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◆ Cell Reports Physical Science2026-04-01· Artificial intelligence

Early calendar life and health prediction of silicon batteries via machine learning with uncertainty quantification

Nina Prakash, Ankit Verma, Peter J. Weddle, Andrew M. Colclasure, Maxwell C. Schulze, Gerard M. Carroll, Josefine McBrayer, Marco-Tulio F. Rodrigues, Jae Hyeon Kim, Gregory F. Pach, Paul Gasper, Lydia Meyer, Amanda Musgrove, Nathan R. Neale, Gabriel M. Veith, Anthony K. Burrell

原始摘要(英文原文)· Original abstract
Lithium-ion batteries with silicon anodes promise high energy density but are limited by calendar lifetime. Reducing the long iteration time to obtain experimental results requires predicting calendar lifetime early in a cell's life. In this study, we demonstrate that lightweight machine learning models with feature engineering can provide calendar lifetime estimates from early electrochemical signals. After 1 month of electrochemical aging, the best models achieve 10% error in calendar-life prediction and can separate "bad" from "good" lifetime cells with a mean F1 score of 0.857. As battery systems exhibit inherent variability, four methods for uncertainty quantification are compared, and confidence intervals are demonstrated with an uncertainty of ±3.6 months in lifetime prediction. A feature importance analysis indicates that early patterns in voltage decay are the strongest indicators of calendar lifetime. Finally, this modeling approach has high error when generalizing to new electrode chemistries or testing conditions but with appropriately low confidence.
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