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Issue Date | Title | Author(s) |
---|---|---|
28-Jan-2016 | Performance of Minnesota functionals on predicting core-level binding energies of molecules containing main-group elements | Pueyo Bellafont, Noèlia; Alvarez Saiz, Gabriel; Viñes Solana, Francesc; Illas i Riera, Francesc |
12-Jan-2016 | Performance of the TPSS functional on predicting core level binding energies of main group elements containing molecules: a good choice for molecules adsorbed on metal surfaces | Pueyo Bellafont, Noèlia; Viñes Solana, Francesc; Illas i Riera, Francesc |
6-Sep-2014 | Bulk properties of transition metals: a challenge for the design of universal density functionals | Janthon, Patanachai; Luo, Sijie (Andy); Kozlov, Sergey; Viñes Solana, Francesc; Limtrakul, Jumras; Truhlar, Donald G.; Illas i Riera, Francesc |
25-May-2018 | Two-dimensional nitrides as highly efficient potential candidates for CO2 capture and activation | Morales-Salvador, Raul; Morales García, Ángel; Viñes Solana, Francesc; Illas i Riera, Francesc |
25-Jun-2014 | Vacancy patterning and patterning vacancies: controlled self-assembly of fullerenes on metal surfaces | Kaiser, Alexander; Viñes Solana, Francesc; Illas i Riera, Francesc; Ritter, Marcel; Hagelberg, Frank; Probst, Michael |
7-Feb-2018 | On the H-2 interactions with transition metal adatoms supported on graphene: a systematic density functional study | Manadé, Montserrat; Viñes Solana, Francesc; Gil, Adrià; Illas i Riera, Francesc |
23-Aug-2018 | Understanding W doping in wurtzite ZnO | Viñes Solana, Francesc; Iglesias-Juez, Ana; Fernandez-Garcia, Marcos; Illas i Riera, Francesc |
15-Jan-2018 | Combining theory and experiment for multitechnique characterization of activated CO2 on transition metal carbide (001) surfaces | Kunkel, Christian; Viñes Solana, Francesc; Ramírez, Pedro J.; Rodríguez, José A.; Illas i Riera, Francesc |
22-Dec-2017 | Biogas upgrading by transition metal carbides | Kunkel, Christian; Viñes Solana, Francesc; Illas i Riera, Francesc |
7-Nov-2017 | Bandgap engineering by cationic disorder: case study on AgBiS2 | Viñes Solana, Francesc; Konstantatos, Gerasimos; Illas i Riera, Francesc |
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