Browsing by Author Morales García, Ángel
Showing results 1 to 12 of 12
| Issue Date | Title | Author(s) |
|---|---|---|
| 3-Sep-2021 | Carbon Capture and Usage by MXenes | Morales-Salvador, Raul; Gouveia, José D.; Morales García, Ángel; Viñes Solana, Francesc; Gomes, José R.B.; Illas i Riera, Francesc |
| 4-Mar-2022 | Effect of the sulfur termination on the properties of Hf2CO2 MXene | Ougherb, Chewki; Ouahrani, Tarik; Badawi, Michael; Morales García, Ángel |
| 1-Sep-2019 | Electronic properties of realistic anatase TiO2 nanoparticles from G(0)W(0) calculations on a Gaussian and plane waves scheme | Morales García, Ángel; Valero Montero, Rosendo; Illas i Riera, Francesc |
| 1-Aug-2017 | Performance of the G(0)W(0) method in predicting the electronic gap of TiO2 nanoparticles | Morales García, Ángel; Valero Montero, Rosendo; Illas i Riera, Francesc |
| 1-Feb-2018 | Properties of single oxygen vacancies on a realistic (TiO2)(84) nanoparticle: a challenge for density functionals | Morales García, Ángel; Lamiel Garcia, Josep Oriol; Valero Montero, Rosendo; Illas i Riera, Francesc |
| 25-Jun-2018 | Reliable and computationally affordable prediction of the energy gap of (TiO2)(n) (10 <= n <= 563) nanoparticles from density functional theory | Morales García, Ángel; Valero Montero, Rosendo; Illas i Riera, Francesc |
| Jan-2022 | Single-Atom Catalysts Based on O-Functionalized MXenes | Buturca, Maria Andreea |
| 16-Jul-2018 | Theoretical modeling of electronic excitations of gas-phase and solvated TiO2 nanoclusters and nanoparticles of interest in photocatalysis | Valero Montero, Rosendo; Morales García, Ángel; Illas i Riera, Francesc |
| 29-Sep-2023 | Theoretical study of electrocatalytic properties of low-dimensional freestanding PbTiO3 for hydrogen evolution reactions | Ouahrani, Tarik; Boufatah, Reda M.; Bendaoudi, Loubna; Bedrane, Zeyneb; Morales García, Ángel; Errandonea, Daniel |
| 7-Nov-2019 | Thickness biased capture of CO2 on carbide MXenes | Morales García, Ángel; Mayans-Llorach, Marc; Viñes Solana, Francesc; Illas i Riera, Francesc |
| 25-May-2018 | Two-dimensional nitrides as highly efficient potential candidates for CO2 capture and activation | Morales-Salvador, Raul; Morales García, Ángel; Viñes Solana, Francesc; Illas i Riera, Francesc |
| 14-Apr-2019 | Understanding the interplay between size, morphology and energy gap in photoactive TiO2 nanoparticles | Morales García, Ángel; Macià Escatllar, Antoni; Illas i Riera, Francesc; Bromley, Stefan Thomas |