Physical Review B · 2010 · 81 citations · 44 references
Natural SciencesPhysicsCondensed Matter PhysicsQuantum MechanicsSolid State PhysicsElectron CorrelationElectronic Band StructureExchange InteractionsMagnetism In SolidsSpin-orbit CouplingStrongly Correlated Electron SystemsConstraintsElectron PairingHubbard ModelIrreducible RepresentationsMean-field ApproximationMean-field TheoryMulti-orbital CorrelationsRandom Phase Approximation
The study provides phase diagrams for three‑ and five‑orbital Hubbard models and identifies the realistic coupling regime to guide future theoretical work. Using mean‑field theory and the random‑phase approximation, the authors map the phase space and analyze pairing tendencies within the realistic U–J region. Neutron‑scattering and ARPES data tightly constrain U and J, and the analysis shows that the dominant spin‑singlet pairing channels are nodal, with strong competition among different irreducible representations, consistent with bulk measurements of nodes.
The results of neutron-scattering and angle-resolved photoemission experiments for the Fe-pnictide parent compounds, and their metallic nature, are shown to impose severe constraints on the range of values that can be considered ``realistic'' for the intraorbital Hubbard repulsion $U$ and Hund coupling $J$ in multiorbital Hubbard models treated in the mean-field approximation. Phase diagrams for three- and five-orbital models are here provided, and the physically realistic regime of couplings is highlighted, to guide future theoretical work into the proper region of parameters of Hubbard models. In addition, using the random phase approximation, the pairing tendencies in these realistic coupling regions are investigated. It is shown that the dominant spin-singlet pairing channels in these coupling regimes correspond to nodal superconductivity, with strong competition between several states that belong to different irreducible representations. This is compatible with experimental bulk measurements that have reported the existence of nodes in several Fe-pnictide compounds.
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