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Electronic structure and superconducting properties of LaNiO$_2$

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arxiv 2411.03777 v1 pith:LYOBNTRD submitted 2024-11-06 cond-mat.str-el cond-mat.supr-con

classification cond-mat.str-elcond-mat.supr-con
keywords superconductivitytheorydensitydopingdynamicalelectronicembeddingexperimental
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abstract

Motivated by recent photoemission measurements on the La$_{0.8}$Sr$_{0.2}$NiO$_2$, we carry out a systematic study of the infinite-layer nickelate using both dynamical mean-field theory and density matrix embedding theory. The renormalized electronic structure and Fermi surface of correlated La$_{0.8}$Sr$_{0.2}$NiO$_2$ are studied in an effective two-band model through the dynamical mean-field calculation. We find the correlation effects reflect mainly on the Ni $d$ band, which is consistent with the experimental findings. We further study the ground state including magnetism and superconductivity through the density matrix embedding theory. Within the experimental doping range and rigid-band approximation, we show that the $d$-wave superconductivity is the lowest energy state, while the static magnetism is absent except very close to zero doping. These findings provide a new understanding of infinite-layer nickelate superconductivity.

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Cited by 2 Pith papers

Reviewed papers in the Pith corpus that reference this work. Sorted by Pith novelty score. Full citation record

  1. Hole distribution and self-doping enhanced electronic correlation in hole-doped infinite-layer nickelates

    cond-mat.str-el 2025-07 conditional novelty 5.0 of 10

    In hole-doped infinite-layer nickelates, DFT+DMFT calculations show doped holes split almost equally between Ni-3d_x2-y2 and interstitial-s orbitals, and the interstitial-s orbital acts as a self-doping charge donor t...

  2. Recent progress in nickelate superconductors

    cond-mat.supr-con 2025-09 conditional novelty 2.0 of 10

    A comprehensive review of nickelate superconductors that surveys the 112, 327, and 43(10) families and frames the key open questions about their pairing mechanisms.

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