Pubblicazioni

A DFT study on the mechanism of NO decomposition catalyzed by short-distance Cu(I) pairs in Cu-ZSM-5

2017 - MOLECULAR CATALYSIS
Morpurgo, Simone

Collective molecular mechanisms in the CH3NH3PbI3 dissolution by liquid water

2017 - ACS NANO
Caddeo, Claudia; Saba, Maria Ilenia; Meloni, Simone; Filippetti, Alessio; Mattoni, Alessandro

The elephant in the room of density functional theory calculations

2017 - THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS
Jensen, S. R.; Saha, S.; Flores-Livas, J. A.; Huhn, W.; Blum, V.; Goedecker, S.; Frediani, L.

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