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Magnetic Resonance in Solids

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Vol 2, No 1 (1998)
1-25 66
Abstract

One of the most exciting features of the hole centers CuO45- in doped cuprates is in their unusually complicated ground state as a result of electronic quasi-degeneracy. An additional hole, doped to the basic CuO46- cluster with the b1g hole can occupy both the same hybrid Cu3d-O2p orbital state resulting in a Zhang-Rice singlet 1A1g and the purely oxygen eu molecular orbital resulting in singlet or triplet 1,3Eu  term with the close energies. We present a detailed analysis of the (pseudo)-Jahn-Teller effect driven by the near-degeneracy within the (1A1g1,3Eu)-manifold.



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ISSN 2072-5981 (Online)