Chromium analogues of Iron-based superconductors
Abstract
We theoretically investigate the (Cr) compound BaCrAs and show that, despite non-negligible differences in the electronic structure, its many-body physics mirrors that of BaFeAs, which has instead a (Fe) configuration. This reflects a symmetry of the electron correlation effects around the half-filled Mott insulating state. The experimentally known metallic antiferromagnetic phase is correctly modeled by dynamical mean-field theory, and for realistic values of the interaction it shows a moderate mass enhancement of order 2. This value decreases if the ordered moment grows as a result of a stronger interaction. The antiferromagnetic phase diagram for this shows similarities with that calculated for the systems. Correspondingly, in the paramagnetic phase the influence of the half-filled Mott insulator shows up as a crossover from a weakly correlated to an orbitally differentiated "Hund's metal" phase which reflects an analogous phenomenon in iron compounds including a strong enhancement of the compressibility in a zone just inside the frontier between the normal and the Hund's metal. The experimental evidence and our theoretical description place BaCrAs at interaction strength slightly below the crossover which implies that negative pressures and/or electron doping (e.g. Cr Mn,Fe or Ba Sc,Y,La) might strongly enhance the compressibility, thereby possibly inducing a pairing instability in this non-superconducting compound.
Keywords
Cite
@article{arxiv.1610.10054,
title = {Chromium analogues of Iron-based superconductors},
author = {Martin Edelmann and Giorgio Sangiovanni and Massimo Capone and Luca de' Medici},
journal= {arXiv preprint arXiv:1610.10054},
year = {2017}
}
Comments
8 pages, 8 figures