Density functional theory study of the interaction of H2O, CO2 and CO with the ZrO2 (111), Ni/ZrO2 (111), YSZ (111) and Ni/YSZ (111) surfaces

Article ID	Journal	Published Year	Pages	File Type
5421445	Surface Science	2016	36 Pages	PDF

Keywords

Yttria-stabilized zirconia Surface science Triple phase boundary Supported nanoparticles fuel cell

Related Topics

Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry

Density functional theory study of the interaction of H2O, CO2 and CO with the ZrO2 (111), Ni/ZrO2 (111), YSZ (111) and Ni/YSZ (111) surfaces

Authors

Abdelaziz Cadi-Essadek, Alberto Roldan, Nora H. de Leeuw,