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Showing 1–14 of 14 results
Advanced filters: Author: Muratahan Aykol Clear advanced filters
  • Degradation of cathode materials is a key factor hindering the long-term stability of lithium ion batteries. Here, the authors develop a high-throughput computational approach to design effective cathode coating materials, proposing a selection of candidate materials to help improve cathode lifetimes.

    • Muratahan Aykol
    • Soo Kim
    • C. Wolverton
    ResearchOpen Access
    Nature Communications
    Volume: 7, P: 1-12
  • Predicting the synthesizability of inorganic materials is challenging due to the many variables and complex phenomena involved in synthesis. Here, the authors combine material stabilities with a historical analysis of experimental discovery timelines as a temporal network to predict the synthesizability of hypothetical materials.

    • Muratahan Aykol
    • Vinay I. Hegde
    • Jens S. Hummelshøj
    ResearchOpen Access
    Nature Communications
    Volume: 10, P: 1-7
  • Batteries, as complex materials systems, pose unique challenges for the application of machine learning. Although a shift to data-driven, machine learning-based battery research has started, new initiatives in academia and industry are needed to fully exploit its potential.

    • Muratahan Aykol
    • Patrick Herring
    • Abraham Anapolsky
    Comments & Opinion
    Nature Reviews Materials
    Volume: 5, P: 725-727
  • This study introduces a2c, a computational method that leverages machine learning and atomistic simulations to predict the most likely crystallization products upon annealing of amorphous precursors. The a2c tool was demonstrated on a variety of materials, including oxides, nitrides and metallic glasses, and can assist researchers in discovering synthesis pathways for materials design.

    • Muratahan Aykol
    • Amil Merchant
    • Ekin Dogus Cubuk
    ResearchOpen Access
    Nature Computational Science
    Volume: 5, P: 105-111
  • A protocol using large-scale training of graph networks enables high-throughput discovery of novel stable structures and led to the identification of 2.2 million crystal structures, of which 381,000 are newly discovered stable materials.

    • Amil Merchant
    • Simon Batzner
    • Ekin Dogus Cubuk
    ResearchOpen Access
    Nature
    Volume: 624, P: 80-85
  • Accurately predicting battery lifetime is difficult, and a prediction often cannot be made unless a battery has already degraded significantly. Here the authors report a machine-learning method to predict battery life before the onset of capacity degradation with high accuracy.

    • Kristen A. Severson
    • Peter M. Attia
    • Richard D. Braatz
    Research
    Nature Energy
    Volume: 4, P: 383-391
  • A closed-loop machine learning methodology of optimizing fast-charging protocols for lithium-ion batteries can identify high-lifetime charging protocols accurately and efficiently, considerably reducing the experimental time compared to simpler approaches.

    • Peter M. Attia
    • Aditya Grover
    • William C. Chueh
    Research
    Nature
    Volume: 578, P: 397-402
  • The discovery and development of advanced materials are imperative for the clean energy sector. We envision that a closed-loop approach, which combines high-throughput computation, artificial intelligence and advanced robotics, will sizeably reduce the time to deployment and the costs associated with materials development.

    • Daniel P. Tabor
    • Loïc M. Roch
    • Alán Aspuru-Guzik
    Reviews
    Nature Reviews Materials
    Volume: 3, P: 5-20