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Inner shell excitation, ionization and fragmentation of pyrimidine
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2010 (English)In: Journal of Physics, Conference Series, ISSN 1742-6588, E-ISSN 1742-6596, Vol. 212, 012002- p.Article in journal (Refereed) Published
Abstract [en]

The inner shell excitation and ionisation of pyrimidine have been studied at the carbon K edge by near-edge X ray absorption fine structure (NEXAFS) and X ray photoelectron (XPS) spectroscopies. The theoretical predictions of density functional theory (DFT) provide a satisfactory assignment of the complex spectra of this polyatomic molecule. The fragmentation following the C(1s -1)π* excitation has been investigated by resonant Auger electron-ion coincidence spectroscopy, which allows a site and state selective study.

Place, publisher, year, edition, pages
2010. Vol. 212, 012002- p.
Keyword [en]
Carbon K-edge, Coincidence spectroscopy, Inner shell excitation, Ionisation, Polyatomic molecules, Resonant Auger, State selective, Theoretical prediction, X ray absorption fine structures, X-ray photoelectrons, XPS
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URN: urn:nbn:se:kth:diva-149417DOI: 10.1088/1742-6596/212/1/012002ISI: 000286419500002Scopus ID: 2-s2.0-77950632799OAI: oai:DiVA.org:kth-149417DiVA: diva2:745357
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QC 20140910

Available from: 2014-09-10 Created: 2014-08-21 Last updated: 2017-12-05Bibliographically approved

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Zhang, Wenhua
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Theoretical Chemistry (closed 20110512)
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