Materials Science and Spectroscopy Using Deep Learning

Presentations

• Physics-Guided Machine Learning Framework for Real-Time Multi-Scale Materials Characterization at Light Sources

  ORAL · Invited

  March 18, 2025, 11:30 AM – March 18, 2025, 12:06 PM

  Publication: https://doi.org/10.1063/5.0132433
  https://link.springer.com/article/10.1007/s11837-021-04889-3
  https://doi.org/10.1016/j.scriptamat.2020.10.028
  https://doi.org/10.1063/5.0014725
  https://doi.org/10.1016/j.actamat.2019.03.026
  https://doi.org/10.21203/rs.3.rs-4555290/v1

  Presenters

  • Reeju Pokharel

    • Los Alamos National Laboratory

  Authors

  • Alexander Scheinker

    • Los Alamos National Laboratory (LANL)

  • Reeju Pokharel

    • Los Alamos National Laboratory

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• Novel approaches to studying frustrated charge interactions in strongly correlated materials

  ORAL · Invited

  March 18, 2025, 12:06 PM – March 18, 2025, 12:42 PM

  Publication: S. J. Gomez Alvarado, G. Pokharel, B. R. Ortiz, J. A. M. Paddison, S. Sarker, J. P. C. Ruff, and S. D. Wilson, Frustrated Ising charge correlations in the kagome metal ScV6Sn6. Phys. Rev. B 110 (2024) L140304. [DOI: 10.1103/PhysRevB.110.L140304] [arXiv: 2407.12099]
  
  S. J. Gomez Alvarado, J. R. Chamorro, A. R. Jackson, G. Pokharel, R. Gomez, B. R. Ortiz, S. Sarker, L. Kautzsch, L. Gallington, R. Seshadri, and S. D. Wilson, Interleaved lattice and magnetic frustration in LnCd3P3 (Ln = La, Ce, Pr, Nd). (In preparation)

  Presenters

  • Steven J Gomez Alvarado

    • University of California, Santa Barbara
    • Materials Department, University of California, Santa Barbara, CA 93106-5050, U.S.A.

  Authors

  • Steven J Gomez Alvarado

    • University of California, Santa Barbara
    • Materials Department, University of California, Santa Barbara, CA 93106-5050, U.S.A.

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• Graph and Generative Large Language Models for Data-Driven Materials Discovery

  ORAL

  March 18, 2025, 12:42 PM – March 18, 2025, 12:54 PM

  Presenters

  • Yong Wei

    • University of North Georgia

  Authors

  • Yong Wei

    • University of North Georgia

  • Mingyuan Yan

    • University of North Georgia

  • Yuewei Lin

    • Brookhaven National Laboratory

  • Hanning Chen

    • University of Texas at Austin

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• Abstract Withdrawn

  ORAL · Withdrawn

  March 18, 2025, 12:54 PM – March 18, 2025, 1:06 PM

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• Leveraging Generative AI for Stress Prediction and Design of Architected Graphene Structures

  ORAL

  March 18, 2025, 1:06 PM – March 18, 2025, 1:18 PM

  Publication: Masrouri, Milad, Kamalendu Paul, and Zhao Qin. "Generative AI model trained by molecular dynamics for rapid mechanical design of architected graphene." Extreme Mechanics Letters 72 (2024): 102230.

  Presenters

  • Kamalendu Paul

    • Syracuse University

  Authors

  • Kamalendu Paul

    • Syracuse University

  • Milad Masrouri

    • Syracuse University

  • Zhao Qin

    • Syracuse University

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• Prediction of Frictional Contact Networks Using Deep Graph Convolutional Neural Network in Dense Suspensions. Part 1: Methods and Scalability

  ORAL

  March 18, 2025, 1:18 PM – March 18, 2025, 1:30 PM

  Publication: 1- A. Aminimajd, J. Maia, A. Singh, "Scalability of Graph Neural Network in Accurate Prediction of Force Chain Network in Suspensions.", Physical Review Letter (Under Review)
  2- https://arxiv.org/abs/2409.13160

  Presenters

  • Armin Aminimajd

    • Case Western Reserve University

  Authors

  • Armin Aminimajd

    • Case Western Reserve University

  • Joao M Maia

    • Case Western Reserve University

  • Abhinendra Singh

    • Case Western Reserve University

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• Abstract Withdrawn

  ORAL · Withdrawn

  March 18, 2025, 1:30 PM – March 18, 2025, 1:42 PM

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• Deep Learning Approach to Identifying New Infrared Spectroscopic Features Produced by Accelerated Aging of Cross-linked Polyethylene Pipe

  ORAL

  March 18, 2025, 1:42 PM – March 18, 2025, 1:54 PM

  Publication: [1] M. Grossutti et al., ACS Appl. Mater. Interfaces 15, 22532 (2023).

  Presenters

  • Zachery Evans

    • University of Guelph

  Authors

  • Zachery Evans

    • University of Guelph

  • Isaac Mercier

    • University of Guelph

  • Lauren Kauth

    • University of Waterloo

  • Michael Grossutti

    • University of Guelph

  • John R Dutcher

    • University of Guelph

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• Abstract Withdrawn

  ORAL · Withdrawn

  March 18, 2025, 1:54 PM – March 18, 2025, 2:06 PM

  View abstract →