Browsing by Author Calle Vallejo, Federico
Showing results 1 to 7 of 7
| Issue Date | Title | Author(s) |
| 26-May-2020 | A Semiempirical Method to Detect and Correct DFT-Based Gas-Phase Errors and Its Application in Electrocatalysis | Granda Marulanda, Laura P.; Rendón Calle, Alejandra; Builes, Santiago; Illas i Riera, Francesc; Koper, Marc T. M.; Calle Vallejo, Federico |
| Jun-2021 | CO Electro-oxidation using near-surface alloys of platinum and transition metals | Brito Ravicini, Alvaro |
| 3-May-2022 | Computational Analyses of CO2 Electroreduction and C Interactions with Transition Metals | Piqué Caufapé, Oriol |
| 2021 | Computational-experimental study of the onset potentials for CO2 reduction on polycrystalline and oxide-derived copper electrodes | Piqué, Oriol; Löffler, Mario; Katsounaros, Ioannis; Calle Vallejo, Federico |
| 1-Sep-2021 | Importance of the gas-phase error correction for O2 when using DFT to model the oxygen reduction and evolution reactions | Sargeant, Elizabeth; Illas i Riera, Francesc; Rodríguez, Paramaconi; Calle Vallejo, Federico |
| Jun-2022 | Pt alloys with transition metals for hydrogen evolution | Ferrer Sarget, Lluís |
| Jun-2022 | Structure-sensitive hydrogenation of NO using metal electrocatalysts | Lezana Muralles, Maria Fernanda |
