CORREA, ANDREA

CORREA, ANDREA  

Dipartimento di Scienze chimiche  

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Titolo Tipologia Data di pubblicazione Autore(i) File
Collective dynamics of molecular rotors in periodic mesoporous organosilica: a combined solid-state 2H-NMR and molecular dynamics simulation study 1.1 Articolo in rivista 2022 De Nicola, A.; Correa, A.; Bracco, S.; Perego, J.; Sozzani, P.; Comotti, A.; Milano, G.
A molecular interpretation of the dynamics of diffusive mass transport of water within a glassy polyetherimide 1.1 Articolo in rivista 2021 Correa, A.; De Nicola, A.; Scherillo, G.; Loianno, V.; Mallamace, D.; Mallamace, F.; Ito, H.; Musto, P.; Mensitieri, G.
Bidimensional H-Bond Network Promotes Structural Order and Electron Transport in BPyMPMs Molecular Semiconductor 1.1 Articolo in rivista 2021 De Nicola, A.; Correa, A.; Giunchi, A.; Muccioli, L.; D'Avino, G.; Kido, J.; Milano, G.
On the calculation of the potential of mean force between atomistic nanoparticles 1.1 Articolo in rivista 2018 Munaò, Gianmarco; Correa, Andrea; Pizzirusso, Antonio; Milano, Giuseppe
Structural Characterization of Electron Donors in Ziegler–Natta Catalysts 1.1 Articolo in rivista 2018 Blaakmeer, E. S. Merijn; Antinucci, Giuseppe; Correa, Andrea; Busico, Vincenzo; van Eck, Ernst R. H.; Kentgens, Arno P. M.
Biomembrane solubilization mechanism by Triton X-100: a computational study of the three stage model 1.1 Articolo in rivista 2017 Pizzirusso, Antonio; De Nicola, Antonio; Sevink, G. J. Agur; Correa, Andrea; Cascella, Michele; Kawakatsu, Toshihiro; Rocco, Mattia; Zhao, Ying; Celino, Massimo; Milano, Giuseppe
MgCl2 -supported Ziegler-Natta catalysts: A DFT-D ‘flexible-cluster’ approach. TiCl4 and probe donor adducts 1.1 Articolo in rivista 2018 Breuza, Emanuele; Antinucci, Giuseppe; Budzelaar, Peter H. M; Busico, Vincenzo; Correa, Andrea; Ehm, Christian; Budzelaar, Petrus Henricus Maria
Atomistic Model of Realistic Crystalline Mesoporous Organosilica Materials Including Nanochannels 1.1 Articolo in rivista 2018 De Nicola, Antonio; Correa, Andrea; Comotti, Angiolina; Sozzani, Piero; Milano, Giuseppe
Mechanistic insights into formic acid dehydrogenation promoted by Cu-amino based systems 1.1 Articolo in rivista 2017 Correa, Andrea; Cascella, Michele; Scotti, Nicola; Zaccheria, Federica; Ravasio, Nicoletta; Psaro, Rinaldo
Local Structure and Dynamics of Water Absorbed in Poly(ether imide): A Hydrogen Bonding Anatomy 1.1 Articolo in rivista 2017 de Nicola, Antonio; Correa, Andrea; Milano, Giuseppe; La Manna, Pietro; Musto, Pellegrino; Mensitieri, Giuseppe; Scherillo, Giuseppe
Molecular Modeling of the Regiochemistry of Olefins Insertion with Single Site Polymerization Catalysts 1.1 Articolo in rivista 2006 Correa, Andrea; Talarico, Giovanni; L., Cavallo
Regiochemistry of propene insertion with group 4 polymerization catalysts from a theoretical perspective 1.1 Articolo in rivista 2007 Correa, Andrea; Talarico, Giovanni; L., Cavallo
Separating Electronic from Steric Effects in Ethene/α-Olefin Copolymerization: A Case Study on Octahedral [ONNO] Zr-Catalysts 1.1 Articolo in rivista 2019 Zaccaria, Francesco; Cipullo, Roberta; Correa, Andrea; Budzelaar, P. H. M.; Busico, Vincenzo; Ehm, Christian
MgCl2-Supported Ziegler-Natta Catalysts: A DFT-D ‘Flexible-Cluster’ Approach. Internal Donor Adducts 1.1 Articolo in rivista 2018 Breuza, Emanuele; Antinucci, Giuseppe; Budzelaar, Peter H. M.; Busico, Vincenzo; Correa, Andrea; Ehm, Christian; Budzelaar, Petrus Henricus Maria
Mechanism of gold-catalyzed cycloisomerization of enynyl esters 2.1 Contributo in volume (Capitolo o Saggio) 2010 Correa, A.; Cavallo, L.
A comparison of the performance of the semiempirical PM6 method versus DFT methods in Ru-catalyzed olefin metathesis 2.1 Contributo in volume (Capitolo o Saggio) 2010 Correa, A.; Poater, A.; Ragone, F.; Cavallo, L.
Chemodivergent metathesis of dienynes catalyzed by ruthenium-indenylidene complexes: An experimental and computational study 1.1 Articolo in rivista 2009 Clavier, Hervé; Correa, Andrea; Escudero-Adán, Eduardo C.; Jordi, Benet-Buchholz; Cavallo, Luigi; Nolan, Steven P.
Exploring the reactivity of ru-based metathesis catalysts with a π-acid ligand trans to the Ru-ylidene bond 1.1 Articolo in rivista 2009 Poater, Albert; Ragone, Francesco; Correa, Andrea; Cavallo, Luigi
SambVca: A web application for the calculation of the buried volume of N-heterocyclic carbene ligands 1.1 Articolo in rivista 2009 Poater, Albert; Cosenza, Biagio; Correa, Andrea; Giudice, Simona; Ragone, Francesco; Scarano, Vittorio; Cavallo, Luigi
[Pd(NHC)(allyl)Cl] complexes: Synthesis and determination of the NHC percent buried volume (%Vbur) steric parameter 1.1 Articolo in rivista 2009 Clavier, Hervé; Correa, Andrea; Cavallo, Luigi; Escudero-Adán, Eduardo C.; Benet-Buchholz, Jordi; Slawin, Alexandra M. Z.; Nolan, Steven P.