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Magnetic Couplings in Edge-Sharing High-Spin d<sup>7</sup> Compounds

ORAL

Abstract

High-spin d7 Co(II) compounds have recently been identified as possible platforms for realising highly anisotropic and bond-dependent couplings featured in quantum-compass models such as the celebrated Kitaev model. In order to evaluate this potential, we consider all symmetry-allowed contributions to the magnetic exchange for ideal edge-sharing bonds. Through a combination of ab-initio calculations we conclude that bond-dependent couplings are generally suppressed in favor of Heisenberg or XXZ exchange for real materials. Consequences for prominent Co(II) materials will be discussed.

Publication: S. M. Winter, arXiv preprint: arXiv:2204.09856 (2022).

Presenters

  • Stephen Winter

    Wake Forest University

Authors

  • Stephen Winter

    Wake Forest University