Description of lattice anharmonicity observed in ferroelectrics with unusual three-well local potential

For Sn_2P_2S_6 family of uniaxial ferroelectrics, the anharmonic quantum oscillators model, based on local three-well potential for spontaneous polarization fluctuations, has been used for a description of anharmonic properties, namely thermal expansion. The calculated pseudospin fluctuations spectr...

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Main Authors: R. Yevych, Yu. Vysochanskii
Format: Article
Language:English
Published: Institute for Condensed Matter Physics 2018-09-01
Series:Condensed Matter Physics
Subjects:
Online Access:https://doi.org/10.5488/CMP.21.33001
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author R. Yevych
Yu. Vysochanskii
author_facet R. Yevych
Yu. Vysochanskii
author_sort R. Yevych
collection DOAJ
description For Sn_2P_2S_6 family of uniaxial ferroelectrics, the anharmonic quantum oscillators model, based on local three-well potential for spontaneous polarization fluctuations, has been used for a description of anharmonic properties, namely thermal expansion. The calculated pseudospin fluctuations spectra in ferroelectric phase demonstrate negative Grüneisen parameters for excitations that satisfy Curie-Weiss-like temperature and pressure dependencies in the vicinity of second order phase transition. Thermal expansion coefficient is calculated by evaluation of pseudospins entropy baric dependence. Negative thermal expansion in the ferroelectric phase of Sn_2P_2S_6 crystal is obtained which is in agreement with observed experimental data.
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spelling doaj.art-ff1b5b036fbd49fd99b40a7ffdba1d6e2022-12-22T03:57:26ZengInstitute for Condensed Matter PhysicsCondensed Matter Physics1607-324X2224-90792018-09-012133300110.5488/CMP.21.33001Description of lattice anharmonicity observed in ferroelectrics with unusual three-well local potentialR. YevychYu. VysochanskiiFor Sn_2P_2S_6 family of uniaxial ferroelectrics, the anharmonic quantum oscillators model, based on local three-well potential for spontaneous polarization fluctuations, has been used for a description of anharmonic properties, namely thermal expansion. The calculated pseudospin fluctuations spectra in ferroelectric phase demonstrate negative Grüneisen parameters for excitations that satisfy Curie-Weiss-like temperature and pressure dependencies in the vicinity of second order phase transition. Thermal expansion coefficient is calculated by evaluation of pseudospins entropy baric dependence. Negative thermal expansion in the ferroelectric phase of Sn_2P_2S_6 crystal is obtained which is in agreement with observed experimental data.https://doi.org/10.5488/CMP.21.33001ferroelectricslattice models in statistical physicsthermal expansion
spellingShingle R. Yevych
Yu. Vysochanskii
Description of lattice anharmonicity observed in ferroelectrics with unusual three-well local potential
Condensed Matter Physics
ferroelectrics
lattice models in statistical physics
thermal expansion
title Description of lattice anharmonicity observed in ferroelectrics with unusual three-well local potential
title_full Description of lattice anharmonicity observed in ferroelectrics with unusual three-well local potential
title_fullStr Description of lattice anharmonicity observed in ferroelectrics with unusual three-well local potential
title_full_unstemmed Description of lattice anharmonicity observed in ferroelectrics with unusual three-well local potential
title_short Description of lattice anharmonicity observed in ferroelectrics with unusual three-well local potential
title_sort description of lattice anharmonicity observed in ferroelectrics with unusual three well local potential
topic ferroelectrics
lattice models in statistical physics
thermal expansion
url https://doi.org/10.5488/CMP.21.33001
work_keys_str_mv AT ryevych descriptionoflatticeanharmonicityobservedinferroelectricswithunusualthreewelllocalpotential
AT yuvysochanskii descriptionoflatticeanharmonicityobservedinferroelectricswithunusualthreewelllocalpotential