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Quantum-Chemical Analysis of the Structural Phase Transition in Quasi–One-Dimensional Ferroelectrics Pb(H/D)PO4

  • Proceedings of the XXI National Conference on Magnetoelectrics Physics
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Bulletin of the Russian Academy of Sciences: Physics Aims and scope

Abstract

The applicability of the simplest cluster models for semi-quantitative descriptions of the thermodynamics of structural phase transitions in quasi–one-dimensional ferroelectrics is considered. A lead hydrogen phosphate is used as an example. Even such simple models can qualitatively and, in some cases, quantitatively reproduce experimental data.

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Correspondence to S. P. Dolin.

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Original Russian Text © S.P. Dolin, T.Yu. Mikhailova, N.N. Breslavskaya, 2018, published in Izvestiya Rossiiskoi Akademii Nauk, Seriya Fizicheskaya, 2018, Vol. 82, No. 3, pp. 327–330.

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Dolin, S.P., Mikhailova, T.Y. & Breslavskaya, N.N. Quantum-Chemical Analysis of the Structural Phase Transition in Quasi–One-Dimensional Ferroelectrics Pb(H/D)PO4. Bull. Russ. Acad. Sci. Phys. 82, 284–286 (2018). https://doi.org/10.3103/S1062873818030061

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  • DOI: https://doi.org/10.3103/S1062873818030061

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