Article 2 – Bending-induced isostructural transitions in ultrathin layers of van der Waals ferrielectrics

Abstract:

Using Landau-Ginzburg-Devonshire (LGD) phenomenological approach we analyze the bending-induced re-distribution of electric polarization and field, elastic stresses and strains inside ultrathin layers of van der Waals ferrielectrics. We consider a CuInP2S6 (CIPS) thin layer with fixed edges and suspended central part, the bending of which is induced by external forces. The unique aspect of CIPS is the existence of two ferrielectric states, FI1 and FI2, corresponding to big and small polarization values, which arise due to the specific four-well potential of the eighth-order LGD functional. When the CIPS layer is flat, the single-domain FI1 state is stable in the central part of the layer, and the FI2 states are stable near the fixed edges. With an increase of the layer bending below the critical value, the sizes of the FI2 states near the fixed edges decreases, and the size of the FI1 region increases. When the bending exceeds the critical value, the edge FI2 states disappear being substituted by the FI1 state, but they appear abruptly near the inflection regions and expand as the bending increases. The bending-induced isostructural FI1-FI2 transition is specific for the bended van der Waals ferrielectrics described by the eighth (or higher) order LGD functional with consideration of linear and nonlinear electrostriction couplings. The isostructural transition, which is revealed in the vicinity of room temperature, can significantly reduce the coercive voltage of ferroelectric polarization reversal in CIPS nanoflakes, allowing for the curvature-engineering control of various flexible nanodevices.

Title: Bending-induced isostructural transitions in ultrathin layers of van der Waals ferrielectrics

Authors: Anna N. Morozovska, Eugene A. Eliseev, Yongtao Liu, Kyle P. Kelley, Ayana Ghosh, Ying Liu, Jinyuan Yao, Nicholas V. Morozovsky, Andrei L Kholkin, Yulian M. Vysochanskii, Sergei V. Kalinin

Reference: Acta Materialia Volume 263, 15 January 2024, 119519

DOI: https://doi.org/10.1016/j.actamat.2023.119519

 

Related Posts

Article 5 – Size Effect of Negative Capacitance State and Subthreshold Swing in Van der Waals Ferrielectric Field-Effect Transistors

Abstract: Analytical calculations corroborated by the finite element modelling show that thin films of Van der Waals ferrielectrics covered by a 2D-semiconductor are promising candidates for the controllable reduction of the dielectric layer capacitance due to the negative capacitance (NC) effect emerging in the ferrielectric film. The NC state is

Read more »

Article 3 – Strain-polarization coupling in the low-dimensional Van der Waals Ferrielectrics

Abstract: Using the Landau-Ginzburg-Devonshire phenomenological approach we explore the strain-polarization coupling in the low-dimensional van der Waals ferrielectrics. We evolve the analytical model of the piezoelectric susceptibility of the material in response to the periodic strain modulation, such as caused by a surface acoustic wave. Numerical calculations are performed for

Read more »

Article 2 – Bending-induced isostructural transitions in ultrathin layers of van der Waals ferrielectrics

Abstract: Using Landau-Ginzburg-Devonshire (LGD) phenomenological approach we analyze the bending-induced re-distribution of electric polarization and field, elastic stresses and strains inside ultrathin layers of van der Waals ferrielectrics. We consider a CuInP2S6 (CIPS) thin layer with fixed edges and suspended central part, the bending of which is induced by external

Read more »

Article 1 – The strain-induced transitions of the piezoelectric, pyroelectric, and electrocaloric properties of the CuInP2S6 films

Abstract: Low-dimensional ferroelectrics, ferrielectrics, and antiferroelectrics are of urgent scientific interest due to their unusual polar, piezoelectric, electrocaloric, and pyroelectric properties. The strain engineering and strain control of the ferroelectric properties of layered two-dimensional van der Waals materials, such as CuInP2(S,Se)6 monolayers, thin films, and nanoflakes, are of fundamental interest

Read more »