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Issue DateTitleAuthor(s)
9-Jun-2014The Bending Machine: CO2 Activation and Hydrogenation on d-MoC(001) and b-Mo2C(001) Surfaces.Posada Pérez, Sergio; Viñes Solana, Francesc; Ramírez, Pedro J.; Vidal, Alba B.; Rodríguez, José A.; Illas i Riera, Francesc
5-May-2005A systematic density functional theory study of the electronic structure of bulk and (001) surface of transition-metals carbidesViñes Solana, Francesc; Sousa Romero, Carmen; Liu, Ping; Rodríguez, José A.; Illas i Riera, Francesc
15-Jan-2018Combining theory and experiment for multitechnique characterization of activated CO2 on transition metal carbide (001) surfacesKunkel, Christian; Viñes Solana, Francesc; Ramírez, Pedro J.; Rodríguez, José A.; Illas i Riera, Francesc
13-Mar-2020Boosting the activity of transition metal carbides towards methane activation by nanostructuringFigueras Valls, Marc; Gutiérrez, Ramón A.; Prats Garcia, Hèctor; Viñes Solana, Francesc; Ramírez, Pedro J.; Illas i Riera, Francesc; Rodríguez, José A.
30-Jun-2014When reconstruction comes around: Ni, Cu, and Au adatoms on d-MoC(001)Asara, Gian Giacomo; Viñes Solana, Francesc; Ricart, Josep M.; Rodríguez, José A.; Illas i Riera, Francesc
1-May-2020Critical hydrogen coverage effect on the hydrogenation of ethylene catalyzed by δ-MoC(001): an ab initio thermodynamic and kinetic studyJimenez-Orozco, Carlos; Flórez, Elisabeth; Viñes Solana, Francesc; Rodríguez, José A.; Illas i Riera, Francesc
18-Dec-2014Fundamentals of methanol synthesis on metal carbide based catalysts: activation of CO2 and H2Posada Pérez, Sergio; Viñes Solana, Francesc; Rodríguez, José A.; Illas i Riera, Francesc
3-Apr-2019Room temperature methane capture and activation by Ni clusters supported on TiC(001): effects of metal-carbide interactions on the cleavage of the C-H bondPrats Garcia, Hèctor; Gutiérrez, Ramón A.; Piñero, Juan José; Viñes Solana, Francesc; Bromley, Stefan Thomas; Ramírez, Pedro J.; Rodríguez, José A.; Illas i Riera, Francesc