| On the kinetics of the C5H5+ C5H5 reaction C Cavallotti, D Polino Proceedings of the Combustion Institute 34 (1), 557-564, 2013 | 78 | 2013 |
| Analysis of some reaction pathways active during cyclopentadiene pyrolysis C Cavallotti, D Polino, A Frassoldati, E Ranzi The Journal of Physical Chemistry A 116 (13), 3313-3324, 2012 | 77 | 2012 |
| Toluene and benzyl decomposition mechanisms: elementary reactions and kinetic simulations M Derudi, D Polino, C Cavallotti Physical Chemistry Chemical Physics 13 (48), 21308-21318, 2011 | 63 | 2011 |
| Fulvenallene decomposition kinetics D Polino, C Cavallotti The Journal of Physical Chemistry A 115 (37), 10281-10289, 2011 | 47 | 2011 |
| Analysis of the Reactivity on the C7H6 Potential Energy Surface D Polino, A Famulari, C Cavallotti The Journal of Physical Chemistry A 115 (27), 7928-7936, 2011 | 35 | 2011 |
| Using metadynamics to build neural network potentials for reactive events: the case of urea decomposition in water M Yang, L Bonati, D Polino, M Parrinello Catalysis Today 387, 143-149, 2022 | 33 | 2022 |
| The onset of dehydrogenation in solid ammonia borane: An ab initio metadynamics study V Rizzi, D Polino, E Sicilia, N Russo, M Parrinello Angewandte Chemie International Edition 58 (12), 3976-3980, 2019 | 31 | 2019 |
| Combustion chemistry via metadynamics: Benzyl decomposition revisited D Polino, M Parrinello The Journal of Physical Chemistry A 119 (6), 978-989, 2015 | 25 | 2015 |
| Predictive Theory for the Addition and Insertion Kinetics of 1CH2 Reacting with Unsaturated Hydrocarbons D Polino, SJ Klippenstein, LB Harding, Y Georgievskii The Journal of Physical Chemistry A 117 (48), 12677-12692, 2013 | 22 | 2013 |
| Revealing the role of phosphoric acid in all-vanadium redox flow batteries with DFT calculations and in situ analysis FJ Oldenburg, M Bon, D Perego, D Polino, T Laino, L Gubler, TJ Schmidt Physical Chemistry Chemical Physics 20 (36), 23664-23673, 2018 | 14 | 2018 |
| Reactivity of silicon surfaces in presence of adsorbed hydrogen and chlorine C Cavallotti, D Polino ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 241, 2011 | 14 | 2011 |
| Is Quantum Tunneling Relevant in Free‐Radical Polymerization? D Cuccato, M Dossi, D Polino, C Cavallotti, D Moscatelli Macromolecular Reaction Engineering 6 (12), 496-506, 2012 | 13 | 2012 |
| Theoretical investigation of germane and germylene decomposition kinetics D Polino, A Barbato, C Cavallotti Physical Chemistry Chemical Physics 12 (35), 10622-10632, 2010 | 13 | 2010 |
| Identifying slow molecular motions in complex chemical reactions GM Piccini, D Polino, M Parrinello The Journal of Physical Chemistry Letters 8 (17), 4197-4200, 2017 | 9 | 2017 |
| How Collective Phenomena Impact CO2 Reactivity and Speciation in Different Media D Polino, E Grifoni, R Rousseau, M Parrinello, VA Glezakou The Journal of Physical Chemistry A 124 (20), 3963-3975, 2020 | 7 | 2020 |
| Kinetics of aqueous media reactions via ab initio enhanced molecular dynamics: the case of urea decomposition D Polino, M Parrinello The Journal of Physical Chemistry B 123 (31), 6851-6856, 2019 | 7 | 2019 |
| An Ab Initio RRKM/Master Equation Investigation of SiH4 and GeH4 Decomposition Kinetics Using a Kinetic Monte Carlo Approach C Cavallotti, D Polino, A Barbato ECS Transactions 25 (8), 445, 2009 | 4 | 2009 |
| Development of methodologies for the accurate estimation of reaction rate coefficients D POLINO Italy, 2013 | 2 | 2013 |
| Machine Learning of Atomic Dynamics and Statistical Surface Identities in Gold Nanoparticles D Rapetti, M Delle Piane, M Cioni, D Polino, R Ferrando, GM Pavan | | 2022 |
| Innate Dynamics and Identity Crisis of a Metal Surface Unveiled by Machine Learning of Atomic Environments M Cioni, D Polino, D Rapetti, L Pesce, MD Piane, GM Pavan arXiv preprint arXiv:2207.14622, 2022 | | 2022 |
carlo cavallottiProfessor of Principles of Chemical Engineering, Politecnico di MilanoVerified email at polimi.it
