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Titel Fe K-edge XANES and pre-edge polarization dependance for the determination of the oxidation state of iron in antigorite and other phyllosilicates
VerfasserIn M. Munoz, O. Vidal, C. Marcaillou, S. Pascarelli, O. Mathon, F. Farges
Konferenz EGU General Assembly 2012
Medientyp Artikel
Sprache Englisch
Digitales Dokument PDF
Erschienen In: GRA - Volume 14 (2012)
Datensatznummer 250063317
 
Zusammenfassung
Iron oxidation state in minerals is often a crucial indicator for the understanding of mineralogical reactions related to hydrothermalism, or various natural processes. We investigated here the influence of the linear polarization of the synchrotron X-ray beam on the determination of the iron oxidation state in phyllosilicates. Fe K-edge XANES spectra and pre-peaks of biotite (Bt), chlorite (Chl), talc (Tlc) and antigorite (Atg) crystals have been recorded at different crystal orientations. As a function of the crystal orientation, the experimental results show, 1) important changes both for XANES and pre-peaks, 2) typical changes of spectral signatures for all mineral species, 3) uncorrelated changes between XANES and pre-peaks, 4) important changes of the pre-peak energies, but no significant change of the integrated areas. Ab initio XANES calculations, performed for 6 orientations of the Bt structure are consistent with the experimental measurements. The energy position of the pre-peak centroids changes with crystal orientation by 0.4 eV for Bt and Tlc crystals, and by 0.2 eV for Chl and Atg, which correspond to XFe(apparent)3+ variations (2δ) of 0.22 and 0.15, respectively. Measurements on powdered crystals show that – (2/3)2δÂ