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Numerical methods for nonlinear Schrödinger equations

Numerical methods for nonlinear Schrödinger equations

Mechthild Thalhammer (ORCID: 0000-0001-5958-6219)
  • Grant DOI 10.55776/P21620
  • Funding program Principal Investigator Projects
  • Status ended
  • Start October 1, 2009
  • End September 30, 2014
  • Funding amount € 136,196
  • Project website

Disciplines

Mathematics (100%)

Keywords

    Nonlinear Schrödinger equations, Nonlinear evolution equations, Exponential operator splitting methods, Pseudospectral methods, Error estimates, Long-term integration

Abstract Final report

Nonlinear evolution equations are fundamental in the mathematical description of dynamical processes in natural sciences, engineering, medicine, and economy. In particular, various physical phenomena are modeled by nonlinear partial differential equations. Prominent examples from quantum physics are nonlinear Schrödinger equations. Especially for such problems, the preservation of certain physically relevant quantities is a fundamental property of the equation. For the numerical solution of complex problems arising in practical applications, the use of computers is indispensable. Though, primarily in connection with simulations over long times, the actual result is adulterated by the influence of the discretisation, rounding errors, and inaccuracies in the data. This raises the question how to interpret the results of such computations. In this context, the field of Numerical Analysis contributes with the theoretical study of the stability and error behaviour of the employed numerical approximation. The main objective of the present project is the theoretical analysis of advanced integration methods for time- independent and time-dependent nonlinear Schrödinger equations. In particular, this includes the investigation of the convergence behaviour of the considered numerical discretisations.Primarily, we are concerned with accurate and efficient methods for the numerical solution of the Gross-Pitaevskii equation which arises in quantum physics for the description of Bose-Einstein condensation. For this purpose, space and time discretisations relying on Hermite and Fourier pseudo-spectral methods as well as high-order exponential operator splitting methods are promising.

Nonlinear partial differential equations are fundamental in the mathematical modelling of dynamical processes in natural sciences, engineering, medicine, and economy. Prominent examples from quantum physics include time-dependent nonlinear Schrödinger equations such as Gross-Pitaevskii systems, which arise in the description of multi-component BoseEinstein condensates.For the numerical solution of complex problems arising in practical applications, the use of computers is indispensable. Though, primarily in connection with simulations over longer times, the accumulation of rounding errors is inevitable and the actual result is in?uenced by the chosen discretisation method. The ?eld of Numerical Mathematics is concerned with the development of novel discretisation methods, well adapted to the considered partial differential equations, and the theoretical study of their stability and error behaviour.Within the research project Numerical methods for nonlinear Schrödinger equations advanced numerical methods for time-independent and time-dependent nonlinear Schrödinger equations were developed and their convergence behaviour was analysed. The focus was on space and time discretisation methods based on pseudo-spectral methods and high-order exponential operator splitting methods. In addition, different approaches for the construction of adaptive time-splitting methods enhancing reliability and ef?ciency of the numerical computations were investigated.The favourable behaviour of the considered discretisation methods was con?rmed by numerical experiments for nonlinear Schrödinger equations such as Gross-Pitaevskii equations.

Research institution(s)
  • Universität Innsbruck - 100%

Research Output

  • 372 Citations
  • 17 Publications
Publications
  • 2017
    Title Convergence analysis of high-order commutator-free quasi-Magnus exponential integrators for nonautonomous linear evolution equations of parabolic type
    DOI 10.1093/imanum/drx012
    Type Journal Article
    Author Blanes S
    Journal IMA Journal of Numerical Analysis
    Pages 743-778
    Link Publication
  • 2012
    Title Defect-based local error estimators for splitting methods, with application to Schrödinger equations, Part I: The linear case
    DOI 10.1016/j.cam.2012.01.001
    Type Journal Article
    Author Auzinger W
    Journal Journal of Computational and Applied Mathematics
    Pages 2643-2659
    Link Publication
  • 2012
    Title A numerical study of adaptive space and time discretisations for Gross–Pitaevskii equations
    DOI 10.1016/j.jcp.2012.05.031
    Type Journal Article
    Author Thalhammer M
    Journal Journal of Computational Physics
    Pages 6665-6681
    Link Publication
  • 2014
    Title Defect-based local error estimators for splitting methods, with application to Schrödinger equations, Part II. Higher-order methods for linear problems
    DOI 10.1016/j.cam.2013.04.043
    Type Journal Article
    Author Auzinger W
    Journal Journal of Computational and Applied Mathematics
    Pages 384-403
    Link Publication
  • 2014
    Title Efficient time integration methods based on operator splitting and application to the Westervelt equation
    DOI 10.1093/imanum/dru029
    Type Journal Article
    Author Kaltenbacher B
    Journal Ima Journal of Numerical Analysis
    Pages 1092-1124
    Link Publication
  • 2013
    Title The Lie-Trotter splitting for nonlinear evolutionary problems involving critical parameters: A compact local error representation and application to nonlinear Schrödinger equations in the semiclassical regime.
    Type Journal Article
    Author Descombes S
  • 2016
    Title Improved error estimates for splitting methods applied to highly-oscillatory nonlinear Schrödinger equations
    DOI 10.1090/mcom/3088
    Type Journal Article
    Author Chartier P
    Journal Mathematics of Computation
    Pages 2863-2885
    Link Publication
  • 2017
    Title High-order commutator-free quasi-Magnus exponential integrators for non-autonomous linear evolution equations
    DOI 10.1016/j.cpc.2017.07.016
    Type Journal Article
    Author Blanes S
    Journal Computer Physics Communications
    Pages 243-262
    Link Publication
  • 2014
    Title Defect-based local error estimators for high-order splitting methods involving three linear operators
    DOI 10.1007/s11075-014-9935-8
    Type Journal Article
    Author Auzinger W
    Journal Numerical Algorithms
    Pages 61-91
  • 2015
    Title Defect-based local error estimators for splitting methods, with application to Schrödinger equations, Part III: The nonlinear case
    DOI 10.1016/j.cam.2014.06.012
    Type Journal Article
    Author Auzinger W
    Journal Journal of Computational and Applied Mathematics
    Pages 182-204
    Link Publication
  • 2012
    Title Convergence Analysis of High-Order Time-Splitting Pseudospectral Methods for Nonlinear Schrödinger Equations
    DOI 10.1137/120866373
    Type Journal Article
    Author Thalhammer M
    Journal SIAM Journal on Numerical Analysis
    Pages 3231-3258
  • 2013
    Title Error analysis of high-order splitting methods for nonlinear evolutionary Schrödinger equations and application to the MCTDHF equations in electron dynamics
    DOI 10.1051/m2an/2013067
    Type Journal Article
    Author Koch O
    Journal ESAIM: Mathematical Modelling and Numerical Analysis
    Pages 1265-1286
    Link Publication
  • 2013
    Title Embedded exponential operator splitting methods for the time integration of nonlinear evolution equations
    DOI 10.1016/j.apnum.2012.09.002
    Type Journal Article
    Author Koch O
    Journal Applied Numerical Mathematics
    Pages 14-24
  • 2013
    Title Convergence analysis of high-order time-splitting pseudo-spectral methods for rotational Gross–Pitaevskii equations
    DOI 10.1007/s00211-013-0586-9
    Type Journal Article
    Author Hofstätter H
    Journal Numerische Mathematik
    Pages 315-364
  • 2013
    Title Full Discretisations for Nonlinear Evolutionary Inequalities Based on Stiffly Accurate Runge–Kutta and hp-Finite Element Methods
    DOI 10.1007/s10208-013-9179-3
    Type Journal Article
    Author Gwinner J
    Journal Foundations of Computational Mathematics
    Pages 913-949
    Link Publication
  • 2010
    Title An exact local error representation of exponential operator splitting methods for evolutionary problems and applications to linear Schrödinger equations in the semi-classical regime
    DOI 10.1007/s10543-010-0282-4
    Type Journal Article
    Author Descombes S
    Journal BIT Numerical Mathematics
    Pages 729-749
  • 2016
    Title Higher-Order Exponential Integrators for Quasi-Linear Parabolic Problems. Part II: Convergence
    DOI 10.1137/15m103384
    Type Journal Article
    Author Gonza´Lez C
    Journal SIAM Journal on Numerical Analysis
    Pages 2868-2888
    Link Publication

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