Magnetic and structural transitions in layered iron arsenide systems: A Fe2 As2 versus RFeAsO

Abstract

Resistivity, specific-heat, and magnetic-susceptibility measurements performed on SrFe2 As2 samples evidence a behavior very similar to that observed in LaFeAsO and BaFe2 As2, with the difference being that the formation of the spin-density wave and the lattice deformation occur in a pronounced first-order transition at T0 =205 K. Comparing further data evidences that the Fe magnetism is stronger in SrFe2 As2 and in EuFe2 As2 than in the other layered FeAs systems investigated up to now. Full potential local-density approximation band-structure calculations confirm the large similarity between the compounds, especially for the relevant low energy Fe3d states. The relation between structural details and magnetic order is analyzed. © 2008 The American Physical Society.