TY - JOUR
T1 - Electronic structure of superconducting nickelates probed by resonant photoemission spectroscopy
AU - Chen, Zhuoyu
AU - Osada, Motoki
AU - Li, Danfeng
AU - Been, Emily M.
AU - Chen, Su-Di
AU - Hashimoto, Makoto
AU - Lu, Donghui
AU - Mo, Sung-Kwan
AU - Lee, Kyuho
AU - Wang, Bai Yang
AU - Rodolakis, Fanny
AU - McChesney, Jessica L.
AU - Jia, Chunjing
AU - Moritz, Brian
AU - Devereaux, Thomas P.
AU - Hwang, Harold Y.
AU - Shen, Zhi-Xun
PY - 2022/6/1
Y1 - 2022/6/1
N2 - The discovery of infinite-layer nickelate superconductors has spurred enormous interest. While the Ni1+ cations possess nominally the same 3d9 configuration as Cu2+ in cuprates, the electronic structure variances remain elusive. Here, we present a soft X-ray photoemission spectroscopy study on parent and doped infinite-layer Pr-nickelate thin films with a doped perovskite reference. By identifying the Ni character with resonant photoemission and comparison with density functional theory + U (on-site Coulomb repulsion energy) calculations, we estimate U ∼5 eV, smaller than the charge transfer energy Δ ∼8 eV, confirming the Mott-Hubbard electronic structure in contrast to charge-transfer cuprates. Near the Fermi level (EF), we observe a signature of occupied rare-earth states in the parent compound, which is consistent with a self-doping picture. Our results demonstrate a correlation between the superconducting transition temperature and the oxygen 2p hybridization near EF when comparing hole-doped nickelates and cuprates.
AB - The discovery of infinite-layer nickelate superconductors has spurred enormous interest. While the Ni1+ cations possess nominally the same 3d9 configuration as Cu2+ in cuprates, the electronic structure variances remain elusive. Here, we present a soft X-ray photoemission spectroscopy study on parent and doped infinite-layer Pr-nickelate thin films with a doped perovskite reference. By identifying the Ni character with resonant photoemission and comparison with density functional theory + U (on-site Coulomb repulsion energy) calculations, we estimate U ∼5 eV, smaller than the charge transfer energy Δ ∼8 eV, confirming the Mott-Hubbard electronic structure in contrast to charge-transfer cuprates. Near the Fermi level (EF), we observe a signature of occupied rare-earth states in the parent compound, which is consistent with a self-doping picture. Our results demonstrate a correlation between the superconducting transition temperature and the oxygen 2p hybridization near EF when comparing hole-doped nickelates and cuprates.
KW - complex oxide
KW - electronic structure
KW - infinite layer
KW - MAP2: Benchmark
KW - nickelate
KW - resonant photoemission spectroscopy
KW - strong correlation
KW - superconductor
KW - thin film
UR - http://www.scopus.com/inward/record.url?scp=85131115636&partnerID=8YFLogxK
UR - https://www.scopus.com/record/pubmetrics.uri?eid=2-s2.0-85131115636&origin=recordpage
U2 - 10.1016/j.matt.2022.01.020
DO - 10.1016/j.matt.2022.01.020
M3 - RGC 21 - Publication in refereed journal
SN - 2590-2393
VL - 5
SP - 1806
EP - 1815
JO - Matter
JF - Matter
IS - 6
ER -