31 citations · 52 across the 3 of their papers we have counts for
3 papers
Interface Effects on the Ionic Conductivity of Doped Ceria / Yttria-stabilized Zirconia Heterostructures
Daniele Pergolesi, Elisa Gilardi, Emiliana Fabbri +5
Multilayered heterostructures of Ce0.85Sm0.15O2-delta and Y0.16Zr0.92O2-delta of a high crystallographic quality were fabricated on (001) - oriented MgO single crystal substrates.…
First-principles molecular dynamics simulations of proton diffusion in cubic BaZrO3 perovskite under strain conditions
Marco Fronzi, Yoshitaka Tateyama, Nicola Marzari +1
First-principles molecular dynamics simulations have been employed to analyze the proton diffusion in cubic BaZrO3 perovskite at 1300K, and a non-linear effect of an applied isomet…
CHx adsorption (x=1-4) and thermodynamic stability on CeO2(111) surface: A first-principles investigation
Marco Fronzi, Simone Piccinin, Bernard Delley +2
We present an ab initio investigation of the interaction between methane, its dehydrogenated forms and the cerium oxide surface. In particular, the stoichiometric CeO2(111) surface…