纳米团簇
光催化
催化作用
选择性
活动站点
密度泛函理论
材料科学
分子
光化学
化学
化学工程
无机化学
纳米技术
有机化学
计算化学
工程类
作者
Jianfeng Tian,Kang Zhong,Xingwang Zhu,Jinman Yang,Zhao Mo,Jinyuan Liu,Jiachao Dai,Yuanbin She,Yanhua Song,Huaming Li,Hui Xu
标识
DOI:10.1016/j.cej.2022.138392
摘要
The selectivity and activity of photocatalytic CO2 reduction can be effectively enhanced by modulating the reduction pathway of CO2 molecules and promoting the separation of photogenerated charges. Here, we synthesized an Au nanoclusters (Au NCs) modified BiOBr nanosheets catalyst with highly exposed Au active sites by liquid nitrogen assisted ionothermal method. Compared with the pristine BiOBr, the 2.0 wt% Au25 NCs/BiOBr showed excellent photocatalytic activity with a nearly double increase in the rate of CO emission (43.57 μmol g−1h−1). Through relevant experimental characterizations and density functional theory (DFT) calculations, it had been proved that the increased CO2 reduction activities of the samples are attributed to the Au active sites. The increase of Au active sites lowered the CO2 thermodynamic reaction energy barrier and also changed the reaction pathways. This work will play a positive role in application of Au NCs catalysts in photocatalytic applications in the further.
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