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Cationic double K-hole pre-edge states of CS2 and SF6
Univ Gothenburg, Dept Phys, Origovagen 6B, SE-41296 Gothenburg, Sweden..
Univ Gothenburg, Dept Phys, Origovagen 6B, SE-41296 Gothenburg, Sweden.;Univ Oxford, Phys & Theoret Chem Lab, Dept Chem, South Parks Rd, Oxford OX1 3QZ, England..
UPMC Univ Paris 06, Sorbonne Univ, CNRS, UMR 7614,Lab Chim Phys Mat & Rayonnment, F-75005 Paris 05, France..
UPMC Univ Paris 06, Sorbonne Univ, CNRS, UMR 7614,Lab Chim Phys Mat & Rayonnment, F-75005 Paris 05, France..
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2017 (English)In: Scientific Reports, ISSN 2045-2322, E-ISSN 2045-2322, Vol. 7, article id 13317Article in journal (Refereed) Published
Abstract [en]

Recent advances in X-ray instrumentation have made it possible to measure the spectra of an essentially unexplored class of electronic states associated with double inner-shell vacancies. Using the technique of single electron spectroscopy, spectra of states in CS2 and SF6 with a double hole in the K-shell and one electron exited to a normally unoccupied orbital have been obtained. The spectra are interpreted with the aid of a high-level theoretical model giving excellent agreement with the experiment. The results shed new light on the important distinction between direct and conjugate shake-up in a molecular context. In particular, systematic similarities and differences between pre-edge states near single core holes investigated in X-ray absorption spectra and the corresponding states near double core holes studied here are brought out.

Place, publisher, year, edition, pages
NATURE PUBLISHING GROUP , 2017. Vol. 7, article id 13317
National Category
Condensed Matter Physics
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URN: urn:nbn:se:uu:diva-340127DOI: 10.1038/s41598-017-13607-6ISI: 000413084800014PubMedID: 29042664OAI: oai:DiVA.org:uu-340127DiVA: diva2:1179259
Funder
Swedish Research CouncilKnut and Alice Wallenberg Foundation
Available from: 2018-01-31 Created: 2018-01-31 Last updated: 2018-01-31Bibliographically approved

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