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Designing nickelate superconductors with $d^8$ configuration exploiting mixed-anion strategy

Published 2 Jul 2020 in cond-mat.supr-con and cond-mat.str-el | (2007.01153v3)

Abstract: Inspired by a recently proposed superconducting mechanism for a new cuprate superconductor Ba$2$CuO${3+\delta}$, we theoretically design an unconventional nickelate superconductor with $d8$ electron configuration. Our strategy is to enlarge the on-site energy difference between $3d_{x2-y2}$ and other $3d$ orbitals by adopting halogens or hydrogen as out-of-plane anions, so that the $3d$ bands other than $d_{x-y2}$ lie just below the Fermi level for the $d8$ configuration, acting as incipient bands that enhance superconductivity. We also discuss a possible relevance of the present proposal to the recently discovered superconductor (Nd,Sr)NiO$_2$.

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