Valence photoelectron spectra of alkali bromides calculated within the propagator theory

Alexander Karpenko, Denys Iablonskyi, Helena Aksela

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Abstract

The valence ionization spectra covering the binding energy range 0-45 eV of alkali bromide XBr (X = Li, Na, K, Rb) vapors are studied within the framework of the propagator theory. Relativistic Algebraic Diagrammatic Construction calculations have been carried out in order to investigate photoionization processes and to describe molecular electronic structure. Theoretical results are compared with available experimental data.
Original languageEnglish
JournalJournal of Chemical Physics
Volume138
Issue number16
Pages (from-to)164315
ISSN0021-9606
DOIs
Publication statusPublished - 2013

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© 2013 AIP Publishing LLC

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