Browsing by Author Viñes Solana, Francesc
Showing results 32 to 51 of 111
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| Issue Date | Title | Author(s) |
|---|---|---|
| 15-Dec-2021 | Computational modeling of transition metals carbides with relevant to nanotechnology and catalysis | Piñero Vargas, Juan José |
| 1-Jul-2022 | Computational Pourbaix Diagrams for MXenes: A Key Ingredient toward Proper Theoretical Electrocatalytic Studies | López, Martí; Exner, Kai S.; Viñes Solana, Francesc; Illas i Riera, Francesc |
| 11-Apr-2019 | Correcting flaws in the assignment of nitrogen chemical environments in N-doped graphene | Figueras Valls, Marc; Villar-Garcia, Ignacio J.; Viñes Solana, Francesc; Sousa Romero, Carmen; de la Peña O'Shea, Victor A.; Illas i Riera, Francesc |
| 31-Jan-2020 | Critical effect of carbon vacancies on the reverse water gas shift reaction over vanadium carbide catalysts | Pajares, Arturo; Prats Garcia, Hèctor; Romero, Alexandre; Viñes Solana, Francesc; Ramírez de la Piscina, Pilar; Sayós Ortega, Ramón; Homs Martí, Narcís; Illas i Riera, Francesc |
| 1-May-2020 | Critical hydrogen coverage effect on the hydrogenation of ethylene catalyzed by δ-MoC(001): an ab initio thermodynamic and kinetic study | Jimenez-Orozco, Carlos; Flórez, Elisabeth; Viñes Solana, Francesc; Rodríguez, José A.; Illas i Riera, Francesc |
| Jan-2021 | DFT Accuracy on Bulk Transition Metals Properties | Fernández Martínez, Andrea |
| Jun-2014 | Diamondization of Bulk and Slabs of Graphite | Notario Estévez, Almudena |
| 15-Nov-2018 | Diversity of adsorbed hydrogen on the TiC (001) surface at high coverages | Piñero, Juan José; Ramírez, Pedro J.; Bromley, Stefan Thomas; Illas i Riera, Francesc; Viñes Solana, Francesc; Rodríguez, José A. |
| 13-Mar-2019 | Double-well potential energy surface in the interaction between h-BN and Ni(111) | Ontaneda, Jorge; Viñes Solana, Francesc; Illas i Riera, Francesc; Grau-Crespo, Ricardo |
| 18-Jun-2022 | Effect of nanostructuring on the interaction of CO2 with molybdenum carbide nanoparticles | Jiménez-Orozco, Carlos; Figueras, Marc; Flórez, Elizabeth; Viñes Solana, Francesc; Rodriguez, José A.; Illas i Riera, Francesc |
| 1-May-2016 | Effect of the exchange-correlation potential on the transferability of Bronsted-Evans-Polanyi relationships in heterogeneous catalysis | Fajin, Jose L. C.; Viñes Solana, Francesc; Cordeiro, M. Natália D. S.; Illas i Riera, Francesc; Gomes, José R. B. |
| 16-May-2017 | Effective and highly selective CO generation from CO2 using a polycrystalline α‑Mo2C catalyst | Liu, Xinayun; Kunkel, Christian; Ramírez de la Piscina, Pilar; Homs Martí, Narcís; Viñes Solana, Francesc; Illas i Riera, Francesc |
| 11-Jan-2017 | Electronic structure of stoichiometric and reduced ZnO from periodic relativistic all electron hybrid density functional calculations using numeric atom-centered orbitals | Viñes Solana, Francesc; Illas i Riera, Francesc |
| 2015 | Electronic-structure-based material descriptors: (in)dependence on self-interaction and Hartree-Fock exchange | Notario Estévez, Almudena; Kozlov, Sergey; Viñes Solana, Francesc; Illas i Riera, Francesc |
| 4-Apr-2008 | Estudio de la estructura y reactividad de superficies y nanopartículas de carburos de metales de transición | Viñes Solana, Francesc |
| 7-Jan-2021 | Exfoliation Energy as a Descriptor of MXenes Synthesizability and Surface Chemical Activity | Dolz Garcia, Daniel; Morales García, Ángel; Viñes Solana, Francesc; Illas i Riera, Francesc |
| 5-Dec-2017 | Existence of multi-radical and closed-shell semiconducting states in post-graphene organic Dirac materials | Alcón Rovira, Isaac; Viñes Solana, Francesc; Moreira, Ibério de Pinho Ribeiro; Bromley, Stefan Thomas |
| 13-Feb-2020 | Explaining Cu@Pt bimetallic nanoparticles activity based on NO adsorption | Viñes Solana, Francesc; Görling, Andreas |
| 3-Apr-2020 | Facile heterogeneously catalyzed nitrogen rixation by MXenes | Gouveia, José D.; Morales García, Ángel; Viñes Solana, Francesc; Gomes, José R. B.; Illas i Riera, Francesc |
| 6-May-2017 | Functionalization of γ-graphyne by transition metal adatoms | Kim, Sunkyung; Ruiz Puigdollers, Antonio; Gamallo Belmonte, Pablo; Viñes Solana, Francesc; Lee, Jin Yong |