氧化物
催化作用
金属
苯甲醇
酒精氧化
材料科学
扫描隧道显微镜
氧气
密度泛函理论
烧结
小学(天文学)
化学工程
合理设计
酒
纳米技术
化学
计算化学
有机化学
冶金
物理
天文
工程类
作者
Guofeng Zhao,Fan Yang,Zongjia Chen,Qingfei Liu,Yongjun Ji,Yi Zhang,Zhiqiang Niu,Junjie Mao,Xinhe Bao,P. Hu,Yadong Li
摘要
Abstract A main obstacle in the rational development of heterogeneous catalysts is the difficulty in identifying active sites. Here we show metal/oxide interfacial sites are highly active for the oxidation of benzyl alcohol and other industrially important primary alcohols on a range of metals and oxides combinations. Scanning tunnelling microscopy together with density functional theory calculations on FeO/Pt(111) reveals that benzyl alcohol enriches preferentially at the oxygen-terminated FeO/Pt(111) interface and undergoes readily O–H and C–H dissociations with the aid of interfacial oxygen, which is also validated in the model study of Cu 2 O/Ag(111). We demonstrate that the interfacial effects are independent of metal or oxide sizes and the way by which the interfaces were constructed. It inspires us to inversely support nano-oxides on micro-metals to make the structure more stable against sintering while the number of active sites is not sacrificed. The catalyst lifetime, by taking the inverse design, is thereby significantly prolonged.
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