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We investigate the effects of lithium intercalation in twisted bilayers of graphene, using first-principles electronic structure calculations. To model this system we employ commensurate supercells that correspond to twist angles of…

Mesoscale and Nanoscale Physics · Physics 2020-02-11 Daniel T. Larson , Stephen Carr , Georgios A. Tritsaris , Efthimios Kaxiras

We study thermal fluctuations of a free-standing bilayer graphene subject to vanishing external tension. Within a phenomenological theory, the system is described as a stack of two continuum crystalline membranes, characterized by finite…

Mesoscale and Nanoscale Physics · Physics 2020-12-01 Achille Mauri , David Soriano , Mikhail I. Katsnelson

Twisted bilayer graphene (TBG) features strongly correlated and topological phases due to its flat bands emerging near the magic angle. However, the effects of the non-Hermiticity, arising from the coupling to the environment and…

Mesoscale and Nanoscale Physics · Physics 2025-06-06 Juan Pablo Esparza , Vladimir Juricic

We investigate correlated insulating states in magic-angle twisted bilayer graphene (TBG) by the exact diagonalization method applied to the extended Hubbard model with interaction parameters recently evaluated in the realistic effective…

Strongly Correlated Electrons · Physics 2018-08-08 Masayuki Ochi , Mikito Koshino , Kazuhiko Kuroki

By comparing with recently available experimental data from several groups, we critically discuss the manifestation of continuum many body interaction effects in twisted bilayer graphene (tBLG) with small twist angles and low carrier…

Mesoscale and Nanoscale Physics · Physics 2020-06-02 Sankar Das Sarma , Fengcheng Wu

Twisted bilayer graphene (tBLG) has recently emerged as a new platform for studying electron correlations, the strength of which can be controlled via the twist angle. Here, we study the effect of internal screening on electron-electron…

Strongly Correlated Electrons · Physics 2019-12-18 Zachary A. H. Goodwin , Fabiano Corsetti , Arash A. Mostofi , Johannes Lischner

The recently demonstrated unconventional superconductivity in twisted bilayer graphene (tBLG) opens the possibility for interesting applications of two-dimensional layers that involve correlated electron states. Here we explore the…

Mesoscale and Nanoscale Physics · Physics 2018-08-30 Stephen Carr , Shiang Fang , Pablo Jarillo-Herrero , Efthimios Kaxiras

We present electronic structure calculations of twisted double bilayer graphene (TDBG): A tetralayer graphene structure composed of two AB-stacked graphene bilayers with a relative rotation angle between them. Using first-principles…

Mesoscale and Nanoscale Physics · Physics 2019-11-05 F. J. Culchac , Rodrigo B. Capaz , Leonor Chico , E. Suarez Morell

We compute the phase diagram of twisted bilayer graphene near the magic angle where the occurrence of flat bands enhances the effects of electron-electron interactions and thus unleashes strongly-correlated phenomena. Most importantly, we…

Strongly Correlated Electrons · Physics 2018-12-26 Dante M. Kennes , Johannes Lischner , Christoph Karrasch

We review the theoretical modelling of moir\'e materials, focusing on various aspects of magic-angle twisted bilayer graphene (MA-TBG) viewed through the lens of Hartree-Fock mean-field theory. We first provide an elementary introduction to…

Strongly Correlated Electrons · Physics 2026-03-20 Yves H. Kwan , Ziwei Wang , Glenn Wagner , Nick Bultinck , Steven H. Simon , Siddharth A. Parameswaran

Twisted bilayer graphene is an exciting platform for exploring correlated quantum phases, extremely tunable with respect to both the single-particle bands and the interaction profile of electrons. Here, we investigate the phase diagram of…

Strongly Correlated Electrons · Physics 2023-12-08 Nikita Astrakhantsev , Glenn Wagner , Tom Westerhout , Titus Neupert , Mark H. Fischer

Ferromagnetism and superconductivity typically compete with each other since the internal magnetic field generated in a magnet suppresses the formation of spin-singlet Cooper pairs in conventional superconductors. Only a handful of…

Mesoscale and Nanoscale Physics · Physics 2020-07-09 Xiaomeng Liu , Zeyu Hao , Eslam Khalaf , Jong Yeon Lee , Kenji Watanabe , Takashi Taniguchi , Ashvin Vishwanath , Philip Kim

This study theoretically investigates the contact conductance in twisted bilayer graphene (TBG), providing a theoretical explanation for recent experimental observations from scanning tunneling microscopy (STM) and conductive atomic force…

Mesoscale and Nanoscale Physics · Physics 2025-06-30 Kevin J. U. Vidarte , Caio Lewenkopf , F. Crasto de Lima , R. Hiroki Miwa , Felipe Pérez Riffo , Eric Suárez Morell

We present a theoretical study of the local optical conductivity, plasmon spectra, and thermoelectric properties of twisted bilayer graphene (TBG) at different filling factors and twist angles $\theta$. Our calculations are based on the…

Mesoscale and Nanoscale Physics · Physics 2020-09-04 Pietro Novelli , Iacopo Torre , Frank H. L. Koppens , Fabio Taddei , Marco Polini

Magic-angle twisted bilayer graphene has recently become a thriving material platform realizing correlated electron phenomena taking place within its topological flat bands. Several numerical and analytical methods have been applied to…

Strongly Correlated Electrons · Physics 2021-09-17 Bin-Bin Chen , Yuan Da Liao , Ziyu Chen , Oskar Vafek , Jian Kang , Wei Li , Zi Yang Meng

Flat electronic bands, characteristic of magic-angle twisted bilayer graphene (TBG), host a wealth of correlated phenomena. Early theoretical considerations suggested that, at the magic angle, the Dirac velocity vanishes and the entire…

The emergence of alternating twist multilayer graphene (ATMG) as a generalization of twisted bilayer graphene (TBG) raises the question - in what important ways do these systems differ? Here, we utilize ab-initio relaxation and…

Strongly Correlated Electrons · Physics 2021-11-24 Patrick J. Ledwith , Eslam Khalaf , Ziyan Zhu , Stephen Carr , Efthimios Kaxiras , Ashvin Vishwanath

A series of recent experiments have demonstrated robust superconductivity in magic-angle twisted trilayer graphene (TTG). In particular, a recent work by Cao et al. (arxiv:2103.12083) studies the behavior of the superconductor in an…

Superconductivity · Physics 2021-11-17 Ethan Lake , T. Senthil

Lattice relaxation profoundly reshapes electronic structures in twisted materials. Prevailing treatments, however, typically rely on large-scale density functional theory (DFT), which is computationally costly and mechanistically opaque.…

Materials Science · Physics 2025-09-17 Junxi Yu , Bingbing Wang , Cheng-Cheng Liu

We present a novel approach to achieve spatial variations in the degree of non-covalent functionalization of twisted bilayer graphene (tBLG). The tBLG with twist angles varying between ~ 5{\deg} and 7{\deg} was non-covalently functionalized…

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