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Issue DateTitleAuthor(s)
18-Jan-2018Matildite Contact with Media: First-Principles Study of AgBiS2 Surfaces and Nanoparticle MorphologyViñes Solana, Francesc; Konstantatos, Gerasimos; Illas i Riera, Francesc
7-May-2020Morphology of TiO2 nanoparticles as fingerprint for the transient absorption spectra: implications for photocatalysisMorales García, Ángel; Valero Montero, Rosendo; Illas i Riera, Francesc
20-Jan-2022Artificial-intelligence-driven discovery of catalyst genes with application to CO2 activation on semiconductor oxidesMazheika, Aliaksei; Wang, Yang-Gang; Valero Montero, Rosendo; Viñes Solana, Francesc; Illas i Riera, Francesc; Ghiringelli, Luca M.; Levchenko, Sergey V.; Scheffler, Matthias