Qprop: A Schrödinger-solver for intense laser-atom interaction
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Publication:709897
DOI10.1016/J.CPC.2005.11.001zbMATH Open1196.81046arXivphysics/0507089OpenAlexW2015442136WikidataQ59040200 ScholiaQ59040200MaRDI QIDQ709897FDOQ709897
Authors: Dieter Bauer, Peter Koval
Publication date: 18 October 2010
Published in: Computer Physics Communications (Search for Journal in Brave)
Abstract: The Qprop package is presented. Qprop has been developed to study laser-atom interaction in the nonperturbative regime where nonlinear phenomena such as above-threshold ionization, high order harmonic generation, and dynamic stabilization are known to occur. In the nonrelativistic regime and within the single active electron approximation, these phenomena can be studied with Qprop in the most rigorous way by solving the time-dependent Schr"odinger equation in three spatial dimensions. Because Qprop is optimized for the study of quantum systems that are spherically symmetric in their initial, unperturbed configuration, all wavefunctions are expanded in spherical harmonics. Time-propagation of the wavefunctions is performed using a split-operator approach. Photoelectron spectra are calculated employing a window-operator technique. Besides the solution of the time-dependent Schr"odinger equation in single active electron approximation, Qprop allows to study many-electron systems via the solution of the time-dependent Kohn-Sham equations.
Full work available at URL: https://arxiv.org/abs/physics/0507089
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\texttt{Qprop}Crank-Nicolson approximantsplit operatorwindow-operatortime-dependent Schrödinger equation
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- Eigenstate expansion method for simulations of non-perturbative multiphoton processes
- Strong field approximation for systems with Coulomb interaction
- DMTDHF: a full dimensional time-dependent Hartree-Fock program for diatomic molecules in strong laser fields
- Time-dependent method in the laser-atom interactions
- Three-dimensional simulation of the femto-second pulsed laser interacting with a nitrogen molecule
- Stable and efficient momentum-space solutions of the time-dependent Schrödinger equation for one-dimensional atoms in strong laser fields
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- Dynamics of atoms in strong laser fields. I: A quasi analytical model in momentum space based on a Sturmian expansion of the interacting nonlocal Coulomb potential
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- Fourth order real space solver for the time-dependent Schrödinger equation with singular Coulomb potential
- Simple, accurate, and efficient implementation of 1-electron atomic time-dependent Schrödinger equation in spherical coordinates
- ALTDSE: an Arnoldi-Lanczos program to solve the time-dependent Schrödinger equation
- The N-shaped partition method: a novel parallel implementation of the Crank Nicolson algorithm
- MP-CITDSE: a set of \textit{ab-initio} programs for the simulation of hydrogenic and helium-like atom-laser interactions
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- High‐order harmonic generation by a spatially inhomogeneous field
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