Non-local correlations in Iron Pnictides and Chalcogenides
Abstract
Deviations of low-energy electronic structure of iron-based superconductors from density functional theory predictions have been parametrized in terms of band- and orbital-dependent mass renormalizations and energy shifts. The former have typically been described in terms of a local self-energy within the framework of dynamical mean field theory, while the latter appears to require non-local effects due to interband scattering. By calculating the renormalized bandstructure in both random phase approximation (RPA) and the two-particle self-consistent approximation (TPSC), we show that correlations in pnictide systems like LaFeAsO and LiFeAs can be described rather well by a non-local self-energy. In particular, Fermi pocket shrinkage as seen in experiment occurs due to repulsive interband finite-energy scattering. For the canonical iron chalcogenide system FeSe in its bulk tetragonal phase, the situation is however more complex since even including momentum-dependent band renormalizations cannot explain experimental findings. We propose that the long-range Coulomb interaction may play an important role in band-structure renormalization in FeSe. We further compare our evaluations of non-local quasiparticle scattering lifetime within RPA and TPSC with experimental data for LiFeAs.
Cite
@article{arxiv.2003.01638,
title = {Non-local correlations in Iron Pnictides and Chalcogenides},
author = {Shinibali Bhattacharyya and Kristofer Björnson and Karim Zantout and Daniel Steffensen and Laura Fanfarillo and Andreas Kreisel and Roser Valentí and Brian M. Andersen and P. J. Hirschfeld},
journal= {arXiv preprint arXiv:2003.01638},
year = {2020}
}
Comments
12 Pages, 8 figures