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    Surface effects in x-ray absorption spectra of lanthanides: Focus on strongly correlated cerium materials

    D. Yu. Usachov1,2,*, K. A. Bokai1,2, G. Poelchen3, V. S. Stolyarov2,4, A. V. Fedorov5, K. Kliemt6, S. Khim7, N. Caroca-Canales7, C. Krellner6 et al.

    D. V. Vyalikh8,9,10,†

    • *Contact author: dmitry.usachov@spbu.ru
    • †Contact author: denis.vyalikh@dipc.org

    Phys. Rev. B 112, 035137 – Published 14 July, 2025

    DOI: https://doi.org/10.1103/blg4-bxl5

    Abstract

    Lanthanide (Ln) materials are widely studied using x-ray absorption spectroscopy (XAS), primarily at the Ln 3d edge, with less attention given to the 4d edge. Spectral features are usually analyzed in relation to bulk properties with surface effects rarely considered. In this study, we explore surface phenomena and their impact on XAS spectra, using as examples the antiferromagnetic (AFM) Kondo lattice CeRh2Si2, where we thoroughly examine both the 3d and 4d edges, and AFM LnRh2Si2 (Ln = Tm, Tb, and Pr), where our focus is primarily on the 3d edge. We observe significant contributions from surface effects in the 3d XAS spectra, even when measured in the total electron yield regime. We find evidence of Ce 4f moment reorientation at the Ce-terminated surface of CeRh2Si2, linked to changes in the crystal electric field at the surface. By modeling the Ce 3d and 4d XAS spectra, we not only distinguish between surface and bulk properties but also reveal the fine multiplet structure and the characteristic shape of the giant resonance associated with |MJ〉 states. These findings provide insights into 4f-derived surface phenomena and their distinction from bulk electronic properties, while also emphasizing the general importance of surface sensitivity in XAS measurements of Ln materials.

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