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Meeting MS&T24: Materials Science & Technology
Symposium Advances in Multiphysics Modeling and Multi-modal Imaging of Functional Materials
Presentation Title Deep Operator Learning for Battery Characterization: From Materials to Systems
Author(s) Wei Li, Ruqing Fang, Junning Jiao, Georgios N. Vassilakis, Juner Zhu
On-Site Speaker (Planned) Juner Zhu
Abstract Scope Recent advances in scientific machine learning (SciML) have shed light on modeling complex engineered systems, including batteries. Battery materials are functional through a combination of multiphysics processes, including pattern formation. Simulations of real patterns in battery materials incur significant computational costs, which could be alleviated by leveraging large image datasets. We developed Phase-Field DeepONet, a physics-informed operator neural network framework that predicts the dynamic responses of systems governed by gradient flows of free-energy functionals. The approach is demonstrated in solving the Allen-Cahn and Cahn-Hilliard equations. We also explored a technical roadmap to scale up material-level simulations to the system level by replacing governing equations of the sub-models with pre-trained neural networks (DeepONets). A successful preliminary example will be demonstrated on Li-metal solid-state batteries. The SciML-based framework shows significantly improved computational efficiency compared to conventional approaches.

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A Thermodynamically Consistent Model for Yield Stress Fluids
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Analytical Model and Dynamical Phase-Field simulations of Terahertz Susceptibility in Ferroelectrics
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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
Explicit Separation of Edge and Screw Dislocation Mobility and Density Evolution Law in BCC Single Crystal Plasticity Model
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Identifying Internal Process Order Parameters in Nonstoichiometric Oxides Described by Sublattice Model
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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
Location Preference of Boron and Nitrogen Dopants at Graphene/Copper Interface
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Nanoscale Magnetic Imaging Using Polarised X-Rays
Nonparametric Learning of Kernels in Nonlocal Operators
Probing Short-Wavelength Magnonics Using IR-Band Stroboscope
The Cheap Stochastic Surrogate Model for the Precipitation Quasi-Geostrophic Equations
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