Bergische Universität Wuppertal
Fachbereich Mathematik und Naturwissenschaften
Angewandte Mathematik - Numerische Analysis

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Absorbing Boundary conditions using Titchmarsh-Weyl theory

joint work with C. Zheng, Tsinghua University, Beijing, China


Summary

A new approach for simulating the solution of the time-dependent Schrödinger equation with a general variable potential will be proposed. The key idea is to approximate the Titchmarsh-Weyl m-function (exact Dirichlet-to-Neumann operator) by a rational function with respect to the spectral parameter. With the proposed method we can overcome the usual high-frequency restriction for absorbing boundary conditions of general variable potential problems. We end up with a fast computational algorithm for absorbing boundary conditions that are accurate for the full frequency band.

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References

  1. X. Antoine, A. Arnold, C. Besse, M. Ehrhardt and A. Schädle, A Review of Transparent and Artificial Boundary Conditions Techniques for Linear and Nonlinear Schrödinger Equations, Commun. Comput. Phys. 4 (2008), 729-796. (open-access article)
    supplementary material (Matlab codes):
  2. M. Ehrhardt and C. Zheng, Implementing exact absorbing boundary condition for the linear one-dimensional Schrödinger problem with variable potential by Titchmarsh-Weyl theory, WIAS Preprint No. 1426, July 2009 (submitted to: Journal of Computational Physics)


University of Wuppertal
Faculty of Mathematics and Natural Sciences
Department of Mathematics
Applied Mathematics & Numerical Analysis Group

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