paper

Superconductivity in nickelate and cuprate superconductors with strong bilayer coupling

arXiv:2312.17064 · doi:10.1103/PhysRevB.110.024514

Abstract

The discovery of superconductivity at 80 K under high pressure in LaNiO presents the groundbreaking confirmation that high- superconductivity is a property of strongly correlated materials beyond cuprates. We use density functional theory (DFT) calculations of the band structure of LaNiO under pressure to verify that the low-energy bands are composed almost exclusively of Ni 3 and O 2 orbitals. We deduce that the Ni 3 orbitals are essentially decoupled by the geometry of the high-pressure structure and by the effect of the Ni Hund coupling being strongly suppressed, which results from the enhanced interlayer antiferromagnetic interaction between orbitals and the strong intralayer hybridization of the orbitals with O 2. By introducing a tight-binding model for the Fermi surfaces and low-energy dispersions, we arrive at a bilayer -- model with strong interlayer hopping, which we show is a framework unifying LaNiO with cuprate materials possessing similar band structures, particularly the compounds LaCaCuO, PbSrYCuO, and EuSrCuNbO. We use a renormalized mean-field theory to show that these systems should have (+)-wave superconductivity, with a dominant -wave component and the high driven by the near-optimally doped band, while the band adds an -wave component that should lead to clear experimental signatures.

11 pages, 4 figures

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