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Issue DateTitleAuthor(s)
1-Apr-2016Performance of a modified hybrid functional in the simultaneous description of stoichiometric and reduced TiO2 polymorphsKo, Kyoung Chul; Lamiel Garcia, Josep Oriol; Lee, Jin Yong; Illas i Riera, Francesc
2000Core exciton energies of bulk MgO, Al2O3, and SiO2 from explicitly correlated ab initio cluster model calculationsGraaf, Coen de; Illas i Riera, Francesc
1990Chemisorption of group-III metals on the Si(111) and Ge(111) surfaces: An ab initio studyRicart, Josep M.; Rubio Martínez, Jaime; Illas i Riera, Francesc
2002Effect of Fock exchange on the electronic structure and magnetic coupling in NiOMoreira, Ibério de Pinho Ribeiro; Illas i Riera, Francesc; Martin, Richard L.