Unveiling Frequency-Dependent Electromechanical Dynamics in Ferroelectric BaTiO3 Nanofilm with a Core-Shell Structure

Abstract

Diverse domain patterns significantly influence the nonlinear electromechanical behaviors of ferroelectric nanomaterials, with polarization switching under strong electric fields being inherently a frequency-dependent phenomenon. Nevertheless, research in this area remains limited. In this study, we present a phase-field investigation of frequency-dependent electromechanical dynamics of a polycrystalline BaTiO3 nanofilm with a core-shell structure, subjected to applied frequencies ranging from 1 to 80 kHz. Our findings elucidate the microstructural mechanisms underlying the electromechanical behaviors observed in these materials. The effect of the grain size and the strains effect are also taken into account. Hysteresis and butterfly loops exhibit a marked change in shape as the frequency changes. We discuss the underlying domain-switching dynamics as a basis for evaluating such frequency-dependent properties. In addition, we examine the scaling behaviors of the dynamic hysteresis and the influence of grain boundaries on the domain structure. We can also observe from hysteresis loops that the remnant polarization and coercive field significantly diminish when grain sizes decrease from 60 to 5 nm. A smaller grain size of the nanofilm yields a larger percentage of the dielectric grain boundary, which “dilutes” the overall ferroelectricity of the film. A vortex domain structure is more likely to form at low frequency and a small grain size.