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Mostrati risultati da 21 a 37 di 37
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A theoretical study on the sugars' mutarotation: the epimerization of 2-tetrahydropyranol catalysed by formamidine, benzamidine and by the 2-aminopyridine/2-iminopyridine tautomeric couple 2005 Morpurgo, Simone; Grandi, A.; Zazza, C.; Bossa, Mario
Cathodic electrografting of versatile ligands on Si(100) as a low-impact approach for establishing a Si-C bond: A surface-coordination study of substituted 2,2 '-bipyridines with Cu I ions 2007 Aurora, A; Cattaruzza, F; Coluzza, C; DELLA VOLPE, C; DI SANTO, G; Flamini, A; Mangano, C; Morpurgo, Simone; Pallavicini, P; Zanoni, Robertino
Group Theory and Crystal Field Theory: a simple and rigorous derivation of the spectroscopic terms generated by the t2g2 electronic configuration in a strong octahedral field 2007 Morpurgo, Simone
A computational study on N2 adsorption in Cu-ZSM-5 2007 Morpurgo, Simone; Moretti, Giuliano; Bossa, Mario
Studio DFT sul meccanismo della decomposizione di NO su Cu-ZSM-5 2008 Morpurgo, Simone; Bossa, Mario; Moretti, Giuliano
Long range and surface effects on the Auger parameter: Electrostatic self-consistent polarization energy model 2008 Satta, Mauro; Morpurgo, Simone; Moretti, Giuliano
A DFT study on the mechanism of NO decomposition catalyzed by Cu(I) pairs in Cu-ZSM-5 2010 Morpurgo, Simone; Moretti, Giuliano; M., Bossa
Use of the label of bottled mineral waters: a way to introduce the properties of electrolytic solutions 2012 Calascibetta, Franco Giuseppe; Favero, Gabriele; Moretti, Giuliano; Morpurgo, Simone
A computational study on the mechanism of NO decomposition catalyzed by Cu-ZSM-5: A comparison between single and dimeric Cu+ active sites 2012 Morpurgo, Simone; Moretti, Giuliano; Bossa, Mario
Basis set effects on Cu(I) coordination in Cu-ZSM-5: a computational study 2012 Morpurgo, Simone; Moretti, Giuliano; Bossa, Mario
Reactivity of saturated hydrocarbon anchoring arms on Si(100) upon white light photoactivation: experimental evidence and theoretical insights 2014 Marrani, Andrea Giacomo; Carboni, Marco; Boccia, Alice; P., Galloni; Morpurgo, Simone; Zanoni, Robertino
A DFT study on Cu(I) coordination in Cu-ZSM-5: effects of the functional choice and tuning of the ONIOM approach 2015 Morpurgo, Simone
A DFT study on the mechanism of NO decomposition catalyzed by short-distance Cu(I) pairs in Cu-ZSM-5 2017 Morpurgo, Simone
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 Morpurgo, Simone
A DFT study on the mechanism of NO and N2O decomposition catalysed by Cu(I) pairs in Cu-ZSM-5: Revisited reactivity at the M6 ring 2022 De Rosa, Michele; Morpurgo, Simone
Fe-MOR and Fe-FER as catalysts for abatement of N2O with CH4: in situ UV-vis DRS and operando FTIR study 2023 Cristina Campa, Maria; Pietrogiacomi, Daniela; Catracchia, Carlotta; Morpurgo, Simone; Olszowka, Joanna; Mlekodaj, Kinga; Lemishka, Mariia; Dedecek, Jiri; Kornas, Agnieszka; Tabor, Edyta
A DFT study on Cu-ZSM-5 as a catalyst for NO decomposition: Possible activity of a Cu(I) pair located at the T3 tetrahedral sites 2024 De Rosa, Michele; Campa, Maria Cristina; Pietrogiacomi, Daniela; Morpurgo, Simone
Mostrati risultati da 21 a 37 di 37
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