Controlling the off-center positions of anions through thermodynamics and kinetics in flexible perovskite-like materials

Due to the network flexibility of their BX 3 sub-lattice, a manifold of polymorphs with potential multiferroic applications can be found in perovskite-like ABX 3 materials under different pressure and temperature conditions. The potential energy surface of these compounds usually presents equivalent...

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Veröffentlicht in:Physical chemistry chemical physics : PCCP 2021-02, Vol.23 (8), p.4491-4499
Hauptverfasser: Lobato, A, Recio-Poo, M, Otero-de-la-Roza, A, Salvadó, M. A, Recio, J. M
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Sprache:eng
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