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Interpretation of x-ray emission spectra: NO adsorbed on Ru(001)
Uppsala University.
Uppsala University.
Uppsala University.
Uppsala University.
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1999 (English)In: JOURNAL OF CHEMICAL PHYSICS, ISSN 0021-9606, Vol. 111, no 10, 4704-4713 p.Article in journal (Other scientific) Published
Abstract [en]

A density functional investigation of the x-ray emission spectrum of NO adsorbed on Ru(001) has been carried out using model cluster calculations. The dipole matrix elements governing the emission probability were evaluated in the frozen ground-state appr

Place, publisher, year, edition, pages
AMER INST PHYSICS , 1999. Vol. 111, no 10, 4704-4713 p.
Keyword [en]
SURFACE CHEMICAL-BOND; ELECTRONIC-STRUCTURE; BASIS SETS; SPECTROSCOPY; NI(100); BENZENE; ABSORPTION; COMPLEXES; MOLECULES; ORBITALS
Identifiers
URN: urn:nbn:se:uu:diva-66698OAI: oai:DiVA.org:uu-66698DiVA: diva2:94609
Note
Addresses: Staufer M, Tech Univ Munich, Lehrstuhl Theoret Chem, D-85747 Garching, Germany. Tech Univ Munich, Lehrstuhl Theoret Chem, D-85747 Garching, Germany. Tech Univ Munich, Phys Dept E20, D-85747 Garching, Germany. Univ Stockholm, FYSIKUM, S-11385 StAvailable from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-14

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