催化作用
材料科学
铂金
吸附
过渡金属
氧化物
贵金属
铁
密度泛函理论
化学工程
合理设计
无机化学
金属
纳米技术
物理化学
计算化学
化学
冶金
有机化学
工程类
作者
Yanling Ma,Fan Li,Xiaobo Ren,Wenlong Chen,Chao Li,Peng Tao,Chengyi Song,Wen Shang,Rong Huang,Baoliang Lv,Hong Zhu,Tao Deng,Jianbo Wu
标识
DOI:10.1021/acsami.8b03579
摘要
Rational design of supported noble metal is of great importance for highly efficient heterogeneous catalysts. On the basis of the distinct adsorption characteristics of noble metal and transition-metal oxides toward O2 and CO, the overall catalytic performance of CO oxidation reaction could be further modified by controlling the surface property of the materials to achieve optimal adsorption activity. Here, we studied the influence of facets matching between both platinum and ferric oxide support on CO conversion efficiency. It shows that the activities of four catalysts rank following the order of Pt{100}/α-Fe2O3{104} > Pt{100}/α-Fe2O3{001} > Pt{111}/α-Fe2O3{001} > Pt{111}/α-Fe2O3{104}. The strong metal-support interaction and adsorption energy varying with matched enclosed surface are demonstrated by density functional theory based on the projected d-band density of states. Compared with the other three cases, the combination of Pt{100} and α-Fe2O3{104} successfully weakens CO poisoning and provides proper active sites for O2 adsorption. It reveals that the facets matching could be a practicable approach to design catalysts with enhanced catalytic performance.
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