Applied Catalysis B: Environment and Energy ( IF 20.2 ) Pub Date : 2023-03-14 , DOI: 10.1016/j.apcatb.2023.122634 Siqi Wu , Xiaobin Liu , Huimin Mao , Tong Cui , Bin Li , Guizhong Zhou , Lei Wang
The development of efficient and stable oxygen reduction reaction (ORR) electrocatalysts in seawater electrolyte is the key to realizing marine resource utilization and expanding metal-air battery applications. Herein, defect-rich Fe-doped Co nanoparticles encapsulated by N-doped hierarchical carbon (D-FeCo@NHC) are rationally designed and synthesized. It is worth mentioning that the Fe doping helps to promote the generation of metal defect and adjust the electronic structure of D-FeCo@NHC. Density functional theory (DFT) demonstrate that the metal defect and carbon defect jointly optimize the d-band center of D-FeCo@NHC. As a result, in alkaline seawater electrolyte, D-FeCo@NHC display a half-wave potential of 0.874 V, and the assembled liquid Zn-air battery exhibit a high peak power density (173 mW cm−2) and ultra-long cycling stability (over 800 h). This work highlights the defect engineering in the construction of seawater-based oxygen reduction electrocatalysts, which provide a significant and promising approach for seawater-based metal-air cathode materials.
中文翻译:
通过定制富含缺陷的多级异质组装体实现碱性海水中的高效氧还原反应
在海水电解液中开发高效稳定的氧还原反应(ORR)电催化剂是实现海洋资源利用和扩大金属空气电池应用的关键。在此,合理设计和合成了由 N 掺杂分级碳 (D- Fe Co@NHC)包裹的富含缺陷的 Fe 掺杂 Co 纳米粒子。值得一提的是,Fe掺杂有助于促进金属缺陷的产生,调整D- Fe Co@NHC的电子结构。密度泛函理论 (DFT) 表明金属缺陷和碳缺陷共同优化了D- Fe Co@NHC的d带中心。因此,在碱性海水电解液中,D- FeCo@NHC 的半波电位为 0.874 V,组装的液体锌空气电池具有高峰值功率密度(173 mW cm -2)和超长循环稳定性(超过 800 小时)。这项工作突出了海水基氧还原电催化剂构建中的缺陷工程,为海水基金属-空气阴极材料提供了一种重要且有前景的方法。