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X-ray magnetic circular dichroism and resonant inelastic X-ray scattering explained: role of many-body correlation and mixed-valence fluctuations

2024/12/10 by Kim, Beom Hyun, Lee, Sang-Jun, Huang, H. +12
#FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci) #Strongly Correlated Electrons (cond-mat.str-el)

paper · doi:10.48550/arxiv.2412.07204

Abstract

X-ray magnetic circular dichroism (XMCD) and resonant inelastic X-ray scattering with magnetic circular dichroism (RIXS-MCD) provide unparalleled insights into the electronic and magnetic dynamics of complex materials. Yet, their spectra remain challenging to interpret due to intricate many-body interactions. Here, we introduce a theoretical framework based on the Anderson impurity model, fully incorporating charge transfer (CT) and core-valence exchange correlation (CVEC) effects. Using epitaxial ferromagnetic La0.7Sr0.3MnO3 film as a model system, we capture elusive spectral features, demonstrating the necessity of CT inclusion for resolving XMCD subpeaks and revealing the profound impact of CVEC on RIXS-MCD spectra. Our approach not only successfully mirrors experimental results but also opens new avenues for exploring spin, orbital, and charge excitations in 3d transition metals and other correlated materials.

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