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We present a three-band tight-binding (TB) model for describing the low-energy physics in monolayers of group-VIB transition metal dichalcogenides $MX_2$ ($M$=Mo, W; $X$=S, Se, Te). As the conduction and valence band edges are predominantly…

Materials Science · Physics 2014-03-07 Gui-Bin Liu , Wen-Yu Shan , Yugui Yao , Wang Yao , Di Xiao

We study theoretically the effects of short-range electron-electron interactions on the electronic structure of graphene, in the presence of single substitutional impurities. Our computational approach is based on the $\pi$ orbital…

Mesoscale and Nanoscale Physics · Physics 2015-11-30 Faluke Aikebaier , Anna Pertsova , Carlo M. Canali

A computational method is developed whereby the reflectivity of low-energy electrons from a surface can be obtained from a first-principles solution of the electronic structure of the system. The method is applied to multilayer graphene.…

Mesoscale and Nanoscale Physics · Physics 2014-01-21 R. M. Feenstra , M. Widom

We investigate the electronic structure of alternating-twist triple Bernal-stacked bilayer graphene (t3BG) as a function of interlayer coupling $\omega$, twist angle $\theta$, interlayer potential difference $\Delta$, and top-bottom…

Mesoscale and Nanoscale Physics · Physics 2022-06-22 Jiseon Shin , Bheema Lingam Chittari , Yunsu Jang , Hongki Min , Jeil Jung

We present self-consistent calculations of electron transport in graphene nanoconstrictions within the Hartree approximation. We consider suspended armchair ribbons with V-shaped constrictions having perfect armchair or zigzag edges as well…

Mesoscale and Nanoscale Physics · Physics 2012-06-20 S. Ihnatsenka , G. Kirczenow

The eigenstates of an electron in the chiral two-dimensional electron gas (C2DEG) formed in an AB-stacked bilayer or an ABC-stacked trilayer graphene is a spinor with $4$ or $6$ components respectively. These components give the amplitude…

Mesoscale and Nanoscale Physics · Physics 2014-01-08 R. Côté , Manuel Barrette

We present electronic transport measurements through short and narrow (30x30 nm) single layer graphene constrictions on a hexagonal boron nitride substrate. While the general observation of Coulomb-blockade is compatible with earlier work,…

Mesoscale and Nanoscale Physics · Physics 2015-01-30 Dominik Bischoff , Florian Libisch , Joachim Burgdörfer , Thomas Ihn , Klaus Ensslin

Proximity effect is a very powerful approach and has been widely applied to induce electron correlations such as: superconductivity, magnetism and spin-orbit effects at the interface of heterostructure quantum materials. However, proximity…

We present a model for interacting electrons in a continuum band structure that resembles a ``trashcan'', with a flat bottom of radius $k_b$ beyond which the dispersion increases rapidly with velocity $v$. The form factors of the Bloch…

Strongly Correlated Electrons · Physics 2025-03-14 B. Andrei Bernevig , Yves H. Kwan

We introduce twisted trilayer graphene (tTLG) with two independent twist angles as an ideal system for the precise tuning of the electronic interlayer coupling to maximize the effect of correlated behaviors. As established by experiment and…

Mesoscale and Nanoscale Physics · Physics 2020-10-12 Ziyan Zhu , Stephen Carr , Daniel Massatt , Mitchell Luskin , Efthimios Kaxiras

We study the properties of flat-bands that appear in a heterostructure composed of strands of different widths of graphene armchair nanoribbons. One of the flat-bands is reminiscent of the one that appears in pristine armchair nanoribbons…

Mesoscale and Nanoscale Physics · Physics 2022-02-18 P. A. Almeida , L. S. Sousa , Tome M. Schmidt , G. B. Martins

We present a tight-binding parametrization for penta-graphene that correctly describes its electronic band structure and linear optical response. The set of parameters is validated by comparing to ab-initio density functional theory…

Materials Science · Physics 2020-12-25 Sergio Bravo , J. D. Correa , Leonor Chico , M. Pacheco

We studied formation of charge density wave between valleys in a system with a double-well-like dispersive valence band relevant for the rhombohedral graphene trilayer. In a regime with 2 Fermi surfaces, electron- and hole-like: one of…

Strongly Correlated Electrons · Physics 2025-09-16 Igor V. Blinov

Motivated by the recent experimental discovery of superconductivity in rhombohedral tetralayer graphene, we investigate the pairing mechanism arising from the density-density interactions within the random-phase approximation. This approach…

Superconductivity · Physics 2026-04-21 Qiong Qin , Congjun Wu

We investigate the electronic and optical properties of lateral heterostructures made of alternated armchair ribbons of graphene and hexagonal boron nitride. It is known that the gapwidth of these heterostructures can be classified into…

Materials Science · Physics 2026-01-22 Elisa Serrano Richaud , Sylvain Latil , Lorenzo Sponza

Chromium triiodide is an intrinsically magnetic van der Waals material down to the single-layer limit. Here, we provide a first-principles description of finite-temperature magnetic and spectral properties of monolayer (ML) CrI$_3$ based on…

Strongly Correlated Electrons · Physics 2022-05-24 Yaroslav O. Kvashnin , Alexander N. Rudenko , Patrik Thunström , Malte Rösner , Mikhail I. Katsnelson

We develop a microscopic theory for plasmon excitations of graphene/${\alpha}$-RuCl${_3}$ heterostructures. Within a Kondo-Kitaev model with various interactions, a heavy Fermi liquid hosting flat bands emerges in which the itinerant…

Strongly Correlated Electrons · Physics 2021-07-29 Hui-Ke Jin , J. Knolle

Rhombohedral multilayer graphene, with its flat electronic bands and concentrated Berry curvature, is a promising material for the realization of correlated topological phases of matter. When aligned to an adjacent hexagonal boron nitride…

Mesoscale and Nanoscale Physics · Physics 2025-09-16 Samuel H. Aronson , Tonghang Han , Zhengguang Lu , Yuxuan Yao , Kenji Watanabe , Takashi Taniguchi , Long Ju , Raymond C. Ashoori

Berry phase is one of the key elements to understand quantum-mechanical phenomena such as the Aharonov-Bohm effect and the unconventional Hall effect in graphene. The Berry phase in monolayer and bilayer graphene has been manifested by the…

Materials Science · Physics 2024-08-15 Hayoon Im , Sue Hyeon Hwang , Minhee Kang , Kyoo Kim , Haeyong Kang , Choongyu Hwang

We construct a microscopic model based on superexchange theory for a moir\'e bilayer in chromium trihalides (Cr$X_3$, $X=$Br, I). In particular, we derive analytically the interlayer Heisenberg exchange and the interlayer…

Mesoscale and Nanoscale Physics · Physics 2023-06-27 Kok Wee Song