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Performance of a modified hybrid functional in the simultaneous description of stoichiometric and reduced TiO2 polymorphs
Ko, Kyoung Chul; Lamiel-García, Oriol; Lee, Jin Yong; Illas i Riera, Francesc
Universitat de Barcelona
Diòxid de titani
Teoria del funcional de densitat
Teoria de l'aproximació
Titanium dioxide
Density functionals
Approximation theory
(c) Ko, Kyoung Chul et al., 2016
Article
info:eu-repo/semantics/acceptedVersion
Royal Society of Chemistry
         

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