Domain decomposition method for the N-body time-independent and time-dependent Schrödinger equations
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Domain decomposition method for the \(N\)-body time-independent and time-dependent Schrödinger equations
Domain decomposition method for the \(N\)-body time-independent and time-dependent Schrödinger equations
Time-dependent Schrödinger equations and Dirac equations (35Q41) Multigrid methods; domain decomposition for initial value and initial-boundary value problems involving PDEs (65M55) Finite element, Rayleigh-Ritz and Galerkin methods for initial value and initial-boundary value problems involving PDEs (65M60)
Abstract: This paper is devoted to the derivation of a pleasingly parallel Galerkin method for the time-independent -body Schr"odinger equation, and its time-dependent version modeling molecules subject to an external electric field. In this goal, we develop a Schwarz Waveform Relaxation (SWR) Domain Decomposition Method (DDM) for the -body Schr"odinger equation. In order to optimize the efficiency and accuracy of the overall algorithm, i) we use mollifiers to regularize the singular potentials and to approximate the Schr"odinger Hamiltonian, ii) we select appropriate orbitals, and iii) we carefully derive and approximate the SWR transmission conditions. Some low dimensional numerical experiments are presented to illustrate the methodology.
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Cites work
- scientific article; zbMATH DE number 3501982 (Why is no real title available?)
- scientific article; zbMATH DE number 6733683 (Why is no real title available?)
- scientific article; zbMATH DE number 3421243 (Why is no real title available?)
- A Galerkin Radial Basis Function Method for the Schrödinger Equation
- An analysis of Schwarz waveform relaxation domain decomposition methods for the imaginary-time linear Schrödinger and Gross-Pitaevskii equations
- An introduction to domain decomposition methods. Algorithms, theory, and parallel implementation
- Asymptotic estimates of the convergence of classical Schwarz waveform relaxation domain decomposition methods for two-dimensional stationary quantum waves
- Computing the Ground State Solution of Bose--Einstein Condensates by a Normalized Gradient Flow
- Cross-points in domain decomposition methods with a finite element discretization
- Domain decomposition method and high-order absorbing boundary conditions for the numerical simulation of the time dependent Schrödinger equation with ionization and recombination by intense electric field
- GMRES: A Generalized Minimal Residual Algorithm for Solving Nonsymmetric Linear Systems
- Lagrange-Schwarz waveform relaxation domain decomposition methods for linear and nonlinear quantum wave problems
- Multilevel preconditioning technique for Schwarz waveform relaxation domain decomposition method for real- and imaginary-time nonlinear Schrödinger equation
- Optimized Multiplicative, Additive, and Restricted Additive Schwarz Preconditioning
- Optimized Schwarz Waveform Relaxation Methods for Advection Reaction Diffusion Problems
- Optimized and quasi-optimal Schwarz waveform relaxation for the one-dimensional Schrödinger equation
- Schwarz waveform relaxation method for one-dimensional Schrödinger equation with general potential
- The analysis of linear partial differential operators. III: Pseudo-differential operators
Cited in
(3)- Domain decomposition method for nonlinear generalized Schrödinger-type systems: Semi-discrete problem
- Applications of time parallelization
- Domain decomposition method and high-order absorbing boundary conditions for the numerical simulation of the time dependent Schrödinger equation with ionization and recombination by intense electric field
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