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Related papers: Twisted bilayer graphene from first-principles: st…

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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 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

Tailoring the interlayer twist angle of bilayer graphene (BLG) has a significant influence on its electronic properties, including superconductivity, topological transitions, ferromagnetic states and correlated insulating states. These…

We present a multi-scale density functional theory (DFT) informed molecular dynamics and tight-binding (TB) approach to capture the interdependent atomic and electronic structures of twisted bilayer graphene. We calibrate the flat band…

Mesoscale and Nanoscale Physics · Physics 2022-03-17 Nicolas Leconte , Srivani Javvaji , Jiaqi An , Appalakondaiah Samudrala , Jeil Jung

Motivated by recent experiments probing the wavefunctions of magic-angle twisted bilayer graphene (tBLG), we perform large-scale first-principles calculations of tBLG with full atomic relaxation across a wide range of twist angles down to…

Mesoscale and Nanoscale Physics · Physics 2026-02-16 Albert Zhu , Daniel Bennett , Daniel T. Larson , Mohammed M. Al Ezzi , Efstratios Manousakis , Efthimios Kaxiras

A major hurdle in understanding the phase diagram of twisted bilayer graphene (TBLG) are the roles of lattice relaxation and electronic structure on isolated band flattening near magic twist angles. In this work, the authors develop an…

Mesoscale and Nanoscale Physics · Physics 2024-03-28 Shivesh Pathak , Tawfiqur Rakib , Run Hou , Andriy Nevidomskyy , Elif Ertekin , Harley T. Johnson , Lucas K. Wagner

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

Twisted bilayer graphene displays many fascinating properties that can be tuned by varying the relative angle (also called twist angle) between its monolayers. As a remarkable feature, both the electronic flat bands and the corresponding…

Materials Science · Physics 2022-05-06 V. Hung Nguyen , Trinh X. Hoang , J. -C. Charlier

Twisted bilayer graphene (tBLG) provides us with a large rotational freedom to explore new physics and novel device applications, but many of its basic properties remain unresolved. Here we report the synthesis and systematic Raman study of…

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 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 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

Twisted bilayer graphene (TBG) exhibits a wide range of intriguing physical properties, such as superconductivity, ferromagnetism, and superlubricity. Depending on the twist angle, periodic moir\'e superlattices form in twisted bilayer…

Mesoscale and Nanoscale Physics · Physics 2022-06-07 Vahid Morovati , Zhiming Xue , Kenneth M. Liechti , Rui Huang

Twisted bilayer materials have attracted tremendous attention due to their unique and novel properties. Here, we derive a thermodynamic model for twisted bilayer graphene (tBLG) within the framework of the classical statistical mechanics,…

Mesoscale and Nanoscale Physics · Physics 2021-11-09 Weidong Yan , Langquan Shui , Wengen Ouyang , Ze Liu

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

In twisted bilayer graphene (TBLG), extremely small deviations from the magic twist angle $\theta_m{\approx}1.08^\circ$ change its electronic structure near the Fermi level drastically, causing a meV-wide flat band to appear or disappear.…

Mesoscale and Nanoscale Physics · Physics 2018-11-26 Xianqing Lin , Dan Liu , David Tománek

Twisted bilayer graphene with a twist angle of around 1.1{\deg} features a pair of isolated flat electronic bands and forms a strongly correlated electronic platform. Here, we use scanning tunneling microscopy to probe local properties of…

Twisted bilayer graphene (tBLG) provides a fascinating platform for engineering flat bands and inducing correlated phenomena. By designing the stacking architecture of graphene layers, twisted multilayer graphene can exhibit different…

This work investigates the electronic properties of twisted bilayer graphene (TBG) through computational calculations, with the aim of understanding the emergence of flat bands and conditions favorable for superconductivity close to the…

Mesoscale and Nanoscale Physics · Physics 2026-01-21 Rajendra Paudel , Nabin Upadhya Dhakal , Nurapati Pantha

Staking layered materials revealed to be a very powerful method to tailor their electronic properties. It has indeed been theoretically and experimentally shown that twisted bilayers of graphene (tBLG) with a rotation angle $\theta$,…

Mesoscale and Nanoscale Physics · Physics 2020-07-01 Omid Faizy Namarvar , Ahmed Missaoui , Laurence Magaud , Didier Mayou , Guy Trambly de Laissardière
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