Calculation of low‐energy elastic cross sections for electron‐CF4 scattering FA Gianturco, RR Lucchese, N Sanna The Journal of Chemical Physics 100 (9), 6464-6471, 1994 | 234 | 1994 |
Hydrogen and Higher Shell Contributions in Zn2+, Ni2+, and Co2+ Aqueous Solutions: An X-ray Absorption Fine Structure and Molecular Dynamics Study P D'Angelo, V Barone, G Chillemi, N Sanna, W Meyer-Klaucke, NV Pavel Journal of the American Chemical Society 124 (9), 1958-1967, 2002 | 212 | 2002 |
Differential cross sections for electron/positron scattering from polyatomic molecules N Sanna, FA Gianturco Computer physics communications 114 (1-3), 142-167, 1998 | 172 | 1998 |
Accurate vibrational spectra of large molecules by density functional computations beyond the harmonic approximation: the case of uracil and 2-thiouracil V Barone, G Festa, A Grandi, N Rega, N Sanna Chemical Physics Letters 388 (4-6), 279-283, 2004 | 127 | 2004 |
Development and validation of an integrated computational approach for the study of ionic species in solution by means of effective two-body potentials. The case of Zn2+, Ni2+ … G Chillemi, P D'Angelo, NV Pavel, N Sanna, V Barone Journal of the American Chemical Society 124 (9), 1968-1976, 2002 | 103 | 2002 |
Evidence for sevenfold coordination in the first solvation shell of Hg (II) aqua ion G Chillemi, G Mancini, N Sanna, V Barone, S Della Longa, M Benfatto, ... Journal of the American Chemical Society 129 (17), 5430-5436, 2007 | 96 | 2007 |
The Mont-Blanc prototype: an alternative approach for HPC systems N Rajovic, A Rico, F Mantovani, D Ruiz, JO Vilarrubi, C Gomez, L Backes, ... SC'16: Proceedings of the International Conference for High Performance …, 2016 | 93 | 2016 |
Selective Bond Breaking in β-d-Ribose by Gas-Phase Electron Attachment around 8 eV I Baccarelli, FA Gianturco, A Grandi, N Sanna, RR Lucchese, I Bald, ... Journal of the American Chemical Society 129 (19), 6269-6277, 2007 | 83 | 2007 |
On the scattering of low‐energy electrons by sulphur hexafluoride FA Gianturco, RR Lucchese, N Sanna The Journal of chemical physics 102 (14), 5743-5751, 1995 | 74 | 1995 |
Experimental Evidence for a Variable First Coordination Shell of the Cadmium(II) Ion in Aqueous, Dimethyl Sulfoxide, and N,N‘-Dimethylpropyleneurea Solution P D'Angelo, G Chillemi, V Barone, G Mancini, N Sanna, I Persson The Journal of Physical Chemistry B 109 (18), 9178-9185, 2005 | 70 | 2005 |
Ring-breaking electron attachment to uracil: Following bond dissociations via evolving resonances FA Gianturco, F Sebastianelli, RR Lucchese, I Baccarelli, N Sanna The Journal of chemical physics 128 (17), 2008 | 65 | 2008 |
Computational evidence for a variable first shell coordination of the cadmium (II) ion in aqueous solution G Chillemi, V Barone, P D'Angelo, G Mancini, I Persson, N Sanna The Journal of Physical Chemistry B 109 (18), 9186-9193, 2005 | 63 | 2005 |
Low-energy electron scattering from methane CT Bundschu, JC Gibson, RJ Gulley, MJ Brunger, SJ Buckman, N Sanna, ... Journal of Physics B: Atomic, Molecular and Optical Physics 30 (9), 2239, 1997 | 61 | 1997 |
WEP: a high-performance analysis pipeline for whole-exome data M D'Antonio, P D'Onorio De Meo, D Paoletti, B Elmi, M Pallocca, N Sanna, ... BMC bioinformatics 14, 1-11, 2013 | 59 | 2013 |
Structural and Dynamical Properties of the Hg2+ Aqua Ion: A Molecular Dynamics Study G Mancini, N Sanna, V Barone, V Migliorati, P D'Angelo, G Chillemi The Journal of Physical Chemistry B 112 (15), 4694-4702, 2008 | 55 | 2008 |
Computed elastic cross sections and angular distributions of low-energy electron scattering from gas phase C60 fullerene FA Gianturco, RR Lucchese, N Sanna Journal of Physics B: Atomic, Molecular and Optical Physics 32 (9), 2181, 1999 | 55 | 1999 |
New hints on the Ph-driven tautomeric equilibria of the topotecan anticancer drug in aqueous solutions from an integrated spectroscopic and quantum-mechanical approach N Sanna, G Chillemi, A Grandi, S Castelli, A Desideri, V Barone Journal of the American Chemical Society 127 (44), 15429-15436, 2005 | 54 | 2005 |
N atoms recombination on a silica surface: A global theoretical approach M Rutigliano, A Pieretti, M Cacciatore, N Sanna, V Barone Surface science 600 (18), 4239-4246, 2006 | 52 | 2006 |
Desorption from Uracil via Metastable Electron Capture A Grandi, FA Gianturco, N Sanna Physical review letters 93 (4), 048103, 2004 | 50 | 2004 |
Low-energy electron scattering from the water molecule: Angular distributions and rotational excitation FA Gianturco, S Meloni, P Paioletti, RR Lucchese, N Sanna The Journal of chemical physics 108 (10), 4002-4012, 1998 | 50 | 1998 |