3 papers
cond-mat.mtrl-sci2016
Surface Reactivity Enhancement by O2 Dissociation on a Single-layer MgO Film Deposited on Metal Substrate
Cequn Li, Jing Fan, Bin Xu +1
Improving reactivity on an insulating surface is crucial due to their important applications in surface catalytic reactions. In this work, we carried out first-principles calculati…
physics.chem-ph2015
Generation of highly reactive oxygen species by co-adsorption of oxygen and water on metal-supported MgO(100) thinfilms
Zhenjun Song, Hu Xu
The formation of highly reactive oxygen species (ROS) on metal oxide surfaces have attracted considerable interest due to their diverse applications. In this work, we have performe…
physics.chem-ph2015
Strain-Induced Water Dissociation on Supported Ultrathin Oxide Films
Zhenjun Song, Jing Fan, Hu Xu
Controlling the dissociation of single water molecule on an insulating surface plays a crucial role in many catalytic reactions. In this Letter, we have identified the enhanced che…