Effects of single- and multi-substituted Zn ions in doped-122 type iron-based superconductors
Abstract
Recent experiments on Zn-substituted 122-type iron-based superconductors (FeSCs) at electron- and hole- doped region provide us with a testing ground for understanding the effect of Zn impurities in these systems. Our first-principle calculations of the electronic structure reveal that the Zn 3d orbitals are far below the Fermi level and chemically inactive, while the Zn 4s-orbital is partially occupied and its wave function overlapping with those 3d-orbitals of neighboring Fe-ions. This suggests that the impurity effect is originating in the Zn 4s-orbital, not its 3d-orbitals. Employing a phenomenological two-orbital lattice model for 122-FeSCs and the self-consistent Bogoliubov-de Gennes equations, we study how the Zn-impurities suppress the superconductivity in electron- and hole- doped compounds. Our obtained results qualitatively agree with the experimental measurements.
Keywords
Cite
@article{arxiv.1604.01323,
title = {Effects of single- and multi-substituted Zn ions in doped-122 type iron-based superconductors},
author = {YuanYuan Zhao and Bo Li and Wei Li and Hong-Yi Chen and Kevin E. Bassler and C. S. Ting},
journal= {arXiv preprint arXiv:1604.01323},
year = {2016}
}
Comments
Accepted for publication in Phys. Rev. B