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Meeting MS&T22: Materials Science & Technology
Symposium Materials Processing and Fundamental Understanding Based on Machine Learning and Data Informatics
Presentation Title Composition and Property Prediction of Polymer-derived Silicon Oxycarbides
Author(s) Yi Je Cho, Harrison Chaney, Kathy Lu
On-Site Speaker (Planned) Yi Je Cho
Abstract Scope Polymer-derived silicon oxycarbide (SiOC) materials enable the formation of homogeneous microstructures and high temperature stable properties. However, the relationship between the processing parameters and microstructures/properties has not been clearly understood. In this study, a materials informatics approach was employed to analyze and estimate this relationship. The correlation analysis provided importance ranking of the process parameters, which can be later utilized for the fabrication process. Machine learning models with high accuracy were proposed using the ranked features obtained from the correlation analysis. ReaxFF simulations were performed to evaluate the fidelity of the machine learning models and to confirm the feasibility of the models for designing new SiOC materials. The data analytics workflow proposed in this study can be extended to different types of polymer-derived ceramics by incorporating various features and targets involved in the process, microstructures, and properties.

OTHER PAPERS PLANNED FOR THIS SYMPOSIUM

Addressing Data Needs for High Temperature Material Processing with Natural Language Processing
AI Driven Microscopic Analysis to Predict the Local Structure in Zirconia Ceramics
AI/ML-Driven Multi-Scale Modeling and Design of Structural Materials
B-5: Using Computer Vision and Machine Learning to Characterize Melt Pool Geometry in Additive Manufacturing
Comparison of Data Driven and Physics-informed Machine Learning Models for Temperature Prediction of Shear Assisted Processing and Extrusion
Composition and Property Prediction of Polymer-derived Silicon Oxycarbides
Computational and Machine Learning Studies of DNA-templated Dye Aggregate Design
Data-Driven Study of Shape Memory Behavior of Multi-component Ni-Ti Alloys
Graph Neural Network Modeling of Deforming Polycrystals
High-throughput Machine Learning Experiments with Graph Neural Networks for Predicting Abnormal Grain Growth in Polycrystalline Materials
Large Scale Atomistic Simulation of the B1-B4 Phase Transition of GaN with the Machine Learning Potential
Machine Learning Based Prediction of Cation Distribution in Complex Spinel Oxides as a Function of Processing Temperature
Machine Learning for Joint Quality Performance-determining Relationship between Intermetallic Properties and weld Microstructure of Al/steel Resistance Spot Welds
Microstructure Characterization and Reconstruction by Deep Learning Methodology
Unraveling the Process Fundamentals of Additive Friction Stir Deposition by Integrating Physics Simulation with Data-driven Approaches

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