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Mostrati risultati da 21 a 40 di 40
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Multi Reference versus Coupled Cluster ab Initio Calculations for the N2 + N2 Reaction Channels 2013 Pacifici, Leonardo; Verdicchio, Marco; Lagana', Antonio
Quantum reactive scattering on innovative computing platforms 2013 Pacifici, Leonardo; Danilo, Nalli; Lagana', Antonio
Design and implementation of a Grid application for direct calculations of reactive rates 2013 FAGINAS LAGO, Maria Noelia; Lombardi, Andrea; Pacifici, Leonardo; A., Costantini
A High-Level Ab Initio Study of the N2 + N2 Reaction Channel 2013 Pacifici, Leonardo; Marco, Verdicchio; FAGINAS LAGO, Maria Noelia; Lombardi, Andrea; Alessandro, Costantini
An innovative synergistic Grid approach to the computational study of protein aggregation mechanisms 2014 FAGINAS LAGO, Maria Noelia; M., Albertì; A., Costantini; Lagana', Antonio; Lombardi, Andrea; Pacifici, Leonardo
The Molecular Stirrer Catalytic Effect in Methane Ice Formation 2014 FAGINAS LAGO, Maria Noelia; Albertí, Margarita; Lagana', Antonio; Lombardi, Andrea; Pacifici, Leonardo; Costantini, Alessandro
A Theoretical Investigation of 1-Butanol Unimolecular Decomposition 2015 Pacifici, Leonardo; FAGINAS LAGO, Maria Noelia; Lombardi, Andrea; Balucani, Nadia; Stranges, Domenico; Falcinelli, Stefano; Rosi, Marzio
Energy transfer upon collision of selectively excited CO2 molecules: State-to-state cross sections and probabilities for modeling of atmospheres and gaseous flows 2015 Lombardi, Andrea; FAGINAS LAGO, Maria Noelia; Pacifici, Leonardo; Grossi, Gaia
FREE-METHANE: A PROJECT FOR PRODUCING FUEL FROM WASTE CO2 USING RENEWABLE ENERGIES 2016 Capriccioli, A.; Lagana', Antonio; Pacifici, Leonardo; Pirani, Fernando; Lombardi, Andrea; Martì, C.; Nicoziani, Andrea; Falcinelli, Stefano; Garcia, E.; Sayos, R.; Evangelisti, S.; Arca, S.; D’Alessandro, E.; Mantovani, S.; Mantovani, M.
Modeling combustions: The ab initio treatment of the O(3P) + CH3OH reaction 2016 Pacifici, Leonardo; Talotta, Francesco; Balucani, Nadia; FAGINAS LAGO, Maria Noelia; Lagana', Antonio
A theoretical investigation of the reaction N(2D)+C6H6and Implications for the upper atmosphere of Titan 2018 Balucani, Nadia; Pacifici, Leonardo; Skouteris, Dimitrios; Caracciolo, Adriana; Casavecchia, Piergiorgio; Rosi, Marzio
A computational study of the reaction N(2D) + C6H6: Implications for the upper atmosphere of Titan 2019 Rosi, Marzio; Balucani, Nadia; Pacifici, Leonardo; Skouteris, Dimitrios; Caracciolo, Adriana; Casavecchia, Piergiorgio; Falcinelli, Stefano
A Computational Study of the Reaction N(2D) + C6H6 Leading to Pyridine and Phenylnitrene 2019 Balucani, N.; Pacifici, L.; Skouteris, D.; Caracciolo, A.; Casavecchia, P.; Falcinelli, S.; Rosi, M.
A computational study on the insertion of n(2D) into a C—H or C—C Bond: The Reactions of N(2D) with Benzene and Toluene and Their Implications on the Chemistry of Titan 2020 Rosi, M.; Pacifici, L.; Skouteris, D.; Caracciolo, A.; Casavecchia, P.; Falcinelli, S.; Balucani, N.
Protein Networks by Invariant Shape Coordinates and Deformation Indexes 2022 Lombardi, Andrea; Faginas-Lago, N.; Pacifici, Leonardo
Confinement of CO 2 Inside (20,0) Single-Walled Carbon Nanotubes 2022 Faginas-Lago, N.; Lombardi, A.; Apriliyanto, Y. B.; Pacifici, L.
Multilayer Graphtriyne Membranes for Separation and Storage of CO2: Molecular Dynamics Simulations of Post-Combustion Model Mixtures 2022 Apriliyanto, Yusuf Bramastya; Faginas-Lago, Noelia; Evangelisti, Stefano; Bartolomei, Massimiliano; Leininger, Thierry; Pirani, Fernando; Pacifici, Leonardo; Lombardi, Andrea
The Role of Molecular Dications From the Astrochemistry to Plasma Assisted CO2 Methanation 2023 Parriani, Marco; Laganà, Antonio; Pirani, Fernando; Vecchiocattivi, Franco; Falcinelli, Stefano
Protein Tetrahedral Networks by Invariant Shape Coordinates 2023 Lombardi, Andrea; Faginas-Lago, Noelia; Pacifici, Leonardo
An experimental and theoretical investigation of the N(2D) + C6H6 (benzene) reaction with implications for the photochemical models of Titan 2023 Balucani, Nadia; Caracciolo, Adriana; Vanuzzo, Gianmarco; Skouteris, Dimitrios; Rosi, Marzio; Pacifici, Leonardo; Casavecchia, Piergiorgio; Hickson, Kevin M.; Loison, Jean-Christophe; Michel Dobrijevic, And
Mostrati risultati da 21 a 40 di 40
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