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  6. Machine Learning-guided Prediction Of Energy Storage Performance Of Carbon Cathode Materials For Zinc-ion Hybrid Capacitors

Machine learning-guided prediction of energy storage performance of carbon cathode materials for zinc-ion hybrid capacitors

Yaoyu Chen1, Hao Wang1, Chenglong Wang1

  • 1Shanghai Key Laboratory of Magnetic Resonance, School of Physics and Electronic Science, East China Normal University, Shanghai 200241, China; Institute of Magnetic Resonance and Molecular Imaging in Medicine, East China Normal University, Shanghai 200241, China.

Journal of Colloid and Interface Science
|June 13, 2025

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View abstract on PubMed

Summary
This summary is machine-generated.

Machine learning accurately predicts specific capacitance for aqueous zinc-ion hybrid capacitors (ZIHCs). Key carbon properties like pore volume and nitrogen content were identified, guiding the design of high-performance ZIHC cathodes.

Area of Science:

  • Materials Science
  • Electrochemistry
  • Computational Chemistry

Background:

  • Aqueous zinc-ion hybrid capacitors (ZIHCs) offer sustainable energy storage.
  • Developing high-performance carbon cathodes is crucial for ZIHC energy density.
  • Machine learning (ML) and deep learning (DL) show potential for accelerating material discovery.

Purpose of the Study:

  • To investigate ML and DL models for predicting specific capacitance (Cs) in carbon cathode-based ZIHCs.
  • To identify critical carbon material properties influencing ZIHC performance.
  • To validate ML predictions through experimental synthesis and testing.

Main Methods:

  • Evaluated six ML/DL models for Cs prediction.
  • Utilized LightGBM, achieving R² of 0.986 and RMSE of 4.88 mAh g⁻¹.
Keywords:
Carbon cathodeMachine learningSpecific capacityZinc-ion hybrid capacitor

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  • Employed SHAP and PDP for feature importance analysis.
  • Synthesized biomass and MOF-derived carbons for experimental validation.
  • Main Results:

    • LightGBM exhibited superior prediction accuracy for ZIHC specific capacitance.
    • Pore volume, nitrogen content, and specific surface area were identified as key factors influencing Cs.
    • Synthesized carbon materials confirmed the reliability of ML predictions.

    Conclusions:

    • ML models, particularly LightGBM, can effectively predict ZIHC performance.
    • This approach provides valuable insights for designing optimized carbon cathodes.
    • The study offers a pathway for accelerating the development of advanced ZIHCs.