Abstract

The ${\mathrm{HgBa}}_{2}{\mathrm{CuO}}_{4+\ensuremath{\delta}}$ superconductor has been studied by high resolution Hg ${L}_{3}$ x-ray absorption near-edge structure (XANES) spectroscopy. The XANES spectrum has been simulated by full multiple-scattering calculations in order to explore the origin of different features in the experimental spectrum. The experimental Hg ${L}_{3}$-edge spectrum could be well reproduced by considering a cluster of 85 atoms, containing 10 shells, within a radius of about 7 \AA{} from the central Hg atom. The low energy spectral feature in the XANES spectrum is found to be due to a transition from the Hg p states to the electronic states hybridized with higher shell Ba atoms. This implies that the transition features in the Hg ${L}_{3}$-edge XANES are strongly influenced by medium range order effects unlike the case of ${L}_{3}$ edge of $3d$ transition metals where short-range order is enough to describe the main transition features.

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