Published in

American Physical Society, Physical review B, 11(89), 2014

DOI: 10.1103/physrevb.89.115131

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Universal metastability of the low-spin state in Co2+systems: Non-Mott type pressure-induced spin-state transition in CoCl2

Journal article published in 2014 by Bongjae Kim ORCID, Kyoo Kim, B. I. Min
This paper was not found in any repository, but could be made available legally by the author.
This paper was not found in any repository, but could be made available legally by the author.

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Abstract

We have investigated the pressure-induced spin-state transition in Co2+ systems in terms of a competition between Hund's exchange energy (J) and crystal-field splitting (ΔCF). First, we show the universal metastability of the low-spin state in octahedrally coordinated Co2+ systems. Then we present the strategy to search for a Co2+ system, for which the mechanism of spin-state and metal-insulator transitions is governed not by Mott physics but by J versus ΔCF physics. Using CoCl2 as a prototypical Co2+ system, we have demonstrated the pressure-induced spin-state transition from high-spin to low-spin, which is accompanied with insulator-to-metal and antiferromagnetic to half-metallic ferromagnetic transitions. Combined with the metastable character of Co2+ and the high compressibility nature of CoCl2, a transition pressure as low as 27 GPa can be identified on the basis of J versus ΔCF physics.