催化作用
近程
吸附
选择性
化学
丝光沸石
大气温度范围
化学工程
无机化学
密度泛函理论
氢
一氧化碳
材料科学
物理化学
沸石
计算化学
有机化学
热力学
工程类
物理
作者
Jianlin Cao,Xiaoqian Zhang,Xinxin Ou,Tao Liu,Tao Xing,Zhi Li,Xin Zhou,Hao Yan,Yibin Liu,Xiang Feng,Yongxiao Tuo,Chaohe Yang,De Chen
标识
DOI:10.1016/j.cej.2022.136661
摘要
Developing efficient and stable catalysts for preferential oxidation of CO (CO-PROX) within a wide temperature window is significant for the industrial hydrogen resource purification process. Herein, dual promoters of Fe and K were deliberately introduced to the mordenite supported Pt catalyst for optimizing the adsorption behaviors of reactants in CO-PROX. The optimal 1Pt0.1 K/Fe-MOR catalyst can achieve 100% CO conversion and 60–70% CO2 selectivity (the ratio of CO/O2 is 1:1) under the realistic application temperature range (130–200 °C), and remains catalytically stable during 65 h testing at 140 °C. A combination of detailed characterizations and density functional theory (DFT) simulations show that Fe species can avoid the co-adsorption of O2 on the Pt sites by providing more oxygen vacancy to activate O2, while K species will further enhance the adsorption of CO and repulse the adsorption of H2 on Pt surface. Therefore, the optimized adsorption of CO, O2 and H2 results in a total CO conversion and high CO2 selectivity in high temperature range.
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