Related papers: Efficient simulation of moire materials using the …
The discovery of superconducting and insulating states in magic angle twisted bilayer graphene (MATBG) has ignited considerable interest in understanding the nature of electronic interactions in this chemically pristine material system. The…
Density matrix renormalization group (DMRG) is one of the most powerful numerical methods available for many-body systems. In this work, we develop a perturbation theory of DMRG (PT-DMRG) to largely increase its accuracy in an extremely…
Close to a magical angle, twisted bilayer graphene (TBLG) systems exhibit isolated flat electronic bands and, accordingly, strong electron localization. TBLGs have hence been ideal platforms to explore superconductivity, correlated…
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…
When the perpendicular magnetic flux per unit cell in a crystal is equal to the quantum of magnetic flux, $\Phi_0=h/e$, we enter the 'Hofstadter regime'. The large unit cell of moir\'e materials like magic-angle twisted bilayer graphene…
We demonstrate how to parallelize the density matrix renormalization group (DMRG) algorithm in real space through a straightforward modification of serial DMRG. This makes it possible to apply at least an order of magnitude more…
We consider the superconducting and Mott-insulating states for the twisted bilayer graphene, modeled as two narrow-band system of electrons with appreciable intraatomic Coulomb interactions. The interaction induces kinetic exchange which…
In this article, we analyse the Bistritzer--MacDonald (BM) model (also known as the continuum model) of twisted bilayer graphene (TBG) with an additional external magnetic field. We provide an explicit semiclassical asymptotic expansion of…
Based on the contractor renormalization group (CORE) method and the density matrix renormalization group (DMRG) method, a new computational scheme, which is called the block density matrix renormalization group with effective interactions…
A numerical approach to ground-state dynamical correlation functions from Density Matrix Renormalization Group (DMRG) is developed. Using sum rules, moments of a dynamic correlation function can be calculated with DMRG, and with the moments…
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…
In this work we address the re-entrance of magic-angle phenomena (band flatness and quantum-geometric transport) in twisted bilayer graphene (TBG) subjected to strong magnetic fluxes $\pm \Phi_0$, $\pm 2 \Phi_0$, $\pm 3 \Phi_0$... ($\Phi_0…
Determining the symmetry breaking order of correlated quantum phases is essential for understanding the microscopic interactions in their host systems. The flat bands in magic angle twisted bilayer graphene (MATBG) provide an especially…
The flat electronic bands in magic-angle twisted bilayer graphene (MATBG) host a variety of correlated insulating ground states, many of which are predicted to support charged excitations with topologically non-trivial spin and/or valley…
Twisted bilayer graphene (TBLG) has recently emerged as a versatile platform for studying a variety of exotic transport phenomena. Here, we present a theoretical study of near-field thermal radiation between suspended TBLG with a focus on…
The discovery of magic-angle twisted trilayer graphene (tTLG) adds a new twist to the family of graphene moir\'e. The additional graphene layer unlocks a series of intriguing properties in the superconducting phase, such as the violation of…
The Kato-Bloch perturbation formalism is used to present a density-matrix renormalization-group (DMRG) method for strongly anisotropic two-dimensional systems. This method is used to study Heisenberg chains weakly coupled by the transverse…
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…
We present a theoretical investigation of the magnetic properties exhibited by twisted bilayer graphene (TBG) systems with small twist angles, where the appearance of flat minibands strongly enhances electron-electron interaction effects.…
During the past 15 years, the density matrix renormalization group (DMRG) has become increasingly important for ab initio quantum chemistry. The underlying matrix product state (MPS) ansatz is a low-rank decomposition of the full…