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January 22, 20260 citationsOpen Access

Toward AI ecosystems for electrolyte and interface engineering in solid-state batteries

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ZWZhilong WangWZWolfgang G. ZeierFYFengqi You

Key Points

  • This work aims to review the role of AI in improving electrolyte and interface engineering for solid-state batteries.
  • Reviewed AI applications in electrolyte and interface engineering
  • Analyzed stability, conductivity, mechanical properties, and resistance
  • Evaluated modeling strategies like machine learning force fields and generative models
  • Proposed a roadmap for multiscale and multimodal modeling
  • AI shows promise in advancing material properties for solid-state batteries
  • Key challenges in electrolyte stability and interface mechanics remain
  • A roadmap for integrating advanced modeling techniques was proposed
  • Interdisciplinary collaboration is expected to drive sustainable battery innovation

Abstract

Solid-state batteries (SSBs) are pivotal for sustainable energy storage, delivering extended life span, low-temperature resilience, and enhanced safety. However, designing stable solid electrolytes and interfaces in SSBsremains a formidable challenge. As a disruptive catalyst for paradigm shifts spanning materials discovery andenergy system redesign, artificial intelligence (AI) is unleashing unprecedented possibilities—could it be the keybreakthrough for SSB innovation? Here, we critically review the progress of AI applications in electrolyte and in-terface engineering, covering key aspects such as stability, conductivity, mechanical properties, and interface re-sistance. This work emphasizes the integration of cutting-edge modeling strategies, including the materials’screening pipelines, machine learning force fields, and generative models. Furthermore, we conduct an in-depthanalysis of persistent challenges and propose a roadmap featuring multiscale modeling and multimodal modelswith physical constraints to build an intelligent ecosystem for SSB development. This review is expected to inspireinterdisciplinary collaborations and drive forward energy materials design, ultimately accelerating the develop-ment of sustainable and cutting-edge battery technologies.

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Cite This Study

Wang et al. (2025) studied this question.

synapsesocial.com/papers/6971bd90642b1836717e23dchttps://doi.org/10.34734/fzj-2026-00028
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