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Issue Date | Title | Author(s) |
---|---|---|
3-Jan-2008 | Dynamic ion pairs in the adsorption of isolated water molecules on alkaline-earth oxide (001) surfaces | Carrasco Rodríguez, Javier; Illas i Riera, Francesc; López, Núria (López Alonso) |
2004 | Theoretical modeling of photon and electron-stimulated Na and K desorption from SiO2 | Domínguez-Ariza, David; López, Núria (López Alonso); Illas i Riera, Francesc; Pacchioni, Gianfranco; Madey, Theodore E. |
2003 | Adsorption energy and spin state of first-row transition metals adsorbed on MgO(100) | Markovits, A.; Paniagua, Juan Carlos; López, Núria (López Alonso); Minot, C.; Illas i Riera, Francesc |
2006 | First principles calculations of the atomic and electronic structure of F centers in bulk and on the (001) surface of SrTiO3 | Carrasco Rodríguez, Javier; Illas i Riera, Francesc; López, Núria (López Alonso); Kotomin, E. A.; Zhukovskii, Yu. F.; Evarestov, R. A. (Robert Aleksandrovich); Mastrikov, Yu. A.; Piskunov, S.; Maier, J. |
2005 | First-principles study of the optical transitions of F centers in the bulk and on the (0001) surface of (alpha)-Al2O3 | Carrasco Rodríguez, Javier; López, Núria (López Alonso); Sousa Romero, Carmen; Illas i Riera, Francesc |
2004 | First principles analysis of the stability and diffusion of oxygen vacancies in meetal oxides | Carrasco Rodríguez, Javier; López, Núria (López Alonso); Illas i Riera, Francesc |
2004 | When Langmuir is too simple: H2 dissociation on Pd(111) at high coverage | López, Núria (López Alonso); Lodziana, Zbigniew; Illas i Riera, Francesc; Salmeron, Miquel |
2002 | Controlling the spin of metal atoms adsorbed on oxide surfaces: Ni on regular and defective sites of the MgO(001) surface | López, Núria (López Alonso); Paniagua, Juan Carlos; Illas i Riera, Francesc |