双金属片
密度泛函理论
沸石咪唑盐骨架
化学
氮化物
矿化(土壤科学)
氮化碳
降级(电信)
电子转移
咪唑酯
金属
化学工程
无机化学
光化学
金属有机骨架
物理化学
计算化学
氮气
吸附
催化作用
光催化
有机化学
电信
计算机科学
工程类
图层(电子)
作者
Xi Li,Shiwen Wang,Pei Chen,Baokang Xu,Xiao Zhang,Yanhua Xu,Ru Zhou,Yu Yang,Huaili Zheng,Peng Yu,Yongjun Sun
标识
DOI:10.1016/j.apcatb.2023.122401
摘要
Co–Zn–N–C catalyst (MCZC) with neighboring Co and Zn pairs anchored on hollow carbon nitride was constructed by the direct etching of zeolitic imidazolate frameworks assembled with Co and Zn. Adequate characterizations and density functional theory (DFT) studies confirmed the successful construction of non-bonding Co and Zn pairs with enhanced electron transfer on Co sites by adjacent Zn sites. Based on the synergy of adjacent Co and Zn atom pairs, the MCZC/Perxymosulfate (PMS) system achieved 99.6% Tetracycline (TC) degradation in 24 min with a mineralization rate of 55.8% and PMS decomposition efficiency of 73.1%. DFT calculation based on the Fukui index identified the sites susceptible to attack by the active species. TC degradation pathways could be inferred, and reduced toxicity of intermediates was observed. This work provides new insights into the design of MOF-derived bimetallic catalysts and the importance of the interaction between adjacent metal active sites to catalytic performance.
科研通智能强力驱动
Strongly Powered by AbleSci AI