华中师范大学学报（自然科学版）2026，Vol.60Issue(2)：255-270,16.DOI:10.19603/j.cnki.1000-1190.2026.02.009
水系锌离子电池负极-电解液界面优化及虚拟开发
Optimization of the anode-electrolyte interface in aqueous zinc-ion batteries and its virtual development
摘要
Abstract
Aqueous Zinc-Ion Batteries(AZIBs)are promising post-lithium-ion energy storage systems due to high safety,low cost,and environmental friendliness.However,negative electrode interface issues(dendrite growth,hydrogen evolution,corrosion)severely limit their calendar life and energy density,demanding rational interface optimization strategies.Relevant reviews on AZIBs interface optimization are scarce.Thus,focusing on AZIBs interface problems and optimization paths,we summarize advances in negative electrode regulation,electrolyte and separator optimization.As traditional trial-and-error experiments barely reveal microscopic mechanisms,it explores the role of virtual technologies(density functional theory,molecular dynamics,machine learning)in clarifying mechanisms,accelerating screening,and optimizing performance.In conclusion,the interface optimization-virtual development paradigm is crucial for AZIBs application.Multi-scale simulation-experiment synergy is highlighted in solving interface issues and improving battery performance,guiding next-generation high-performance energy storage device design.关键词
水系锌离子电池/界面优化/虚拟开发/实验与理论结合Key words
aqueous zinc-ion batteries/interface optimization/virtual development/combination of experiment and theory分类
信息技术与安全科学引用本文复制引用
郑玉杰,吴过,汪磊,梅华平,苟倩誌,李猛..水系锌离子电池负极-电解液界面优化及虚拟开发[J].华中师范大学学报（自然科学版）,2026,60(2):255-270,16.基金项目
国家自然科学基金项目(52173235) （52173235）
重庆市技术创新与应用发展专项重点项目(CSTB2025TIAD-KPX0020) （CSTB2025TIAD-KPX0020）
重庆市自然科学基金项目(CSTB2025NSCQ-BSX0023),重庆大学2024年本科教育教学改革研究项目教师教学发展专项(2024JF11) （CSTB2025NSCQ-BSX0023）
西安建筑科技大学科研启动基金项目(196032407). （196032407）
