Battery Energy Storage: From First Principles to Device

Presentations

• 3D Imaging of lithium vacancy clusters in a Li-ion battery cathode material

  ORAL

  March 20, 2025, 11:30 AM – March 20, 2025, 11:42 AM

  Presenters

  • Dasol Yoon

    • Cornell University

  Authors

  • Dasol Yoon

    • Cornell University

  • Harikrishnan KP

    • Cornell University

  • Yu-Tsun Shao

    • University of Southern California

  • Yao Yang

    • Cornell University

  • Héctor D Abruña

    • Cornell University
    • Cornell Univeristy

  • David A Muller

    • Cornell University

  View abstract →

• RIXS of oxygen in oxide-based battery cathodes

  ORAL

  March 20, 2025, 11:42 AM – March 20, 2025, 11:54 AM

  Publication: 1. Yang, W. Nature Energy (Commentary) 2018, 3, 619-620.
  2. Dai, K. et al., Joule 2019, 3, 518-541.
  3. Wu, J., et al., Sci Adv 2020, 6, eaaw3871.
  4. Zhuo, Z. Q., et al., Joule 2021, 5, 975-997.

  Presenters

  • Wanli Yang

    • Lawrence Berkeley National Lab

  Authors

  • Wanli Yang

    • Lawrence Berkeley National Lab

  • Thomas P Devereaux

    • Stanford University

  View abstract →

• Abstract Withdrawn

  ORAL · Withdrawn

  March 20, 2025, 11:54 AM – March 20, 2025, 12:06 PM

  View abstract →

• Defect-Induced Modifications of Ionic and Electronic Properties of LiBO₂: First-Principles Calculations

  ORAL

  March 20, 2025, 12:06 PM – March 20, 2025, 12:18 PM

  Publication: Ziemke et al., Formation of Lattice Vacancies and their Effects on Lithium-ion Transport in LiBO2 Crystals: Comparative Ab Initio Studies, J. Mat. Chem. A (under revision, preprint: https://doi.org/10.48550/arXiv.2410.06284)

  Presenters

  • Ha M Nguyen

    • University of Missouri-Columbia

  Authors

  • Ha M Nguyen

    • University of Missouri-Columbia

  • Carson D Ziemke

    • Department of Physics and Astronomy, University of Missouri-Columbia

  • Sebastián Amaya-Roncancio

    • Universidad de la Costa, Barranquilla, Colombia
    • Natural and Exact Sciences Department, Universidad de la Costa, Barranquilla, Colombia

  • Narendirakumar Narayanan

    • University of Missouri Research Reactor

  • Yangchuan Xing

    • University of Missouri
    • Chemical and Biomedical Engineering Department, University of Missouri-Columbia

  • John Gahl

    • University of Missouri
    • University of Missouri Research Reactor

  • Thomas W Heitmann

    • University of Missouri
    • MU Physics and Astronomy, Materials Science and Engineering Institute, Research Reactor
    • University of Missouri, Columbia

  • Carlos Wexler

    • University of Missouri
    • MU Physics and Astronomy, Materials Science and Engineering Institute

  View abstract →

• Surface Analysis of Thermal Neutron Irradiated LiBO₂: Implication for Use as Cathode Coating of Li-ion Batteries

  ORAL

  March 20, 2025, 12:18 PM – March 20, 2025, 12:30 PM

  Presenters

  • Thomas W Heitmann

    • University of Missouri
    • MU Physics and Astronomy, Materials Science and Engineering Institute, Research Reactor
    • University of Missouri, Columbia

  Authors

  • Thomas W Heitmann

    • University of Missouri
    • MU Physics and Astronomy, Materials Science and Engineering Institute, Research Reactor
    • University of Missouri, Columbia

  • Ha M Nguyen

    • University of Missouri-Columbia

  • Carson Ziemke

    • University of Missouri - Columbia

  • Narendirakumar Narayanan

    • University of Missouri

  • Sebastián Amaya-Roncancio

    • Universidad de la Costa, Barranquilla, Colombia
    • Natural and Exact Sciences Department, Universidad de la Costa, Barranquilla, Colombia

  • Carlos Wexler

    • University of Missouri
    • MU Physics and Astronomy, Materials Science and Engineering Institute

  • John Gahl

    • University of Missouri
    • University of Missouri Research Reactor

  • Yangchuan Xing

    • University of Missouri
    • Chemical and Biomedical Engineering Department, University of Missouri-Columbia

  • Yangchuan Xing

    • University of Missouri
    • Chemical and Biomedical Engineering Department, University of Missouri-Columbia

  View abstract →

• Abstract Withdrawn

  ORAL · Withdrawn

  March 20, 2025, 12:30 PM – March 20, 2025, 12:42 PM

  View abstract →

• Abstract Withdrawn

  ORAL · Withdrawn

  March 20, 2025, 12:42 PM – March 20, 2025, 12:54 PM

  View abstract →

• Electronic transport in single and double layered V₂O₅

  ORAL

  March 20, 2025, 12:54 PM – March 20, 2025, 1:06 PM

  Presenters

  • Sakthi Kasthurirengan

    • University of Kansas

  Authors

  • Sakthi Kasthurirengan

    • University of Kansas

  • Hartwin Peelaers

    • University of Kansas

  View abstract →

• Computational methods to systematically identify intercalation sites

  ORAL

  March 20, 2025, 1:06 PM – March 20, 2025, 1:18 PM

  Presenters

  • Zachary Stordahl

    • Gustavus Adolphus College

  Authors

  • Zachary Stordahl

    • Gustavus Adolphus College

  • Veronica S Walker

    • Lycoming College

  • Hartwin Peelaers

    • University of Kansas

  View abstract →

• Intercalation Pathways in Vanadium Pentoxide

  ORAL

  March 20, 2025, 1:18 PM – March 20, 2025, 1:30 PM

  Presenters

  • Veronica S Walker

    • Lycoming College

  Authors

  • Veronica S Walker

    • Lycoming College

  • Zachary Stordahl

    • Gustavus Adolphus College

  • Hartwin Peelaers

    • University of Kansas

  View abstract →

• Structural Transformations at the Atomic Scale in Vanadium oxides upon Mg²⁺ intercalation

  ORAL

  March 20, 2025, 1:30 PM – March 20, 2025, 1:42 PM

  Presenters

  • Danial Zangeneh

    • University of Illinois Chicago

  Authors

  • Danial Zangeneh

    • University of Illinois Chicago

  • Anwesa Samanta

    • University of Illinois Chicago

  • Arashdeep Thind

    • University of Illinois Chicago

  • Robert F Klie

    • University of Illinois at Chicago

  • Jordi Cabana

    • University of Illinois Chicago / Argonne National Laboratory

  View abstract →

• DFT+DMFT Study of Li-Induced Delocalized Polaron and Burstein-Moss Shift in α-V₂O₅

  ORAL

  March 20, 2025, 1:42 PM – March 20, 2025, 1:54 PM

  Publication: PHYSICAL REVIEW B 108, 205122 (2023)

  Presenters

  • Alex T Lee

    • University of Illinois at Chicago
    • Chemical Engineering, UIC

  Authors

  • Alex T Lee

    • University of Illinois at Chicago
    • Chemical Engineering, UIC

  • Huu T Do

    • University of Illinois at Chicago

  • Hyowon Park

    • University of Illinois at Chicago

  • Anh T Ngo

    • University of Illinois at Chicago
    • Chemical Engineering, UIC

  View abstract →

• Asymmetric ether solvents for high-rate lithium metal battery electrolytes

  ORAL

  March 20, 2025, 1:54 PM – March 20, 2025, 2:06 PM

  Publication: "Asymmetric ether solvents for high-rate lithium metal battery electrolytes", submitted.

  Presenters

  • Aditya Shah

    • Stanford University

  Authors

  • Aditya Shah

    • Stanford University

  • Rok Choi

    • Stanford University

  • Zhenan Bao

    • Stanford University

  • Yi Cui

    • Stanford University

  • Jian Qin

    • Stanford University

  View abstract →

• Molecular dynamics insights into Ca-based salts in organic electrolyte

  ORAL

  March 20, 2025, 2:06 PM – March 20, 2025, 2:18 PM

  Presenters

  • M.D. Hashan C Peiris

    • Binghamton University - SUNY

  Authors

  • M.D. Hashan C Peiris

    • Binghamton University - SUNY

  • Manuel Smeu

    • Binghamton University

  View abstract →