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Meeting MS&T24: Materials Science & Technology
Symposium Materials Informatics for Images and Multi-dimensional Datasets
Presentation Title Hierarchical Bayesian Models for Automating Structural Materials Characterization
Author(s) Brian DeCost, Howie Joress
On-Site Speaker (Planned) Brian DeCost
Abstract Scope Machine learning systems are being widely deployed to accelerate measurements of the structure, properties, and performance of materials. The black-box nature of the models used by these systems can limit the ability to decouple the effects of competing physical phenomena, particularly in small data or active learning settings. Our approach blends non-parametric machine learning models and Bayesian inference in physical models. Two challenging structural materials characterization tasks highlight this approach: quantitative analysis of multiphase x-ray diffraction (XRD) data and quantification of chemical short range order in multicomponent alloys via EXAFS. We show how to incorporate physical intuition into hierarchical priors, and how to incorporate flexible Gaussian Process modeling components for features without concrete physical models. Our long term goal is automated online analysis that can drive adaptive measurement selection with the aim of enabling comprehensive understanding of the relationship between structure and properties.

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Autonomous approaches for determining structure-processing-property relationships in materials
Categorization of Fracture Surfaces using Deep Learning-enabled 2D Image Analysis
Deep Learning Accelerated Lab-Scale X-Ray Computed Tomography of Low-Melting-Point Solder Alloys Used in Heterogeneously Integrated Semiconductor Packages
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Extraction of Local Scalar 3D Microstructural Properties of SOFC Electrodes from 2D Micrographs using Convolutional Neural Networks.
Feature Extraction from SEM Images of Fatigue Fracture Surfaces
Foundation models for multimodal data mining with applications in materials science.
Hierarchical Bayesian Models for Automating Structural Materials Characterization
Machine Learning Enhanced Data Analytics for Transmission Electron Microscopy
Synthetic 3D Microstructure Generation of Solid Oxide Cell Electrodes using Denoising Diffusion Models

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