Topological, Highly-Correlated, and Complex Materials

Presentations

• Synthesis of the post-diamond BC8 phase of carbon with exascale computers and experiment

  ORAL · Invited

  March 19, 2025, 11:00 AM – March 19, 2025, 11:36 AM

  Presenters

  • Ivan Oleynik

    University of South Florida

  Authors

  • Ivan Oleynik

    University of South Florida

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• Machine Learning-Guided Discovery of Ce-based Ternary Intermetallics

  ORAL

  March 19, 2025, 11:36 AM – March 19, 2025, 11:48 AM

  Publication: https://arxiv.org/abs/2407.11208

  Presenters

  • Weiyi Xia

    Ames National Laboratory

  Authors

  • Weiyi Xia

    Ames National Laboratory

  • Wei-Shen Tee

    Iowa State University

  • Paul C Canfield

    Iowa State University, Ames National Laboratory, and Department of Physics and Astronomy, Iowa State University, Ames National Laboratory and Iowa State University

  • Fernando A Garcia

    Iowa State University

  • Raquel A. Ribeiro

    Iowa State University

  • Yongbin Lee

    Iowa State University

  • Liqin Ke

    Ames National Laboratory

  • Rebecca A Flint

    Iowa State University

  • Cai-Zhuang Wang

    Ames National Lab, Iowa State University

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• Dynamical Stability of Ce-based Intermetallic Ternary Compounds Predicted By Machine-Learning-Guided Studies

  ORAL

  March 19, 2025, 11:48 AM – March 19, 2025, 12:00 PM

  Presenters

  • Wei-Shen Tee

    Iowa State University

  Authors

  • Wei-Shen Tee

    Iowa State University

  • Weiyi Xia

    Ames National Lab

  • Rebecca A Flint

    Iowa State University

  • Cai-Zhuang Wang

    Ames National Lab, Iowa State University

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• Using DFT to investigate Ca₂MoO₄ as a potential MIT candidate

  ORAL

  March 19, 2025, 12:00 PM – March 19, 2025, 12:12 PM

  Presenters

  • Larry Chen

    Northwestern University

  Authors

  • Larry Chen

    Northwestern University

  • James M Rondinelli

    Northwestern University, Northwestern University, Department of Materials Science and Engineering, Department of Material Science and Engineering, Northwestern University

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• Weyl fermions with various chiralities in an f-electron ferromagnetic system: PrB₄

  ORAL

  March 19, 2025, 12:12 PM – March 19, 2025, 12:24 PM

  Publication: Physical Review B 110, 075156 (2024)

  Presenters

  • Chang-Jong Kang

    Chungnam Natl Univ

  Authors

  • Chang-Jong Kang

    Chungnam Natl Univ

  • Dong-Choon Ryu

    Chungnam National University

  • Junwon Kim

    POSTECH

  • Bongjae Kim

    Kyungpook National University

  • B. I. Min

    POSTECH

  • Kyoo Kim

    Rutgers University, New Brunswick, Korea Atomic Energy Research Institute

  View abstract →

• Abstract Withdrawn

  ORAL Withdrawn

  March 19, 2025, 12:24 PM – March 19, 2025, 12:36 PM

  View abstract →

• Finding the symmetries of defects in 2D quantum materials

  ORAL

  March 19, 2025, 12:36 PM – March 19, 2025, 12:48 PM

  Publication: B. Field, S. M. Griffin, "Scanning tables of the layer groups", arXiv:2410.18750

  Presenters

  • Bernard A Field

    Lawrence Berkeley National Laboratory

  Authors

  • Bernard A Field

    Lawrence Berkeley National Laboratory

  • Sinead M Griffin

    Lawrence Berkeley National Laboratory, Materials Sciences Division and Molecular Foundry, LBNL, Materials Sciences Division and Molecular Foundry, Berkeley Lab, Lawrence Berkeley National Lab

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• First-principles study of novel honeycomb-shaped 2D oxygen crystal on an ultraflat Cu (111)

  ORAL

  March 19, 2025, 12:48 PM – March 19, 2025, 1:00 PM

  Publication: preprint: https://www.researchsquare.com/article/rs-4940255/v1

  Presenters

  • BINOD Regmi

    Mississippi State University

  Authors

  • BINOD Regmi

    Mississippi State University

  • Se-Young Jeong

    Korea Advanced Institute of Science and Technology, Pusan National University

  • Su Jae Kim

    Pusan National University

  • Nguyen Huu Lam

    University of Ulsan

  • Hee-Chang Kyung

    Korea Advanced Institute of Science and Technology

  • Hye-Won Ko

    Korea Advanced Institute of Science and Technology

  • Yousil Lee

    Copper Innovative Technology (CIT) Co. Busan

  • Young-Min Kim

    Department of Energy Science, Sungkyunkwan University

  • Kyung-Jin Lee

    KAIST, Korea Advanced Institute of Science and Technology

  • Seong-Gon Kim

    Mississippi state university

  • Ganbat Duvjir

    Department of Semiconductor Physics and Engineering, University of Ulsan

  • Jungdae Kim

    Department of Semiconductor Physics and Engineering, University of Ulsan, University of Ulsan

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• A graph theoretical representation of multidomain nanoparticle morphologies

  ORAL

  March 19, 2025, 1:00 PM – March 19, 2025, 1:12 PM

  Publication: Sandraz, E. & Wolverton, C. A graph theoretical representation of multidomain nanoparticle morphologies. In prep. (2024)

  Presenters

  • Elodie Sandraz

    Northwestern University

  Authors

  • Elodie Sandraz

    Northwestern University

  • Christopher M Wolverton

    Northwestern University

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• Modeling the Morphology of Polymorphic Manganese Sulfide Nanocrystals

  ORAL

  March 19, 2025, 1:12 PM – March 19, 2025, 1:24 PM

  Presenters

  • Junchi Chen

    Washington University in St. Louis

  Authors

  • Junchi Chen

    Washington University in St. Louis

  • Robert Bruce Wexler

    Washington University, St. Louis

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• Revealing the Active Site Local Atomic Environment of Oxide-supported Ag Single Atom Catalyst

  ORAL

  March 19, 2025, 1:24 PM – March 19, 2025, 1:36 PM

  Presenters

  • Syeda Faiza Rubab Sherazi

    University of Central Florida

  Authors

  • Syeda Faiza Rubab Sherazi

    University of Central Florida

  • Duy Le

    University of Central Florida

  • Shaohua Xie

    University of California, Riverside

  • Kailong Ye

    University of California, Riverside

  • Fudong Liu

    University of California, Riverside

  • Talat S Rahman

    University of Central Florida

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• Efficient ab initio prediction of liquidus curves

  ORAL

  March 19, 2025, 1:36 PM – March 19, 2025, 1:48 PM

  Presenters

  • Wenhao Sun

    University of Michigan

  Authors

  • Wenhao Sun

    University of Michigan

  View abstract →