Related papers: Minimum energy paths for dislocation nucleation in…
An analysis of the network defined by the potential energy minima of multi-atomic systems and their connectivity via reaction pathways that go through transition states allows to understand important characteristics like thermodynamic,…
We discuss how to connect the energy levels of two-particle systems trapped by a harmonic-oscillator force to scattering amplitudes, with nucleon-nucleon scattering phase shifts in uncoupled channels as the application. At the center of the…
An adiabatic approach is developed for the problem of boundary friction between two atomically smooth and incommensurate solid surfaces, separated by a monolayer of lubricant atoms. This method permits to consider very slow macroscopic…
The planar bistable device [Tsakonas \textit{et al., Appl. Phys. Lett.}, 2007, {\textbf{90}}, 111913] is known to have two distinct classes of stable equilibria: the diagonal and rotated solutions. We model this device within the…
Most of the research concerting crack propagation in discrete media is concerned with specific types of external loading: displacements on the boundaries, or constant energy fluxes or feeding waves originating from infinity. In this paper…
We establish a number of results concerning conditions for minimum energy dissipation and advective travel time in porous and fractured media. First, we establish a pair of converse results concerning fluid motion along a streamline between…
We study pattern formation in a compressed elastic film which delaminates from a substrate. Our key tool is the determination of rigorous upper and lower bounds on the minimum value of a suitable energy functional. The energy consists of…
Minimum energy conical intersections can be used to rationalize photochemical processes. In this Letter, we examine an algorithm to locate these structures that does not require the evaluation of nonadiabatic coupling vectors, showing that…
Energy-transport equations for the transport of fermions in optical lattices are formally derived from a Boltzmann transport equation with a periodic lattice potential in the diffusive limit. The limit model possesses a formal gradient-flow…
In this paper we characterise the equilibrium measure for a nonlocal and anisotropic weighted energy describing the interaction of positive dislocations in the plane. We prove that the minimum value of the energy is attained by a measure…
We study the linearized Fopl - von Karman theory of a long, thin rectangular elastic membrane that is bent through an angle $2 \alpha$. We prove rigorous bounds for the minimum energy of this configuration in terms of the plate thickness…
In this paper we derive a line tension model for dislocations in 3d starting from a geometrically nonlinear elastic energy with quadratic growth. In the asymptotic analysis, as the amplitude of the Burgers vectors (proportional to the…
The aim of this paper is to study the elastic stress and strain fields of dislocations and disclinations in the framework of Mindlin's gradient elasticity. We consider simple but rigorous versions of Mindlin's first gradient elasticity with…
The spontaneous emergence of heterogeneous dislocation patterns is a conspicuous feature of plastic deformation and strain hardening of crystalline solids. Despite long-standing efforts in the materials science and physics of defect…
Strain relief in lattice mismatched heteroepitaxy is mediated by formation and/or propagation of dislocations. Due to their technological significance, the process of strain relief in materials with face-centred cubic (fcc) lattices has…
Hybrid quantum/classical techniques can flexibly couple ab initio simulations to an empirical or elastic medium to model materials systems that cannot be contained in small periodic supercells. However, due to electronic non-locality a…
In this work, nonlinear variational optimization is used for obtaining minimal seeds for the formation of turbulent bands in channel flow. Using nonlinear optimization together with energy bisection, we have found that the minimal energy…
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…
We study the behavior of atomistic models in general dimensions under uniaxial tension and investigate the system for critical fracture loads. We rigorously prove that in the discrete-to-continuum limit the minimal energy satisfies a…
The stability to dislocations of the elastic phase, or ``Bragg glass'', of a randomly pinned elastic medium in two dimensions is studied using the minimum-cost-flow algorithm for a disordered fully-packed loop model. The elastic phase is…