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Spin coupling in shake-up processes
Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Physics, Department of Quantum Chemistry.
1997 (English)In: INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, ISSN 0020-7608, Vol. 63, no 1, 189-196 p.Article in journal (Other scientific) Published
Abstract [en]

The treatment of spin coupling in calculations of shake-up states in core photoelectron processes is reviewed and the problems arising when the equivalent core approximation is used to model the core hole are discussed. A method for approximating the inte

Place, publisher, year, edition, pages
1997. Vol. 63, no 1, 189-196 p.
Keyword [en]
shake-up; equivalent core approximation; spin coupling; semiempirical; intensity; RAY PHOTOELECTRON-SPECTROSCOPY; INTERMEDIATE NEGLECT; DIFFERENTIAL OVERLAP; SPECTRA; CORE; FORMALDEHYDE; SATELLITES; BENZENE; MOLECULES; PYRIDINE
Identifiers
URN: urn:nbn:se:uu:diva-41654OAI: oai:DiVA.org:uu-41654DiVA: diva2:69555
Note
Enkvist C, UNIV UPPSALA, DEPT QUANTUM CHEM, BOX 518, S-75120 UPPSALA, SWEDEN.Available from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-15

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