Determination of the single-ion anisotropy energy in a S = 5/2 kagome antiferromagnet using X-ray absorption spectroscopy

We report x-ray absorption and x-ray linear dichroism measurements at the Fe L2,3 edges of the geometrically frustrated systems of potassium and hydronium iron jarosite. Comparison with simulated spectra, involving ligand-field multiplet calculations modelling the 3d-2p hybridization between the iron ion and the oxygen ligands, has yielded accurate estimates for the ligand metal-ion hybridization and the resulting single-ion crystal field anisotropy energy. Using this method we provide an experimentally verified scenario for the appearance of a single-ion anisotropy in this nominally high-spin 3d5 orbital singlet 6S system, which accounts for features of the spin-wave dispersion in the long-range ordered ground state of potassium iron jarosite.