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| Issue Date | Title | Author(s) |
|---|---|---|
| 2004 | Theoretical study of bulk and surface oxygen and aluminium vacancies in (alpha)-Al2O3 | Carrasco Rodríguez, Javier; Gomes, José R. B.; Illas i Riera, Francesc |
| 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 |
| 2003 | Electronic structure of a neutral oxygen vacancy in SrTiO3 | Ricci, Davide; Bano, Giuseppe; Pacchioni, Gianfranco; Illas i Riera, Francesc |
| 2004 | Electronic and magnetic structure of LaMnO3 from hybrid periodic density-functional theory | Muñoz Ramos, David; Harrison, N. M.; Illas i Riera, Francesc |
| 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. |
| 2004 | Extent and limitations of density functional theory in describing magnetic systems | Illas i Riera, Francesc; Moreira, Ibério de Pinho Ribeiro; Bofill i Villà, Josep M.; Filatov, M. |
| 2000 | Electronic structure and magnetic interactions of the spin-chain compounds Ca2CuO3 and Sr2CuO3 | Graaf, Coen de; Illas i Riera, Francesc |
| 2000 | Neutral atoms in ionic lattices: Excited states of KCl:Ag(0) | Sousa Romero, Carmen; Graaf, Coen de; Illas i Riera, Francesc; Barriuso, M. T.; Aramburu, J. A.; Moreno Sereno, Mauricio |
| 2000 | Neutral atoms in ionic lattices: Stability and ground state properties of KCl:Ag(0) | Aramburu, J. A.; Moreno Sereno, Mauricio; Cabria, I.; Barriuso, M. T.; Sousa Romero, Carmen; Graaf, Coen de; Illas i Riera, Francesc |
| 2000 | Core exciton energies of bulk MgO, Al2O3, and SiO2 from explicitly correlated ab initio cluster model calculations | Graaf, Coen de; Illas i Riera, Francesc |
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