普鲁士蓝
钴
催化作用
密度泛函理论
吸附
光化学
电子转移
化学
硫酸盐
无机化学
计算化学
有机化学
物理化学
电化学
电极
作者
Chunxiao Zhao,Biao Liu,Xuning Li,K. Zhu,Ruisheng Hu,Zhimin Ao,Junhu Wang
摘要
Herein, we, for the first time, report a high spin Co-Fe Prussian blue analogue (Co-Fe PBA) as a highly efficient Fenton-like catalyst for sulfate radical (SO4˙-) production. Our experiments and density functional theory (DFT) calculations show that the largely elongated SO4-OH bond length, strengthened adsorption and facilitated electron transfer for peroxymonosulfate (PMS) activation catalyzed by high-spin (HS) CoII are the main factors contributing to its excellent activity.
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