Intermediate neglect of differential overlap spectroscopic studies of lanthanide complexes: Diatomic lanthanide oxides PrO and TmO
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Elucidating cerium + H<inf>2</inf>O reactivity through electronic structure: A combined PES and DFT study
2017, Journal of Molecular SpectroscopyCitation Excerpt :Shake-up transitions are common features in core X-ray photoelectron spectra and have also been observed in valence anion PE spectra of metal and metal oxide clusters [23,24,33,34]. Small lanthanide monoxides are predicted to have a 4fn 5d excited state approximately 1 eV above the ground state [21,22]. These higher energy features are therefore tentatively assigned to shake-up transitions involving photodetachment of an electron from the doubly-occupied 6s-based HOMO coupled to the promotion of the remaining electron from the HOMO to a Ce 5d-based molecular orbital.
Excited state calculations of Europium(III) complexes
1997, Journal of Alloys and CompoundsChapter 152 Electronic structure calculations for molecules containing lanthanide atoms
1996, Handbook on the Physics and Chemistry of Rare EarthsChapter 119 Relativistic effects and electronic structure of lanthanide and actinide molecules
1994, Handbook on the Physics and Chemistry of Rare EarthsLaser spectroscopy of the lanthanide monofluorides: The ground state configuration of holmium fluoride
1992, Journal of Molecular SpectroscopyPhotoelectron spectrum of PrO<sup>-</sup>
2015, Journal of Chemical Physics
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