Sfoglia per Autore
Modelling realistic TiO2 nanospheres: A benchmark study of SCC-DFTB against hybrid DFT
2017 Selli, D; Fazio, G; Di Valentin, C
Using Density Functional Theory to Model Realistic TiO2 Nanoparticles, Their Photoactivation and Interaction with Water
2017 Selli, D; Fazio, G; Di Valentin, C
Photoexcited carriers recombination and trapping in spherical vs faceted TiO2 nanoparticles
2017 Di Valentin, C; Fazio, G; Ferrighi, L; Selli, D
Ab initio investigation of polyethylene glycol coating of TiO2 surfaces
2016 Selli, D; DI VALENTIN, C
Hierarchical thermoelectrics: Crystal grain boundaries as scalable phonon scatterers
2016 Selli, D; Boulfelfel, S; Schapotschnikow, P; Donadio, D; Leoni, S
Optimizing electronic structure and quantum transport at the graphene-Si(111) Interface: An ab initio density-functional study
2013 Tayran, C; Zhu, Z; Baldoni, M; Selli, D; Seifert, G; Tománek, D
Superhard sp3 carbon allotropes with odd and even ring topologies
2011 Selli, D; Baburin, I; Martoňák, R; Leoni, S
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