Pubblicazioni

The mechanism of NO and N2O decomposition catalyzed by short-distance Cu(I) pairs in Cu-ZSM-5: A DFT study on the possible role of NO and NO2in the [Cu–O–Cu]2+active site reduction

2018 - JOURNAL OF CATALYSIS
Morpurgo, Simone

A DFT study on Cu(I) coordination in Cu-ZSM-5: effects of the functional choice and tuning of the ONIOM approach

2015 - JOURNAL OF COMPUTATIONAL CHEMISTRY
Morpurgo, Simone

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