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Starts 24 June 2025 00:37

Ends 24 June 2025

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Ontologies, Graph Deep Learning, and AI in Materials Science

Explore ontologies, graph deep learning, and AI in materials science, focusing on advanced manufacturing and synchrotron science. Learn about innovative approaches for multimodal analysis and decision-making.
Inside Livermore Lab via YouTube

Inside Livermore Lab

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Overview

Explore ontologies, graph deep learning, and AI in materials science, focusing on advanced manufacturing and synchrotron science. Learn about innovative approaches for multimodal analysis and decision-making.

Syllabus

  • Introduction to Ontologies in Materials Science
  • Definitions and applications of ontologies
    Role in data organization and classification
    Building and utilizing ontologies in materials science
  • Fundamentals of Graph Theory
  • Concepts of nodes, edges, and graph-based data structures
    Key algorithms and their applications in material data
  • Graph Deep Learning Techniques
  • Introduction to graph neural networks (GNN)
    Variants of GNNs: GCN, GAT, GraphSAGE
    Supervised and unsupervised learning with graphs
  • AI Applications in Materials Science
  • AI-driven discovery of new materials
    Multimodal AI approaches for synchrotron-based research
    Case studies in advanced manufacturing
  • Multimodal Analysis in Materials Science
  • Integration of multiple data sources (e.g., text, images, spectra)
    Techniques for data fusion and representation alignment
    AI-based decision-making in complex systems
  • Synchrotron Science and AI
  • Overview of synchrotron facilities and their role in materials analysis
    AI methods for synchrotron data interpretation
    Enhancing resolution and precision with AI techniques
  • Advanced Manufacturing and AI
  • Smart manufacturing systems and predictive maintenance
    Use of AI in process optimization and quality control
    Digital twins and simulation-driven design with AI
  • Practical Implementation and Tools
  • Software and tools for ontology development
    Graph deep learning frameworks (e.g., PyTorch Geometric, DGL)
    Case studies and project work
  • Ethical and Societal Implications
  • Impact of AI and automation on the materials industry
    Ethical considerations and sustainability in AI applications
  • Future Directions and Innovations
  • Emerging trends in AI and materials science
    Potential research areas and applications
  • Final Project and Assessment
  • Design, development, and presentation of a relevant AI application in materials science
    Evaluation based on innovation, technical implementation, and practical impact

Subjects

Data Science