Abstract
The band structure of the Nd2 − x Ce x CuO4HTSC is calculated using the LDA+GTB method, which combines the local density approximation (LDA) and the generalized tight-binding (GTB) method. Two mechanisms of the concentration dependence of the band structure (single-electron and many-electron mechanisms) are taken into account. It is demonstrated that the main contribution to the evolution of the band structure with doping comes from the many-electron mechanism.
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Original Russian Text © V.A. Gavrichkov, S.G. Ovchinnikov, I.A. Nekrasov, E.E. Kokorina, Z.V. Pchelkina, 2007, published in Fizika Tverdogo Tela, 2007, Vol. 49, No. 11, pp. 1958–1963.
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Gavrichkov, V.A., Ovchinnikov, S.G., Nekrasov, I.A. et al. Comparison of the single-electron and many-electron mechanisms of the concentration dependence of the HTSC cuprate band structure. Phys. Solid State 49, 2052–2057 (2007). https://doi.org/10.1134/S1063783407110066
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DOI: https://doi.org/10.1134/S1063783407110066