Related papers: From incommensurate bilayer heterostructures to Al…
We derive continuum limits of atomistic models in the realm of nonlinear elasticity theory rigorously as the interatomic distances tend to zero. In particular we obtain an integral functional acting on the deformation gradient in the…
We consider the Cauchy problem for 2-D incompressible isotropic elastodynamics. Standard energy methods yield local solutions on a time interval $[0,{T}/{\epsilon}]$, for initial data of the form $\epsilon U_0$, where $T$ depends only on…
We present an extension of the Allen-Cahn/Cahn-Hilliard system which incorporates a geometrically linear ansatz for the elastic energy of the precipitates. The model contains both the elastic Allen-Cahn system and the elastic Cahn-Hilliard…
Moire patterns result from setting a 2D material such as graphene on another 2D material with a small twist angle or from the lattice mismatch of 2D heterostructures. We present a continuum model for the elastic energy of these bilayer…
Continuum atomic relaxation models for twisted bilayer graphene involve minimization of the sum of intralayer elastic energy and interlayer adhesion energy. The elastic energy favors a rigid twist i.e. no distortion in the twisted honeycomb…
We derive and analyze a novel approach for modeling and computing the mechanical relaxation of incommensurate 2D heterostructures. Our approach parametrizes the relaxation pattern by the compact local configuration space rather than real…
The phase-field system is a nonlinear model that has significant applications in material sciences. In this paper, we are concerned with the uniqueness of determining the nonlinear energy potential in a phase-field system consisting of…
We develop a continuum dislocation description of twist and stretch moire superlattices in 2D material bilayers. The continuum formulation is based on the topological constraints introduced by the periodic dislocation network associated…
We prove long-time existence of solutions for the equations of atomistic elastodynamics on a bounded domain with time-dependent boundary values as well as their convergence to a solution of continuum nonlinear elastodynamics as the…
Single-particle continuum models such as the popular Bistritzer-MacDonald model have become powerful tools for predicting electronic phenomena of incommensurate 2D materials and the development of many-body models aimed to model…
We propose an energy-consistent mathematical model for motion of dislocation curves in elastic materials using the idea of phase field model. This reveals a hidden gradient flow structure in the dislocation dynamics. The model is derived as…
One- and two-dimensional bilayer systems are examples of ultra-tunable quantum materials that are considered as the basis for the new generation of electronic and photonic devices. Here we develop a general theory of the electron band…
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…
In this paper, we extend the discrete-to-continuum procedure we developed in our previous work to derive a continuum variational model for a hexagonal twisted bilayer material in which one layer is fixed. We use a discrete energy containing…
Common models for two-phase lipid bilayer membranes are based on an energy that consists of an elastic term for each lipid phase and a line energy at interfaces. Although such an energy controls only the length of interfaces, the membrane…
For two different scenarios regarding thin elastic structures, described by 2d-F\"oppl-von K\'arm\'an plate models, we obtain energy scaling laws. Firstly, assuming the reference geometry being that of a singular excess-cone, we obtain…
In our recent work we found a surprising breakdown of symmetry conservation: using standard numerical discretization with very high precision the computed numerical solutions corresponding to very nice initial data may converge to…
Inter-twisted bilayers of two-dimensional (2D) materials can host low-energy flat bands, which offer opportunity to investigate many intriguing physics associated with strong electron correlations. In the existing systems, ultra-flat bands…
Using the method developed in the companion paper, we construct the effective continuum theories for two different microscopic tight binding models of the twisted bilayer graphene at the twist angle of $1.05^\circ$, one Slater-Koster based…
We consider a variational model for heterogeneous phase separation, based on a diffuse interface energy with moving wells. Our main result identifies the asymptotic behavior of the first variation of the phase field energies as the width of…