Volume 66, Numbers 1-4, 429-433, DOI: 10.1007/BF02395897

Jahn-Teller calculations for CuO4 and FeO4 clusters in the Nd1.85Ce0.15Cu0.99Fe0.01O4−δ

A. Calles, E. Yepez, J. J. Castro, A. Salcido, A. Cabrera, R. Gomez, S. Aburto, V. Marquina, M. L. Marquina and M. Jimenez, et al.

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Abstract

The Jahn-Teller distortion mechanism in the Nd2−x Ce x CuO4 is analyzed. This analysis is based on a quasi-molecular model for the CuO4 cluster havingD 4h symmetry. In order to compare with experimental Mössbauer measurements in the doped Nd1.85Ce0.15Cu0.99Fe0.01O4−δ superconductor, the FeO4 cluster is also analyzed for the case of Fe2+ in the high spin state. The results show not evidence of a Jahn-Teller effect in these superconductors.

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