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1s2p RIXS Calculations for 3d Transition Metal Ions in Octahedral Symmetry
Joint Authors
Zimmermann, Patric
Hunault, Myrtille O. J. Y.
de Groot, Frank M. F.
Source
Issue
Vol. 2018, Issue 2018 (31 Dec. 2018), pp.1-50, 50 p.
Publisher
Hindawi Publishing Corporation
Publication Date
2018-06-24
Country of Publication
Egypt
No. of Pages
50
Main Subjects
Abstract EN
We present a series of 1s2p resonant inelastic X-ray scattering (RIXS) calculations for 3d transition metal ions in octahedral symmetry covering each ground state between 3d0 and 3d9.
The calculations are performed in octahedral (Oh) symmetry using the crystal field multiplet theory.
We discuss the crystal field effects and the selection rules with respect to the 1s2p RIXS pre-edge and compare their final state energies with the corresponding 2p X-ray absorption spectrum (XAS).
The calculations provide a detailed understanding of 1s2p RIXS and serve as a basis for the future analysis of experimental spectra and also as a starting point for calculations that add additional channels including the nonlocal peaks.
American Psychological Association (APA)
Zimmermann, Patric& Hunault, Myrtille O. J. Y.& de Groot, Frank M. F.. 2018. 1s2p RIXS Calculations for 3d Transition Metal Ions in Octahedral Symmetry. Journal of Spectroscopy،Vol. 2018, no. 2018, pp.1-50.
https://search.emarefa.net/detail/BIM-1202486
Modern Language Association (MLA)
Zimmermann, Patric…[et al.]. 1s2p RIXS Calculations for 3d Transition Metal Ions in Octahedral Symmetry. Journal of Spectroscopy No. 2018 (2018), pp.1-50.
https://search.emarefa.net/detail/BIM-1202486
American Medical Association (AMA)
Zimmermann, Patric& Hunault, Myrtille O. J. Y.& de Groot, Frank M. F.. 1s2p RIXS Calculations for 3d Transition Metal Ions in Octahedral Symmetry. Journal of Spectroscopy. 2018. Vol. 2018, no. 2018, pp.1-50.
https://search.emarefa.net/detail/BIM-1202486
Data Type
Journal Articles
Language
English
Notes
Includes bibliographical references
Record ID
BIM-1202486