Butera, Valeria

Butera, Valeria  

Scienze e Tecnologie Biologiche Chimiche e Farmaceutiche  

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Data di pubblicazione Titolo Autori Tipologia Autore(i) File
1-gen-2018 Alkoxysilane production from silica and dimethylcarbonate catalyzed by alkali bases: A quantum chemical investigation of the reaction mechanism Valeria Butera + 01 - Contributo in rivista::1.01 Articolo in rivista Valeria Butera; Norihisa Fukaya; Jun-Chul Choi; Kazuhiko Sato; Yoong-Kee Choe
1-lug-2023 Carbon Dioxide Cycloaddition to Epoxides Promoted by Nicotinamidium Halide Catalysts: A DFT Investigation Butera, Valeria 01 - Contributo in rivista::1.01 Articolo in rivista Butera, Valeria
1-gen-2012 Charge transport in poly-imidazole membranes: A fresh appraisal of the Grotthuss mechanism Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Mangiatordi G.F.; Butera V.; Russo N.; Laage D.; Adamo C.
1-gen-2016 Computational Insight on CO2 Fixation to Produce Styrene Carbonate Assisted by a Single-Center Aluminum(III) Catalyst and Quaternary Ammonium Salts Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Butera V.; Russo N.; Cosentino U.; Greco C.; Moro G.; Pitea D.; Sicilia E.
1-gen-2020 Cyclic Carbonate Formation from Epoxides and CO2Catalyzed by Sustainable Alkali Halide-Glycol Complexes: A DFT Study to Elucidate Reaction Mechanism and Catalytic Activity Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Butera V.; Detz H.
1-gen-2021 d-Glucose Adsorption on the TiO2 Anatase (100) Surface: A Direct Comparison Between Cluster-Based and Periodic Approaches Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Butera V.; Massaro A.; Munoz-Garcia A.B.; Pavone M.; Detz H.
7-feb-2024 Density functional theory methods applied to homogeneous and heterogeneous catalysis: a short review and a practical user guide valeria butera 01 - Contributo in rivista::1.09 Review essay (rassegna critica) valeria butera
1-gen-2022 DFT Study of GaN Clusters Decorated with Rh and Pt Nanoparticles for the Photochemical Reduction of CO2 Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Butera V.; Detz H.
1-gen-2022 Dinuclear Ruthenium(II)-Pyrrolide Complexes Linked by Different Organic Units as PDT Photosensitizers: Computational Study of the Linker Influence on the Photophysical Properties* Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Butera V.; Mazzone G.; Detz H.
1-gen-2011 Do rhodium bis(σ-amine-borane) complexes play a role as intermediates in dehydrocoupling reactions of amine-boranes? Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Butera V.; Russo N.; Sicilia E.
16-ago-2023 Electron-Poor Acridones and Acridiniums as Super Photooxidants in Molecular Photoelectrochemistry by Unusual Mechanisms Butera, Valeria + 01 - Contributo in rivista::1.01 Articolo in rivista Žurauskas, Jonas; Boháčová, Soňa; Wu, Shangze; Butera, Valeria; Schmid, Simon; Domański, Michał; Slanina, Tomáš; Barham, Joshua Philip
1-gen-2016 Electronic Properties of Pure and Fe-Doped β-Ni(OH)2: New Insights Using Density Functional Theory with a Cluster Approach Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Butera V.; Toroker M.C.
1-gen-2023 Elucidation of single atom catalysts for energy and sustainable chemical production: Synthesis, characterization and frontier science Butera V. + 01 - Contributo in rivista::1.09 Review essay (rassegna critica) Loy A.C.M.; Teng S.Y.; How B.S.; Zhang X.; Cheah K.W.; Butera V.; Leong W.D.; Chin B.L.F.; Yiin C.L.; Taylor M.J.; Kyriakou G.
1-gen-2017 Experimental and Theoretical Investigation on the Catalytic Generation of Environmentally Persistent Free Radicals from Benzene Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista D'Arienzo M.; Gamba L.; Morazzoni F.; Cosentino U.; Greco C.; Lasagni M.; Pitea D.; Moro G.; Cepek C.; Butera V.; Sicilia E.; Russo N.; Munoz-Garcia A.B.; Pavone M.
1-gen-2023 Gallium Nitride-based Materials as Promising Catalysts for CO2 Reduction: A DFT Study on the Effect of CO2 Coverage and the Incorporation of Mg Doping or Substitutional In Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Ritacco I.; Farnesi Camellone M.; Caporaso L.; Detz H.; Butera V.
1-feb-2024 GrafeoPlad Palladium: Insight on Structure and Activity of a New Catalyst Series of Broad Scope Barone, GiampaoloButera, Valeria + 01 - Contributo in rivista::1.01 Articolo in rivista Formenti, Matteo; Casaletto, Maria Pia; Barone, Giampaolo; Pagliaro, Mario; Della Pina, Cristina; Butera, Valeria; Ciriminna, Rosaria
1-gen-2021 Hole-mediated photoredox catalysis: Tris(: P-substituted)biarylaminium radical cations as tunable, precomplexing and potent photooxidants Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Wu S.; Zurauskas J.; Domanski M.; Hitzfeld P.S.; Butera V.; Scott D.J.; Rehbein J.; Kumar A.; Thyrhaug E.; Hauer J.; Barham J.P.
9-nov-2023 How the Metal Ion Affects the 1H NMR Chemical Shift Values of Schiff Base Metal Complexes: Rationalization by DFT Calculations Butera, ValeriaD'Anna, LuisaRubino, SimonaBonsignore, RiccardoSpinello, AngeloTerenzi, AlessioBarone, Giampaolo 01 - Contributo in rivista::1.01 Articolo in rivista Butera, Valeria; D'Anna, Luisa; Rubino, Simona; Bonsignore, Riccardo; Spinello, Angelo; Terenzi, Alessio; Barone, Giampaolo
1-gen-2014 Hydrogen release from dialkylamine-boranes promoted by Mg and Ca complexes: A DFT analysis of the reaction mechanism Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Butera V.; Russo N.; Sicilia E.
21-mag-2021 Hydrogenation of CO2to methanol by the diphosphine-ruthenium(ii) cationic complex: a DFT investigation to shed light on the decisive role of carboxylic acids as promoters Butera V. + 01 - Contributo in rivista::1.01 Articolo in rivista Butera V.; Detz H.