Numerical integration of the time-dependent Schrödinger equation for laser-driven helium

The full time-dependent Schrödinger equation for 2-electron atoms in intense laser fields is solved using a mixed finite-difference/basis set approach. We discuss Krylov subspace techniques for the propagation of the equation in time, and numerical methods for optimizing the description of the syste...

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Veröffentlicht in:Computer physics communications 1998-11, Vol.114 (1), p.1-14
Hauptverfasser: Smyth, Edward S., Parker, Jonathan S., Taylor, K.T.
Format: Artikel
Sprache:eng
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Zusammenfassung:The full time-dependent Schrödinger equation for 2-electron atoms in intense laser fields is solved using a mixed finite-difference/basis set approach. We discuss Krylov subspace techniques for the propagation of the equation in time, and numerical methods for optimizing the description of the system on a finite-difference lattice. We describe the implementation of a parallelized code based on these numerical methods, and review performance and scaling results of the code on the Cray T3D/E.
ISSN:0010-4655
1879-2944
DOI:10.1016/S0010-4655(98)00083-6