Fingerprints of Mott and Slater gaps in the core-level photoemission spectra of antiferromagnetic iridates

Fuente: arXiv
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Autori principali: Nakagawa, K., Hariki, A., Okauchi, T., Fujiwara, H., Ahn, K. -H., Murakami, Y., Hamamoto, S., Kanai-Nakata, Y., Kadono, T., Higashiya, A., Tamasaku, K., Yabashi, M., Ishikawa, T., Sekiyama, A., Imada, S., Kuneš, J., Takase, K., Yamasaki, A.
Natura: Preprint
Pubblicazione: 2024
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author Nakagawa, K.
Hariki, A.
Okauchi, T.
Fujiwara, H.
Ahn, K. -H.
Murakami, Y.
Hamamoto, S.
Kanai-Nakata, Y.
Kadono, T.
Higashiya, A.
Tamasaku, K.
Yabashi, M.
Ishikawa, T.
Sekiyama, A.
Imada, S.
Kuneš, J.
Takase, K.
Yamasaki, A.
author_facet Nakagawa, K.
Hariki, A.
Okauchi, T.
Fujiwara, H.
Ahn, K. -H.
Murakami, Y.
Hamamoto, S.
Kanai-Nakata, Y.
Kadono, T.
Higashiya, A.
Tamasaku, K.
Yabashi, M.
Ishikawa, T.
Sekiyama, A.
Imada, S.
Kuneš, J.
Takase, K.
Yamasaki, A.
contents We present Ir $4f$ core-level hard-x-ray photoemission spectroscopy (HAXPES) experiments conducted across antiferromagnetic (AFM) ordering transition in Ruddlesden-Popper iridates Sr$_2$IrO$_4$ and Sr$_3$Ir$_2$O$_7$. The Ir $4f$ spectra exhibit distinct changes between the AFM and paramagnetic (PM) phases, with the spectral difference $I_\text{PM}-I_\text{AFM}$ showing a contrasting behavior in the two compounds. By employing computational simulations using the local-density approximation combined with the dynamical mean-field theory method, we elucidate that $I_\text{PM}-I_\text{AFM}$ primary reflects the Slater or Mott-Hubbard character of the AFM insulating state rather than material specific details. This sensitivity to fine low-energy electronic structure arises from the dependence of charge-transfer responses to the sudden creation of a localized core hole on both metal-insulator transitions and long-range AFM ordering. Our result broadens the applications of core-level HAXPES as a tool for characterization of electronic structure.
format Preprint
id arxiv_https___arxiv_org_abs_2404_12646
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Fingerprints of Mott and Slater gaps in the core-level photoemission spectra of antiferromagnetic iridates
Nakagawa, K.
Hariki, A.
Okauchi, T.
Fujiwara, H.
Ahn, K. -H.
Murakami, Y.
Hamamoto, S.
Kanai-Nakata, Y.
Kadono, T.
Higashiya, A.
Tamasaku, K.
Yabashi, M.
Ishikawa, T.
Sekiyama, A.
Imada, S.
Kuneš, J.
Takase, K.
Yamasaki, A.
Strongly Correlated Electrons
We present Ir $4f$ core-level hard-x-ray photoemission spectroscopy (HAXPES) experiments conducted across antiferromagnetic (AFM) ordering transition in Ruddlesden-Popper iridates Sr$_2$IrO$_4$ and Sr$_3$Ir$_2$O$_7$. The Ir $4f$ spectra exhibit distinct changes between the AFM and paramagnetic (PM) phases, with the spectral difference $I_\text{PM}-I_\text{AFM}$ showing a contrasting behavior in the two compounds. By employing computational simulations using the local-density approximation combined with the dynamical mean-field theory method, we elucidate that $I_\text{PM}-I_\text{AFM}$ primary reflects the Slater or Mott-Hubbard character of the AFM insulating state rather than material specific details. This sensitivity to fine low-energy electronic structure arises from the dependence of charge-transfer responses to the sudden creation of a localized core hole on both metal-insulator transitions and long-range AFM ordering. Our result broadens the applications of core-level HAXPES as a tool for characterization of electronic structure.
title Fingerprints of Mott and Slater gaps in the core-level photoemission spectra of antiferromagnetic iridates
topic Strongly Correlated Electrons
url https://arxiv.org/abs/2404.12646