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Showing 1–6 of 6 results
Advanced filters: Author: KyuJung Jun Clear advanced filters

  • Superionic lithium conductivity has only been observed in a few classes of materials, mostly in thiophosphates but rarely in oxides. Corner-sharing connectivity in an oxide crystal structure framework is now shown to promote superionic conductivity.

    • KyuJung Jun
    • Yingzhi Sun
    • Gerbrand Ceder
    Research
    Nature Materials
    Volume: 21, P: 924-931

  • A generative framework that accelerates the simulations of atomic transport in crystalline solids is developed, enabling large-scale screening and extending simulations to larger spatiotemporal scales for energy storage materials.

    • Juno Nam
    • Sulin Liu
    • Rafael Gómez-Bombarelli
    Research
    Nature Machine Intelligence
    Volume: 7, P: 1625-1635

  • Precipitation of target functional materials from water is sensitive to precursor selection and aqueous electrochemistry (pH and redox potential), where competition between thermodynamics and kinetics can yield undesired impurity phases. Now, a theoretical framework to identify optimal synthesis conditions of target materials is developed and validated against a literature dataset and direct experiments.

    • Zheren Wang
    • Yingzhi Sun
    • Gerbrand Ceder
    ResearchOpen Access
    Nature Synthesis
    Volume: 3, P: 527-536

  • An outstanding challenge in materials science is doing large-scale simulations with complex electron interactions. Deng and colleagues introduce a universal graph neural network-based interatomic potential integrating atomic magnetic moments as charge constraints, which allows for capturing subtle chemical properties in several lithium-based solid-state materials

    • Bowen Deng
    • Peichen Zhong
    • Gerbrand Ceder
    ResearchOpen Access
    Nature Machine Intelligence
    Volume: 5, P: 1031-1041

  • Inorganic lithium superionic conductors are central to the development of solid-state batteries, but the availability of practical superionic conductors is still limited. This Review highlights structural and chemical strategies to enhance ionic conductivity and maps a strategic approach to discover, design and optimize fast lithium-ion conductors for safe and high-energy-density all-solid-state batteries.

    • KyuJung Jun
    • Yu Chen
    • Gerbrand Ceder
    Reviews
    Nature Reviews Materials
    Volume: 9, P: 887-905