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J-Matrix time propagation of atomic hydrogen in attosecond fields

The J-Matrix approach for scattering is extended to the time-dependent Schrödinger equation (TDSE) for one electron atoms in external few cycle attosecond fields. To this purpose, the wave function is expanded in square integrable ([Formula: see text] ) Sturmian functions and an equation system for...

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Autores principales: Gersbacher, Rolf, Broad, John T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9249916/
https://www.ncbi.nlm.nih.gov/pubmed/35778443
http://dx.doi.org/10.1038/s41598-022-14706-9
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author Gersbacher, Rolf
Broad, John T.
author_facet Gersbacher, Rolf
Broad, John T.
author_sort Gersbacher, Rolf
collection PubMed
description The J-Matrix approach for scattering is extended to the time-dependent Schrödinger equation (TDSE) for one electron atoms in external few cycle attosecond fields. To this purpose, the wave function is expanded in square integrable ([Formula: see text] ) Sturmian functions and an equation system for the transition amplitudes is established. Outside the interaction zone, boundary conditions are imposed at the border in the [Formula: see text] function space. These boundary conditions correspond to outgoing waves (Siegert states) and minimize reflections at the [Formula: see text] boundary grid. Outgoing wave behaviour in the asymptotic region is achieved by employing Pollaczek functions. The method enables the treatment of light - atom interactions within arbitrary external fields. Using a partial wave decomposition, the coupled differential equation system is solved by a Runge-Kutta method. As a proof of the method ionization processes of atomic hydrogen in half and few cycle attosecond fields are examined. The electron energy spectrum is calculated and the numerical implementation will be presented. Different forms of the interaction operator are considered and the convergence behaviour is discussed. Results are compared to other studies which use independent approaches like finite difference methods. Remarkable agreement is achieved even with strong field strengths of the electromagnetic field. It is demonstrated that expanding in [Formula: see text] functions and imposing boundary conditions at the limit in the [Formula: see text] function space can be an advantageous alternative to conventional propagation methods using complex absorbing potentials or complex scaling.
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spelling pubmed-92499162022-07-03 J-Matrix time propagation of atomic hydrogen in attosecond fields Gersbacher, Rolf Broad, John T. Sci Rep Article The J-Matrix approach for scattering is extended to the time-dependent Schrödinger equation (TDSE) for one electron atoms in external few cycle attosecond fields. To this purpose, the wave function is expanded in square integrable ([Formula: see text] ) Sturmian functions and an equation system for the transition amplitudes is established. Outside the interaction zone, boundary conditions are imposed at the border in the [Formula: see text] function space. These boundary conditions correspond to outgoing waves (Siegert states) and minimize reflections at the [Formula: see text] boundary grid. Outgoing wave behaviour in the asymptotic region is achieved by employing Pollaczek functions. The method enables the treatment of light - atom interactions within arbitrary external fields. Using a partial wave decomposition, the coupled differential equation system is solved by a Runge-Kutta method. As a proof of the method ionization processes of atomic hydrogen in half and few cycle attosecond fields are examined. The electron energy spectrum is calculated and the numerical implementation will be presented. Different forms of the interaction operator are considered and the convergence behaviour is discussed. Results are compared to other studies which use independent approaches like finite difference methods. Remarkable agreement is achieved even with strong field strengths of the electromagnetic field. It is demonstrated that expanding in [Formula: see text] functions and imposing boundary conditions at the limit in the [Formula: see text] function space can be an advantageous alternative to conventional propagation methods using complex absorbing potentials or complex scaling. Nature Publishing Group UK 2022-07-01 /pmc/articles/PMC9249916/ /pubmed/35778443 http://dx.doi.org/10.1038/s41598-022-14706-9 Text en © The Author(s) 2022 https://creativecommons.org/licenses/by/4.0/Open AccessThis article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article's Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article's Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/ (https://creativecommons.org/licenses/by/4.0/) .
spellingShingle Article
Gersbacher, Rolf
Broad, John T.
J-Matrix time propagation of atomic hydrogen in attosecond fields
title J-Matrix time propagation of atomic hydrogen in attosecond fields
title_full J-Matrix time propagation of atomic hydrogen in attosecond fields
title_fullStr J-Matrix time propagation of atomic hydrogen in attosecond fields
title_full_unstemmed J-Matrix time propagation of atomic hydrogen in attosecond fields
title_short J-Matrix time propagation of atomic hydrogen in attosecond fields
title_sort j-matrix time propagation of atomic hydrogen in attosecond fields
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9249916/
https://www.ncbi.nlm.nih.gov/pubmed/35778443
http://dx.doi.org/10.1038/s41598-022-14706-9
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