Related Experiment Video
Updated: Dec 21, 2025

Author Spotlight: Magnetometric Characterization of Intermediates in the Solid-State Electrochemistry of Redox-Active Metal-Organic Frameworks
Published on: June 9, 2023
Theoretical calculation of x-ray magnetic circular dichroism spectra for Gd/Cu multilayers at the Cu K edge
1Department Chemie, Physikalische Chemie, Universität München, Butenandstraße 5-13, Haus E-2.037, D-81337 München, Germany.
Abstract:
To explain the remarkable oscillations observed in the x-ray magnetic circular dichroic absorption spectra from Gd/Cu multilayers at the Cu K edge, ab initio calculations have been made using the fully relativistic Korringa-Kohn-Rostoker formalism including the spin-orbit coupling. The result reproduces well the oscillatory profiles in the near-edge region, but the peaks and valleys do not correspond to those in the difference density of states [Formula: see text] for the unoccupied Cu 4p band above the Fermi level. We find small spin and orbital moments on the interfacial Cu sites, which decay towards the core of the Cu layer. Surprisingly, neither the spin nor the orbital moments die out on the Cu sites four atomic layers away from the Co interface. This extended polarization is ascribed to the hybridization of the Cu 4p and the Gd 5d states. The accuracy of the calculation is supported by the near-bulk spin and orbital moments found on the Gd sites away from the interface.
More Related Videos
06:49Radio Frequency Magnetron Sputtering of GdBa2Cu3O7âˆ'ÃŽ ´/ La0.67Sr0.33MnO3 Quasi-bilayer Films on SrTiO3 STO Single-crystal Substrates
Published on: April 12, 2019
12:20Sputter Growth and Characterization of Metamagnetic B2-ordered FeRh Epilayers
Published on: October 5, 2013
Related Concept Videos
Colors and Magnetism
When atoms or molecules absorb light at the proper frequency, their electrons are excited to higher-energy orbitals. For many main group atoms and molecules, the absorbed photons are in the ultraviolet range of the electromagnetic spectrum, which cannot be detected by the human eye. For coordination compounds, the energy difference between the d orbitals often allows photons in the visible range to be absorbed and emitted, which is seen as colors by the human...
Crystal Field Theory - Octahedral Complexes
To explain the observed behavior of transition metal complexes (such as colors), a model involving electrostatic interactions between the electrons from the ligands and the electrons in the unhybridized d orbitals of the central metal atom has been developed. This electrostatic model is crystal field theory (CFT). It helps to understand, interpret, and predict the colors, magnetic behavior, and some structures of coordination compounds of transition metals.
CFT focuses on...