计算机科学
材料科学
阳极
电池(电)
阴极
极化(电化学)
电解质
电化学
储能
锂(药物)
纳米技术
工艺工程
电化学储能
边距(机器学习)
燃烧
氧还原反应
电极
接口(物质)
降级(电信)
系统工程
燃料电池
锂离子电池
析氧
氧化还原
作者
Dawn Sivan,Yen-Jen Chen,Chun-Chen Yang,Venkataraman Thangadurai,Rajan Jose
标识
DOI:10.1021/acsami.6c00201
摘要
Lithium–oxygen batteries (LOBs) offer combustion fuel-like energy densities but remain constrained by low efficiency, limited cycle life, and coupled degradation pathways linking the electrochemical growth and decay of the reaction product (Li 2 O 2 ) and associated generation of reactive oxygen species, electrolyte and electrode instabilities, and lithium dendrite growth. Here, we introduce a hybrid materials-informatics framework that integrates structured query learning with retrieval-augmented generation (RAG) to systematically analyze the full-text corpus of 3134 peer-reviewed articles in LOBs. Unlike conventional artificial intelligence (AI) tools, which learn from unstructured literature and risk factual drift, the present approach forms a relational performance-validated database, enabling evidence-traceable comparison of cathode architectures, catalyst types, electrolytes, redox mediators, and lithium protection strategies. The analysis reveals composition-dependent performance hierarchies and exposes interdependencies among Li 2 O 2 morphology, singlet-oxygen formation, overpotentials, and solid electrolyte interface disruption, as reported under their documented experimental conditions. Using this method, we identified the catalyst–electrolyte–anode configurations capable of reducing charge polarization by 0.3–0.6 V and extending cycling stability to 100–200 cycles under standard cycling conditions reported in the source studies. This data-driven roadmap establishes a quantitative foundation for translating LOBs from laboratory demonstrations to deployable high-energy systems and demonstrates how materials informatics can accelerate electrochemical materials synthesis and device design.
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