New Journal of Physics (Jan 2012)

Spin-state order/disorder and metal–insulator transition in GdBaCo2O5.5: experimental determination of the underlying electronic structure

  • Z Hu,
  • Hua Wu,
  • T C Koethe,
  • S N Barilo,
  • S V Shiryaev,
  • G L Bychkov,
  • C Schüßler-Langeheine,
  • T Lorenz,
  • A Tanaka,
  • H H Hsieh,
  • H-J Lin,
  • C T Chen,
  • N B Brookes,
  • S Agrestini,
  • Y-Y Chin,
  • M Rotter,
  • L H Tjeng

DOI
https://doi.org/10.1088/1367-2630/14/12/123025
Journal volume & issue
Vol. 14, no. 12
p. 123025

Abstract

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We have investigated the electronic structure of GdBaCo _2 O _5.5 across the metal–insulator transition (MIT) using soft x-ray absorption and photoelectron spectroscopy. For the low-temperature insulating phase, we find that half of the Co ^3+ ions at the octahedral sites are in the low spin (LS) and the other half in the high spin (HS) state, while the Co ^3+ ions at the pyramidal sites are in the HS configuration. Upon increasing the temperature across the MIT, part of the LS octahedral Co ^3+ undergoes a spin-state transition into the HS configuration. We infer that this destroys the spin-state ordering and thus explains the decrease in resistivity. We observed that the band gap is reduced but not closed in the high-temperature phase.