Summary
This paper develops a unified itinerant electron description for the nature of spin-density wave (SDW) order and magnetic excitations in Ruddlesden-Popper nickelates. The central element is the mirror symmetry of the NiO2 multilayer blocks, which organizes the low-energy electronic states into mirror-even and mirror-odd sectors. It is shown that the dominant interband nesting between mirror-opposite sectors drives a mirror-selective itinerant SDW instability, whose collective modes naturally reproduce the spin-wave-like spectra observed experimentally. In La4Ni3O10, the SDW further induces a secondary mirror-even charge density wave, giving rise to intertwined spin and charge textures. These results demonstrate that magnetism in multilayer nickelates is intrinsically itinerant rather than of local-moment origin, and establish mirror-selective interband SDW order as a unifying organizational principle for magnetic correlations in these systems.
Materials
Methods
- Hartree-Fock
- Random phase approximation (RPA)
- Linear spin-wave theory
- Tight-binding modeling
- DFT
- RPA
- tight-binding modeling
- Hartree-Fock method
Keywords
- mirror selective interband sdw
- itinerant magnetism
- spin wave like spectra
- intertwined spin and charge textures
- spin density wave
- mirror selective interband nesting
- spin wave excitations
Highlights
- The same itinerant SDW framework can simultaneously account for the experimentally observed ordering wave vectors, spin textures, and spin-wave-like magnetic excitation spectra.
- The small ordered moments arise directly from Fermi-surface reconstruction within a partially metallic multiband system.
- Establishes mirror-selective interband SDW order as a unifying organizing principle for magnetic correlations in multilayer nickelates.
- Explains that large effective exchange couplings from spin-wave fits do not correspond to microscopic superexchange interactions.
- Demonstrates that small ordered moments arise from Fermi surface reconstruction, not local moments.
Conclusions
- Magnetism in multilayer nickelates is fundamentally itinerant rather than local-moment in origin.
- Mirror-selective interband SDW order is established as a unifying organizing principle for magnetic correlations in these systems.
- For La4Ni3O10, the SDW further induces a secondary mirror-even charge density wave, yielding intertwined spin and charge textures.
- Dominant interband nesting between mirror-opposite bands drives a mirror-selective SDW instability.
- The collective modes of the SDW naturally reproduce the experimentally observed spin-wave-like spectra.
- For La4Ni3O10, the SDW induces a secondary mirror-even charge density wave, yielding intertwined spin and charge textures.
Main claims
- The dominant magnetic instability in RP nickelates originates from mirror-odd interband scattering between nested Fermi-surface pockets.
- Evidence: Abstract: 'dominant interband nesting between mirror-opposite bands drives a mirror-selective itinerant SDW instability'
- Magnetism in multilayer nickelates is fundamentally itinerant, not local-moment in origin.
- Evidence: Abstract: 'Our results demonstrate that magnetism in multilayer nickelates is fundamentally itinerant rather than local-moment in origin'
- Magnetism in multilayer nickelates is itinerant, driven by mirror-selective interband nesting
- Evidence: From abstract: 'dominant interband nesting between mirror-opposite bands drives a mirror-selective itinerant SDW instability',From abstract: 'magnetism in multilayer nickelates is fundamentally itinerant rather than local-moment in origin'
- Spin-wave-like excitations naturally emerge from itinerant SDW collective modes
- Evidence: From abstract: 'collective modes naturally reproduce the experimentally observed spin-wave-like spectra'
Workflow
- Model construction — Mirror-selective itinerant SDW instability arises from this nesting
- Materials: La3Ni2O7 and La4Ni3O10 crystal structures
- Methods: Mirror-even and mirror-odd sector classification; Effective low-energy Hamiltonian
- Observations: Dominant interband nesting between mirror-opposite bands
- Mean-field and RPA calculation — Magnetism is itinerant rather than local-moment in origin
- Materials: Low-energy band model with residual interactions
- Methods: Hartree-Fock decoupling; Random phase approximation (RPA)
- Observations: Collective modes reproduce experimental spin-wave-like spectra; Small ordered moments
- model_construction — Low-energy states organized into mirror sectors
- Materials: NiO2 blocks; La3Ni2O7 and La4Ni3O10
- Methods: mirror symmetry classification; tight-binding model
- Observations: mirror-even and mirror-odd sectors
- self_consistent_hartree_fock_calculation — Mirror-odd interband SDW instability drives small ordered moments
- Materials: Two-band model with interactions
- Methods: Hartree-Fock mean-field
- Observations: SDW order parameter; ordered moments
- rpa_spin_response_computation — Collective modes reproduce experimentally observed spin-wave spectra
- Materials: HF ground state
- Methods: RPA for transverse spin response
- Observations: collective spin excitation spectra; spin-wave-like modes