General time-dependent configuration-interaction singles. II. Atomic case
(2022) In Physical Review A 106(4).- Abstract
We present a specialization of the grid-based implementation of the time-dependent configuration-interaction singles described in the preceding paper [S. Carlström et al., preceding paper, Phys. Rev. A 106, 043104 (2022)]10.1103/PhysRevA.106.043104. to the case of spherical symmetry. We describe the intricate time propagator in detail and conclude with a few example calculations. Among these, of note are high-resolution photoelectron spectra in the vicinity of the Fano resonances in photoionization of neon and spin-polarized photoelectrons from xenon, in agreement with recent experiments.
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https://lup.lub.lu.se/record/b25ec260-9370-4349-9767-b14ae36dd6d9
- author
- Carlström, Stefanos LU ; Bertolino, Mattias LU ; Dahlström, Jan Marcus LU and Patchkovskii, Serguei
- organization
- publishing date
- 2022-10
- type
- Contribution to journal
- publication status
- published
- subject
- in
- Physical Review A
- volume
- 106
- issue
- 4
- article number
- 042806
- publisher
- American Physical Society
- external identifiers
-
- scopus:85139831822
- ISSN
- 2469-9926
- DOI
- 10.1103/PhysRevA.106.042806
- language
- English
- LU publication?
- yes
- id
- b25ec260-9370-4349-9767-b14ae36dd6d9
- date added to LUP
- 2022-12-14 15:51:03
- date last changed
- 2022-12-14 15:51:03
@article{b25ec260-9370-4349-9767-b14ae36dd6d9, abstract = {{<p>We present a specialization of the grid-based implementation of the time-dependent configuration-interaction singles described in the preceding paper [S. Carlström et al., preceding paper, Phys. Rev. A 106, 043104 (2022)]10.1103/PhysRevA.106.043104. to the case of spherical symmetry. We describe the intricate time propagator in detail and conclude with a few example calculations. Among these, of note are high-resolution photoelectron spectra in the vicinity of the Fano resonances in photoionization of neon and spin-polarized photoelectrons from xenon, in agreement with recent experiments.</p>}}, author = {{Carlström, Stefanos and Bertolino, Mattias and Dahlström, Jan Marcus and Patchkovskii, Serguei}}, issn = {{2469-9926}}, language = {{eng}}, number = {{4}}, publisher = {{American Physical Society}}, series = {{Physical Review A}}, title = {{General time-dependent configuration-interaction singles. II. Atomic case}}, url = {{http://dx.doi.org/10.1103/PhysRevA.106.042806}}, doi = {{10.1103/PhysRevA.106.042806}}, volume = {{106}}, year = {{2022}}, }