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ACrF3 Jahn-Teller-Distorted Fluoroperovskites: Expanding to RbCrF3 and CsCrF3.

Created on 05 Sep 2025

Authors

Øystein S Fjellvåg, Heesoo Park, Fabien Veillon, Jike Lyu, Marisa Medarde, Salah B Amedi, Fabian L M Bernal, Helmer Fjellvåg, Bjørn C Hauback, Bruno Gonano

Published in

Inorganic chemistry. Sep 04, 2025. Epub Sep 04, 2025.

Abstract

The Jahn-Teller effect significantly affects the CrF6 octahedra in Cr(II) fluoroperovskites. Here, we report the synthesis, crystal structures, and magnetic properties of RbCrF3 and CsCrF3, thereby completing a comprehensive investigation of the ACrF3 fluoroperovskites. Powder samples are prepared using a wet-chemical method, which allows stabilization of Cr(II). RbCrF3 predominantly adopts the P4/mbm space group; however, the absence of the expected (211) peak suggests a limited correlation length, and we demonstrate that this is a result of stacking faults in the rotation of the distorted CrF6 octahedra along the c-axis. We estimate around 5-10% of I4/mcm-type stacking in P4/mbm for RbCrF3. In contrast, CsCrF3 showcases a two-phase coexistence of I4/mcm and P4/mbm polymorphs and, as such, parallels to KCuF3. We discuss and highlight the interplay between the impact of A-site cations and the Jahn-Teller effect acting on CrF6 octahedra. Antiferromagnetic interactions dominate the paramagnetic regime, and RbCrF3 and CsCrF3 both have a Weiss temperature of -12 K, associated with Néel temperatures of 50 and 47 K, respectively. The effective paramagnetic moments of 4.65 and 4.68 μB for RbCrF3 and CsCrF3 are in good agreement with S = 2 spin configuration.

PMID:
40906891
Bibliographic data and abstract were imported from PubMed on 05 Sep 2025.

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