Analysis of Schrödinger operators with inverse square potentials. II: FEM and approximation of eigenfunctions in the periodic case

DOI10.1002/NUM.21861MaRDI QIDQ2875709zbMATH OpenOpenAlexFDO

Authors Eugénie Hunsicker, Hengguang Li, Victor Nistor, Ville Uski

Publication date 11 August 2014

Published in Numerical Methods for Partial Differential Equations (Search for Journal in Brave)

Full work available at URL https://arxiv.org/abs/1205.2127, https://dspace.lboro.ac.uk/2134/17169

zbMATH Keywords

finite element methodgraded mesh3D Schrödinger operator

Mathematics Subject Classification ID

Smoothness and regularity of solutions to PDEs (35B65) Schrödinger operator, Schrödinger equation (35J10) Periodic solutions to PDEs (35B10) Stability and convergence of numerical methods for boundary value problems involving PDEs (65N12) Finite element, Rayleigh-Ritz and Galerkin methods for boundary value problems involving PDEs (65N30)

Abstract: Let $V$ be a {em periodic} potential on $R{R}^3$ that is smooth everywhere except at a discrete set $maS$ of points, where it has singularities of the form $Z/h{o}^2$, with $ho(x)=|x-p|$ for $x$ close to $p$ and $Z$ is continuous, $Z(p)>-1/4$ for $pinmaS$. We also assume that $ho$ and $Z$ are smooth outside $maS$ and $Z$ is smooth in polar coordinates around each singular point. Let us denote by $Lambda$ the periodicity lattice and set $TT:=R{R}^3/Lambda$. In the first paper of this series cite{HLNU1}, we obtained regularity results in weighted Sobolev space for the eigenfunctions of the Schr"odinger-type operator $H=-Delta+V$ acting on $L^2(TT)$, as well as for the induced $vtk$--Hamiltonians $Hk$ obtained by resticting the action of $H$ to Bloch waves. In this paper we present two related applications: one to the Finite Element approximation of the solution of $(L+Hk)v=f$ and one to the numerical approximation of the eigenvalues, $lambda$, and eigenfunctions, $u$, of $Hk$. We give optimal, higher order convergence results for approximation spaces defined piecewise polynomials. Our numerical tests are in good agreement with the theoretical results.

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Cites work

• scientific article; zbMATH DE number 3596197 (Why is no real title available?)
• A note on the conditioning of a class of generalized finite element methods
• A weighted least squares finite element method for elliptic problems with degenerate and singular coefficients
• A-priori analysis and the finite element method for a class of degenerate elliptic equations
• Analysis of a modified Schrödinger operator in 2D: Regularity, index, and FEM
• Analysis of periodic Schrödinger operators: Regularity and approximation of eigenfunctions
• Analysis of the finite element method for transmission/mixed boundary value problems on general polygonal domains
• Asymptotic behavior of solutions to Schrödinger equations near an isolated singularity of the electromagnetic potential
• Asymptotics for the low-lying eigenstates of the Schrödinger operator with magnetic field near corners
• Crouzeix-Raviart type finite elements on anisotropic meshes
• Direct and inverse error estimates for finite elements with mesh refinements
• Elliptic Partial Differential Equations of Second Order
• Estimates for the Errors in Eigenvalue and Eigenvector Approximation by Galerkin Methods, with Particular Attention to the Case of Multiple Eigenvalues
• Finite element approximations for Schrödinger equations with applications to electronic structure computations
• Fundamental Properties of Hamiltonian Operators of Schrodinger Type
• Improving the Rate of Convergence of High-Order Finite Elements on Polyhedra I:A PrioriEstimates
• Improving the Rate of Convergence of High-Order Finite Elements on Polyhedra II: Mesh Refinements and Interpolation
• Improving the rate of convergence of `high order finite elements' on polygons and domains with cusps
• Maxwell eigenvalues and discrete compactness in two dimensions
• Mesh Refinement and Windowing Near Edges for Some Elliptic Problem
• Multigrid algorithms for symmetric discontinuous Galerkin methods on graded meshes
• Multigrid methods for the symmetric interior penalty method on graded meshes.
• Nonrelativistic inverse square potential, scale anomaly, and complex extension
• On the Conditioning of Finite Element Equations with Highly Refined Meshes
• On the Sharpness of Certain Local Estimates for $\overset{\circ}{H}^1$ Projections into Finite Element Spaces: Influence of a Reentrant Corner
• On the behavior of solutions to Schrödinger equations with dipole type potentials near the singularity
• On the eigenfunctions of many-particle systems in quantum mechanics
• On the finite element method for elliptic problems with degenerate and singular coefficients
• Rate of Convergence Estimates for Nonselfadjoint Eigenvalue Approximations
• Regularity estimates for elliptic boundary value problems in Besov spaces
• Spectral Approximation for Compact Operators
• Tetrahedral grid refinement

Cited in

(11)

• Convergence Analysis of Planewave Expansion Methods for 2D Schrödinger Operators with Discontinuous Periodic Potentials
• A posteriori eigenvalue error estimation for a Schrödinger operator with inverse square potential
• A posteriori error estimation of hierarchical type for the Schrödinger operator with inverse square potential
• Analysis of periodic Schrödinger operators: Regularity and approximation of eigenfunctions
• Analysis of a modified Schrödinger operator in 2D: Regularity, index, and FEM
• A comparison of the Georgescu and Vasy spaces associated to the \(N\)-body problems and applications
• The highest superconvergence of the tri-linear element for Schrödinger operator with singularity
• A regularity result for the bound states of \(N\)-body Schrödinger operators: blow-ups and Lie manifolds
• Finite Element Approximations to the Discrete Spectrum of the Schrödinger Operator with the Coulomb Potential
• An energy-minimizing mesh for the Schrödinger equation
• Condition numbers of finite element methods on a class of anisotropic meshes

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