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Meeting MS&T24: Materials Science & Technology
Symposium Advances in Multiphysics Modeling and Multi-modal Imaging of Functional Materials
Presentation Title Thermodynamics and Ultrafast Evolution of Nanoscale Polar Structures
Author(s) Tiannan Yang, Long-Qing Chen
On-Site Speaker (Planned) Tiannan Yang
Abstract Scope The interplay between the polarization, charge, and strain orders within the confinement of ferroelectric heterostructures can give rise to various nanoscale polar structures such as vortices, skyrmion bubbles, and flux-closure nanodomains. These structures demonstrate fascinating static and dynamic properties that are vastly distinct from bulk ferroelectric domains. Here, by employing a dynamical phase-field model, we study the thermodynamics of the nanoscale polar structures in PbTiO3/SrTiO3 ferroelectric superlattices and their excited-state evolution dynamics during structural motion and phase transition. We simulate the unique structural response of polar vortices to an applied electric-field pulse and establish the equation of motion and the effective mass, showing good agreement with experimental measurements. We further demonstrate the light-induced formation of several hidden polar phases, resulting from the combined effects of the light-generated charge carriers and thermal energy. The present work offers theoretical guidance for exploring nanoscale polar structures and manipulating their dynamical functionalities.

OTHER PAPERS PLANNED FOR THIS SYMPOSIUM

A Thermodynamically Consistent Model for Yield Stress Fluids
Advances in THz Nano-Imaging: from Qubit Circuits to Topological Edge States
Analytical Model and Dynamical Phase-Field simulations of Terahertz Susceptibility in Ferroelectrics
Atom-to-Architecture Co-Design of Next-Generation High-Efficiency Microelectronics through High-Fidelity Device Modeling
Automated Quantification and Quality of Piezo Force Microscopy Results Especially for Polycrystalline Piezoelectrics
Chemo-Mechanical Origin of Accelerated Oxidation Near the Surface Flaws
Construction of Coarse-Grained Molecular Dynamics with Many-Body Non-Markovian Memory
Deep Operator Learning for Battery Characterization: From Materials to Systems
Determining Heterogeneous Elastic Properties of Soft Materials Using Physics-Informed Neural Networks
Equilibrium and Nonequilibrium Thermodynamics of Ferroics
Fouriera: Automated Spectral Methods for Multiphysics Problems via Symbolic Computing
Identifying Internal Process Order Parameters in Nonstoichiometric Oxides Described by Sublattice Model
Insight into Optical Control of Ferroelectrics Using Density Functional Theory
J-1: Integration of Phase-Field Model and Fast Fourier Transform-Based Crystal Plasticity with Geometrically Necessary Dislocations to Model Simulate Microstructure Evolution of Gradient Grained Metals
Molecular Dynamic Simulation of Pectin and Cellulose Nanocrystals Composites
Nanocomposite Electrical Generators: A Multiscale Approach
Numerical Solution for the Average Velocity of Dislocations Following the Kink-Pair Mechanism
Probing Short-Wavelength Magnonics Using IR-Band Stroboscope
The Cheap Stochastic Surrogate Model for the Precipitation Quasi-Geostrophic Equations
Thermodynamics and Ultrafast Evolution of Nanoscale Polar Structures
Ultrafast X-Ray Imaging and Dynamics in Functional Complex Oxides: Nanoscale Transformations and Dynamical Modes
X-Ray Ptychographic Tomography at the Diamond Light Source

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