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Electronic band properties and superconductivity in La2−yXyCuO4

L. F. Mattheiss

DOI 10.1103/PhysRevLett.58.1028 · Physical Review Letters

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Abstract

The results of electronic-structure calculations for tetragonal La2CuO4 provide insight concerning the origin of high-temperature superconductivity in the La2−yXyCuO4 alloys. A half-filled Cu(3d)-O(2p) band with two-dimensional character and a nearly square Fermi surface produces a Peierls instability for y=0 that opens a semiconductor gap over the Fermi surface. Alloying with divalent or tetravalent atoms should spoil the nesting features while maintaining the strong coupling of O phonons to the conduction electrons.

Source-reported materials — not catalogue approval

FormulaReported Tc (K)Pressure (GPa)Type
La2-yXyCuO4

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30Pressure not reportedunknown

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