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Probing cation antisite disorder in Gd2Ti2O7 pyrochlore by site-specific near-edge x-ray-absorption fine structure and x-ray photoelectron spectroscopy

P. Nachimuthu, S. Thevuthasan, M. H. Engelhard, W. J. Weber, D. K. Shuh, N. M. Hamdan, B. S. Mun, E. M. Adams, D. E. McCready, V. Shutthanandan, D. W. Lindle, G. Balakrishnan, D. M. Paul, E. M. Gullikson, R. C. C. Perera, J. Lian, L. M. Wang, and R. C. Ewing
Phys. Rev. B 70, 100101(R) – Published 16 September 2004

Abstract

Disorder in Gd2Ti2O7 is investigated by near-edge x-ray-absorption fine structure (NEXAFS) and x-ray photoelectron spectroscopy (XPS). NEXAFS shows Ti4+ ions occupy octahedral sites with a tetragonal distortion induced by vacant oxygen sites. O1s XPS spectra obtained with a charge neutralization system from Gd2Ti2O7(100) and the Gd2Ti2O7 pyrochlore used by Chen et al. [Phys. Rev. Lett. 88, 105901 (2002)], both yielded a single peak, unlike the previous result on the latter that found two peaks. The current results give no evidence for an anisotropic distribution of Ti and O. The extra features reported in the aforementioned communication resulted from charging effects and incomplete surface cleaning. Thus, a result confirming the direct observation of simultaneous cation-anion antisite disordering and lending credence to the split vacancy model has been clarified.

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  • Received 7 May 2004

DOI:https://doi.org/10.1103/PhysRevB.70.100101

©2004 American Physical Society

Authors & Affiliations

P. Nachimuthu1,2,*, S. Thevuthasan3, M. H. Engelhard3, W. J. Weber3, D. K. Shuh2, N. M. Hamdan2, B. S. Mun2, E. M. Adams3, D. E. McCready3, V. Shutthanandan3, D. W. Lindle1, G. Balakrishnan4, D. M. Paul4, E. M. Gullikson2, R. C. C. Perera2, J. Lian5, L. M. Wang5, and R. C. Ewing5

  • 1Department of Chemistry, University of Nevada, Las Vegas, Nevada 89154, USA
  • 2Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA
  • 3Pacific Northwest National Laboratory, Richland, Washington 99352, USA
  • 4Department of Physics, University of Warwick, Coventry, United Kingdom
  • 5Department of Nuclear Engineering & Radiological Sciences, University of Michigan, Ann Arbor, Michigan 48109, USA

  • *Corresponding author, Email address: PNachimuthu@lbl.gov

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Issue

Vol. 70, Iss. 10 — 1 September 2004

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