Ca and S K-edge XANES of CaS calculated by different methods : influence of full potential, core hole and Eu doping

Ca and S K-edge spectra of CaS are calculated by the full-potential Green's function multiple-scattering method, by the FLAPW method and by the finite-difference method. All three techniques lead to similar spectra. Some differences remain close to the edge, both when comparing different calcul...

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Détails bibliographiques
Publié dans:Journal of synchrotron radiation. - 1994. - 26(2019), Pt 1 vom: 01. Jan., Seite 152-158
Auteur principal: Šipr, Ondřej (Auteur)
Autres auteurs: Khan, Wilayat, Joly, Yves, Minár, Ján
Format: Article en ligne
Langue:English
Publié: 2019
Accès à la collection:Journal of synchrotron radiation
Sujets:Journal Article CaS XANES core hole full potential