General Time-Dependent Configuration-Interaction Singles II: The Atomic Case

dc.bibliographicCitation.firstPage042806eng
dc.bibliographicCitation.issue4eng
dc.bibliographicCitation.journalTitlePhysical review : A : covering atomic, molecular, and optical physics and quantum informationeng
dc.bibliographicCitation.volume106eng
dc.contributor.authorCarlström, Stefanos
dc.contributor.authorBertolino, Mattias
dc.contributor.authorDahlström, Jan Marcus
dc.contributor.authorPatchkovskii, Serguei
dc.date.accessioned2023-01-06T05:19:54Z
dc.date.available2023-01-06T05:19:54Z
dc.date.issued2022-10-10
dc.description.abstractWe 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)]. 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.eng
dc.description.versionpublishedVersioneng
dc.identifier.urihttps://oa.tib.eu/renate/handle/123456789/10784
dc.identifier.urihttp://dx.doi.org/10.34657/9810
dc.language.isoengeng
dc.publisherWoodbury, NY : Inst.eng
dc.relation.doihttps://doi.org/10.1103/physreva.106.042806
dc.relation.essn2469-9934
dc.relation.issn2469-9926
dc.rights.licenseCC BY 4.0 Unportedeng
dc.rights.urihttps://creativecommons.org/licenses/by/4.0/eng
dc.subject.ddc530eng
dc.subject.otherPhotoelectron spectroscopyeng
dc.subject.otherPhotonseng
dc.subject.otherQuantum chemistryeng
dc.subject.otherResonanceeng
dc.subject.otherConfiguration interaction singleseng
dc.subject.otherFano resonanceseng
dc.subject.otherGrid-basedeng
dc.subject.otherHigh resolutioneng
dc.subject.otherPhotoelectron spectrumeng
dc.subject.otherSpecialisationeng
dc.subject.otherSpherical symmetryeng
dc.subject.otherSpin-polarizedeng
dc.subject.otherTime dependenteng
dc.subject.otherPhotoelectronseng
dc.titleGeneral Time-Dependent Configuration-Interaction Singles II: The Atomic Caseeng
dc.typeArticleeng
dc.typeTexteng
tib.accessRightsopenAccesseng
wgl.contributorMBIeng
wgl.subjectPhysikeng
wgl.typeZeitschriftenartikeleng
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