of two AB-stacked graphene bilayers rotated with respect to each other by a small angle. Our ab initio band structure calculations reveal a considerable…

Mesoscale and Nanoscale Physics · Physics 2020-04-22 Fatemeh Haddadi , QuanSheng Wu , Alex J. Kruchkov , Oleg V. Yazyev