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Local structure and defects in ion irradiated KTaO3

Zhang, F. X. ; Xi, J. ; Zhang, Y. ; Tong, Yang ; Xue, H. ; Huang, R. ; Trautmann, C. ; Weber, W. J. (2018)
Local structure and defects in ion irradiated KTaO3.
In: Journal of Physics: Condensed Matter, 30 (14)
doi: 10.1088/1361-648X/aab1a2
Artikel, Bibliographie

Kurzbeschreibung (Abstract)

The modification of the local structure in cubic perovskite KTaO3 irradiated with 3 MeV and 1.1 GeV Au ions is studied by Raman and x-ray absorption spectroscopy, complemented by density functional theory (DFT) calculations. In the case of irradiation with 3 MeV Au ions where displacement cascade processes are dominant, the Ta L-3-edge x-ray absorption measurements suggest that a peak corresponding to the Ta-O bonds in the TaO6 octahedra splits, which is attributed to the formation of TaK antisite defects that are coupled with oxygen vacancies, VO. This finding is consistent with the DFT calculations. Under irradiation with 1.1 GeV ions, the intense ionization and electronic energy deposition lead to a blue shift and an intensity reduction of active Raman bands. In the case of sequential irradiations, extended x-ray absorption fine structure measurements reveal a decrease in concentration of coupled TaK-VO defects under subsequent irradiation with 1.1 GeV Au ions.

Typ des Eintrags: Artikel
Erschienen: 2018
Autor(en): Zhang, F. X. ; Xi, J. ; Zhang, Y. ; Tong, Yang ; Xue, H. ; Huang, R. ; Trautmann, C. ; Weber, W. J.
Art des Eintrags: Bibliographie
Titel: Local structure and defects in ion irradiated KTaO3
Sprache: Englisch
Publikationsjahr: 11 April 2018
Verlag: IOP Publishing
Titel der Zeitschrift, Zeitung oder Schriftenreihe: Journal of Physics: Condensed Matter
Jahrgang/Volume einer Zeitschrift: 30
(Heft-)Nummer: 14
DOI: 10.1088/1361-648X/aab1a2
Kurzbeschreibung (Abstract):

The modification of the local structure in cubic perovskite KTaO3 irradiated with 3 MeV and 1.1 GeV Au ions is studied by Raman and x-ray absorption spectroscopy, complemented by density functional theory (DFT) calculations. In the case of irradiation with 3 MeV Au ions where displacement cascade processes are dominant, the Ta L-3-edge x-ray absorption measurements suggest that a peak corresponding to the Ta-O bonds in the TaO6 octahedra splits, which is attributed to the formation of TaK antisite defects that are coupled with oxygen vacancies, VO. This finding is consistent with the DFT calculations. Under irradiation with 1.1 GeV ions, the intense ionization and electronic energy deposition lead to a blue shift and an intensity reduction of active Raman bands. In the case of sequential irradiations, extended x-ray absorption fine structure measurements reveal a decrease in concentration of coupled TaK-VO defects under subsequent irradiation with 1.1 GeV Au ions.

Freie Schlagworte: KTaO3, ion irradiation, Raman, EXAFS, defects, DFT
Zusätzliche Informationen:

Artikel-ID: 145401

Fachbereich(e)/-gebiet(e): 11 Fachbereich Material- und Geowissenschaften
11 Fachbereich Material- und Geowissenschaften > Materialwissenschaft
11 Fachbereich Material- und Geowissenschaften > Materialwissenschaft > Fachgebiet Ionenstrahlmodifizierte Materialien
Hinterlegungsdatum: 07 Mär 2024 07:34
Letzte Änderung: 07 Mär 2024 07:34
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