We introduce a small amount of Mo atoms into Ni/YSZ catalyst for the partial oxidation reaction of gasoline. Ni-Mo/YSZ catalyst displays a high reforming activity and stability with an isooctane conversion of 90% and H₂ yield of 76% with less degree of coking and sintering compared to Ni/YSZ catalyst. Our XRD results indicate that a Ni-Mo solid solution is formed. Raman results also suggest that a presence of well dispersed Mo = O species over Ni surface can be a possible active site that is related to the high coke resistance of Ni-Mo/YSZ catalyst. DFT-based calculations indicate that Ni-Mo/YSZ catalysts enhance the carbon-tolerance by increasing activation barriers for the C-H bond cleavage and C-C coupling as compared with the Ni/YSZ system. Ni-Mo catalyst is used as an internal micro-reforming layer on top of conventional Ni-YSZ anode supported single cells. The single cell displays a significantly improved stability with a low degradation rate.

我们将少量的Mo原子引入Ni / YSZ催化剂中，用于汽油的部分氧化反应。Ni-Mo / YSZ催化剂具有很高的重整活性和稳定性，异辛烷转化率为90％，H _2为与Ni / YSZ催化剂相比，焦化和烧结度更低，收率为76％。我们的XRD结果表明形成了Ni-Mo固溶体。拉曼结果还表明，在Ni表面上存在良好分散的Mo = O物种可能是可能的活性位点，这与Ni-Mo / YSZ催化剂的高耐焦炭性有关。基于DFT的计算表明，与Ni / YSZ系统相比，Ni-Mo / YSZ催化剂通过增加CH键断裂和CC偶联的活化势垒来提高碳耐受性。Ni-Mo催化剂用作常规Ni-YSZ阳极负载单电池顶部的内部微重整层。单电池显示出显着改善的稳定性，且降解率低。