| Energy transfer upon collision of selectively excited CO2 molecules: State-to-state cross sections and probabilities for modeling of atmospheres and gaseous flows A Lombardi, N Faginas-Lago, L Pacifici, G Grossi The Journal of Chemical Physics 143 (3), 2015 | 54 | 2015 |
| A high‐level ab initio study of the N2 + N2 reaction channel L Pacifici, M Verdicchio, NF Lago, A Lombardi, A Costantini Journal of Computational Chemistry 34 (31), 2668-2676, 2013 | 51 | 2013 |
| Modeling of Energy Transfer From Vibrationally Excited CO2 Molecules: Cross Sections and Probabilities for Kinetic Modeling of Atmospheres, Flows, and Plasmas A Lombardi, N Faginas-Lago, L Pacifici, A Costantini The Journal of Physical Chemistry A 117 (45), 11430-11440, 2013 | 49 | 2013 |
| VMSLab-G: a virtual laboratory prototype for molecular science on the Grid O Gervasi, A Riganelli, L Pacifici, A Lagana Future Generation Computer Systems 20 (5), 717-726, 2004 | 45 | 2004 |
| An innovative synergistic grid approach to the computational study of protein aggregation mechanisms N Faginas-Lago, M Albertí, A Costantini, A Laganà, A Lombardi, L Pacifici Journal of molecular modeling 20, 1-9, 2014 | 35 | 2014 |
| Time-dependent wavepacket calculations for the system on a LEPS surface: inelastic and reactive probabilities D Skouteris*, L Pacifici, A Laganà Molecular Physics 102 (21-22), 2237-2248, 2004 | 25 | 2004 |
| On the temperature dependence of the rate coefficient of formation of C from C + CH+ S Rampino, M Pastore, E Garcia, L Pacifici, A Laganà Monthly Notices of the Royal Astronomical Society 460 (3), 2368-2375, 2016 | 24 | 2016 |
| A nonorthogonal coordinate approach to atom-diatom parallel reactive scattering calculations A Laganà, S Crocchianti, N Faginas Lago, L Pacifici, G Ferraro Collection of Czechoslovak chemical communications 68 (2), 307-330, 2003 | 24 | 2003 |
| The molecular stirrer catalytic effect in methane ice formation NF Lago, M Albertí, A Laganà, A Lombardi, L Pacifici, A Costantini Computational Science and Its Applications–ICCSA 2014: 14th International …, 2014 | 23 | 2014 |
| A Dynamics Investigation of the C + CH+ → C2+ + H Reaction on an ab Initio Bond-Order-Like Potential L Pacifici, M Pastore, E Garcia, A Laganà, S Rampino The Journal of Physical Chemistry A 120 (27), 5125-5135, 2016 | 17 | 2016 |
| Towards the Grid design of the dynamics engine of a molecular simulator AL O Gervasi, S Crocchianti, L Pacifici, D Skouteris Lecture Series in Computer and Computational Science 7, 1425-1428, 2006 | 14* | 2006 |
| A Theoretical Investigation of the Reaction N(2D) + C6H6 and Implications for the Upper Atmosphere of Titan N Balucani, L Pacifici, D Skouteris, A Caracciolo, P Casavecchia, M Rosi Computational Science and Its Applications–ICCSA 2018: 18th International …, 2018 | 12 | 2018 |
| A quantum-classical study of the OH+ H2 reactive and inelastic collisions C Martí, L Pacifici, A Laganà, C Coletti Chemical Physics Letters 674, 103-108, 2017 | 12 | 2017 |
| A molecular dynamics study for the isomerization of Ar solvated (benzene) 2–K+ heteroclusters M Albertí, L Pacifici, A Laganà, A Aguilar Chemical physics 327 (1), 105-111, 2006 | 12 | 2006 |
| A Computational Study of the Reaction N(2D) + C6H6 Leading to Pyridine and Phenylnitrene N Balucani, L Pacifici, D Skouteris, A Caracciolo, P Casavecchia, ... Computational Science and Its Applications–ICCSA 2019: 19th International …, 2019 | 11 | 2019 |
| An experimental and theoretical investigation of 1-butanol pyrolysis M Rosi, D Skouteris, N Balucani, C Nappi, N Faginas Lago, L Pacifici, ... Frontiers in Chemistry 7, 326, 2019 | 10 | 2019 |
| Design and implementation of a Grid application for direct calculations of reactive rates NF Lago, A Lombardi, L Pacifici, A Costantini Computational and Theoretical Chemistry 1022, 103-107, 2013 | 10 | 2013 |
| 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 … M Rosi, L Pacifici, D Skouteris, A Caracciolo, P Casavecchia, S Falcinelli, ... Computational Science and Its Applications–ICCSA 2020: 20th International …, 2020 | 8 | 2020 |
| Computational Science and Its Applications-ICCSA 2014 N Faginas-Lago, M Albertí, A Laganà, A Lombardi, L Pacifici, A Costantini Lecture Notes in Computer Science 8579, 585-600, 2014 | 8 | 2014 |
| A quantum–classical study of the effect of the long range tail of the potential on reactive and inelastic OH+ H2 dynamics C Martí, A Laganà, L Pacifici, F Pirani, C Coletti Chemical Physics Letters 769, 138404, 2021 | 7 | 2021 |
