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Issue Date | Title | Author(s) |
---|---|---|
2005 | Adsorption of atomic oxygen and nitrogen at β-cristobalite (100): a density functionaly theory study | Arasa Cid, Carina; Gamallo Belmonte, Pablo; Sayós Ortega, Ramón |
28-Jan-2012 | Classical dynamics study of atomic oxygen over graphite (0001) with new interpolated and analytical potential energy surfaces | Morón Tejero, Víctor; Martin-Gondre, Ludovic; Crespos, Cédric; Larregaray, Pascal; Gamallo Belmonte, Pablo; Sayós Ortega, Ramón |
2008 | Classical dynamics study of atomic oxygen sticking on the β-cristobalite (100) surface | Arasa Cid, Carina; Busnengo, H. F.; Salin, A.; Sayós Ortega, Ramón |
2015 | Methane capture at room temperature: adsorption on cubic d-MoC and orthorhombic b-Mo2C molybdenum carbide (001) surfaces | Posada Pérez, Sergio; Politi, José Roberto S.; Viñes Solana, Francesc; Illas i Riera, Francesc |
2007 | A density functional study of atomic oxygen and nitrogen adsorption over α-alumina (0001) | Gamallo Belmonte, Pablo; Sayós Ortega, Ramón |
25-Jun-2014 | Vacancy patterning and patterning vacancies: controlled self-assembly of fullerenes on metal surfaces | Kaiser, Alexander; Viñes Solana, Francesc; Illas i Riera, Francesc; Ritter, Marcel; Hagelberg, Frank; Probst, Michael |
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 |
15-Jan-2018 | Combining theory and experiment for multitechnique characterization of activated CO2 on transition metal carbide (001) surfaces | Kunkel, Christian; Viñes Solana, Francesc; Ramírez, Pedro J.; Rodríguez, José A.; Illas i Riera, Francesc |
1-Mar-2017 | Selectivity for CO2 over CH4 on a functionalized periodic mesoporous phenylene-silica explained by transition state theory | Kunkel, Christian; Viñes Solana, Francesc; Lourenco, Mirtha A. O.; Ferreira, Paula; Gomes, José R. B.; 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 |
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