Numerical Discretization of Variational Phase Field Model for Phase Transitions in Ferroelectric Thin Films

Numerical Discretization of Variational Phase Field Model for Phase Transitions in Ferroelectric Thin Films

Year:    2021

Author:    Ruotai Li, Qiang Du, Lei Zhang

Communications in Computational Physics, Vol. 29 (2021), Iss. 3 : pp. 729–746

Abstract

Phase field methods have been widely used to study phase transitions and polarization switching in ferroelectric thin films. In this paper, we develop an efficient numerical scheme for the variational phase field model based on variational forms of the electrostatic energy and the relaxation dynamics of the polarization vector. The spatial discretization combines the Fourier spectral method with the finite difference method to handle three-dimensional mixed boundary conditions. It allows for an efficient semi-implicit discretization for the time integration of the relaxation dynamics. This method avoids explicitly solving the electrostatic equilibrium equation (a Poisson equation) and eliminates the use of associated Lagrange multipliers. We present several numerical examples including phase transitions and polarization switching processes to demonstrate the effectiveness of the proposed method.

You do not have full access to this article.

Already a Subscriber? Sign in as an individual or via your institution

Journal Article Details

Publisher Name:    Global Science Press

Language:    English

DOI:    https://doi.org/10.4208/cicp.OA-2020-0118

Communications in Computational Physics, Vol. 29 (2021), Iss. 3 : pp. 729–746

Published online:    2021-01

AMS Subject Headings:    Global Science Press

Copyright:    COPYRIGHT: © Global Science Press

Pages:    18

Keywords:    Ferroelectric phase field phase transition polarization switching minimum energy path.

Author Details

Ruotai Li

Qiang Du

Lei Zhang

  1. Temperature-dependent damping mechanism in ferroelastic-reinforced composites

    Xiang, Wenting

    Tang, Min

    Zhu, Wenhui

    Chai, Jingheng

    Wu, Qi

    Zhang, Zihan

    Guo, Xiaoxu

    Yang, Zheng

    Yan, Yongke

    Geng, Liwei D.

    Journal of Applied Physics, Vol. 136 (2024), Iss. 5

    https://doi.org/10.1063/5.0218133 [Citations: 0]