Electronic structure of tin oxides by electron energy loss spectroscopy and real-space multiple scattering calculations

M. S. Moreno, R. F. Egerton, J. J. Rehr, and P. A. Midgley
Phys. Rev. B 71, 035103 – Published 7 January 2005

Abstract

The electronic structure of the tin oxides SnO and SnO2 is studied using the fine structure of the SnM4,5 and oxygen K-edges measured by electron energy loss spectroscopy (EELS). The experimental results are compared with real-space multiple scattering calculations. It is observed that both edges are overlapped. The calculations reveal that the observed fine structure is due largely to the oxygen states, and that it can be used to fingerprint each phase. The calculated densities of states are similar for both compounds and suggest a covalent nature. The structures appearing within the first 10eV above the threshold arise from a covalent mixing of mainly O 2p and Sn 5sp. For SnO the oxygen edge is satisfactorily reproduced. Discrepancies in the predicted energy position of the features in the EELS of SnO2 are briefly discussed.

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  • Received 22 June 2004

DOI:https://doi.org/10.1103/PhysRevB.71.035103

©2005 American Physical Society

Authors & Affiliations

M. S. Moreno*

  • Centro Atómico Bariloche, 8400-San Carlos de Bariloche, Argentina

R. F. Egerton

  • Department of Physics, University of Alberta, Edmonton, Canada T6G 2J1

J. J. Rehr

  • Department of Physics, University of Washington, Seattle, Washington 98195-1560, USA

P. A. Midgley

  • Department of Materials Science and Metallurgy, University of Cambridge CB2 3QZ, UK

  • *Also at CONICET. Electronic address: smoreno@cab.cnea.gov.ar

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Vol. 71, Iss. 3 — 15 January 2005

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