阴极
X射线光电子能谱
镍
过渡金属
电化学
热稳定性
材料科学
冶金
密度泛函理论
金属
化学
化学工程
无机化学
电极
工程类
催化作用
物理化学
计算化学
生物化学
作者
Ziyue Wen,Feng Wu,Zhikun Zhao,Zhuolin Yang,Xinghui Liu,Daobin Mu
标识
DOI:10.1016/j.est.2024.111135
摘要
Active cathode materials with ultra-high specific capacities, including nickel-rich substrates, are promising candidates for future high-energy density batteries. However, the poor stability of nickel-rich cathodes has limited the development of long-life batteries. Herein, the electrochemical properties of layered cathode materials were optimized by tuning the transition metal ratio (Co/Mn) in precursor preparation. The effects of transition metals Co and Mn on the specific capacities and cyclabilities of layered cathode materials were investigated by X-ray photoelectron spectroscopy (XPS) and Density Functional Theory (DFT) calculations. Keeping Co and Mn equal allows extreme nickel cathode materials to have the best performance. The as-obtained LiNi0.9Co0.05Mn0.05O2 cathode exhibited a high capacity of 221.0 mAh g−1, combined with excellent interfacial structure and thermal stability. The enhanced nickel ions mechanism of the active cathode materials by transition metal regulation was clarified. Overall, the proposed materials containing transition metals with improved capacity and cycling stability are promising for the development of future advanced batteries.
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