Preparation, characterization and DFT+U study of the polar Fe3+-based phase Ba5Fe2ZnIn4S15 containing S = 5/2 zigzag chains

Author:

Almoussawi Batoul1,Duffort Victor1ORCID,Arevalo-Lopez Angel M.1ORCID,Braun Maxime1,Djelal Nora1,Kabbour Houria1ORCID

Affiliation:

1. Univ. Lille, CNRS, Centrale Lille, ENSCL, Univ. Artois, UMR 8181 – UCCS – Unité de Catalyse et Chimie du Solide, F-59000 Lille, France

Abstract

The polar chalcogenide phase Ba5Fe2ZnIn4S15 possesses weakly interacting magnetic zig-zag chains made of corner-sharing Fe3+S4 thus forming an AFM S = 5/2 spin chain system. The intrinsic polarization is mostly due to the anionic framework.

Funder

Centre National de la Recherche Scientifique

Ministère de l'Education Nationale, de l'Enseignement Superieur et de la Recherche

Agence Nationale de la Recherche

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

Reference26 articles.

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4. Effects of Cr doping on the superconductivity and magnetism of FeTe0.8S0.2

5. Plausible multiferroic and magneto-electric behaviour of polycrystalline Bi0.85Gd0.05La0.1FeO3 at room temperature

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