MOLCAS 7: the next generation F Aquilante, L De Vico, N Ferré, G Ghigo, P Malmqvist, P Neogrády, ... Journal of computational chemistry 31 (1), 224-247, 2010 | 1725 | 2010 |
A modified definition of the zeroth-order Hamiltonian in multiconfigurational perturbation theory (CASPT2) G Ghigo, BO Roos, PÅ Malmqvist Chemical physics letters 396 (1-3), 142-149, 2004 | 1036 | 2004 |
Photochemical transformation of ibuprofen into harmful 4-isobutylacetophenone: pathways, kinetics, and significance for surface waters G Ruggeri, G Ghigo, V Maurino, C Minero, D Vione Water research 47 (16), 6109-6121, 2013 | 103 | 2013 |
The mechanism of the Stevens and Sommelet− Hauser rearrangements. A theoretical study G Ghigo, S Cagnina, A Maranzana, G Tonachini The Journal of organic chemistry 75 (11), 3608-3617, 2010 | 95 | 2010 |
Diradical and Peroxirane Pathways in the [π2 + π2] Cycloaddition Reactions of 1Δg Dioxygen with Ethene, Methyl Vinyl Ether, and Butadiene: A Density … A Maranzana, G Ghigo, G Tonachini Journal of the American Chemical Society 122 (7), 1414-1423, 2000 | 91 | 2000 |
Benzene oxidation in the troposphere. theoretical investigation on the possible competition of three postulated reaction channels G Ghigo, G Tonachini Journal of the American Chemical Society 120 (27), 6753-6757, 1998 | 64 | 1998 |
Combustion and atmospheric oxidation of hydrocarbons: Theoretical study of the methyl peroxyl self-reaction G Ghigo, A Maranzana, G Tonachini The Journal of chemical physics 118 (23), 10575-10583, 2003 | 57 | 2003 |
Oxidative degradation of benzene in the troposphere. Theoretical mechanistic study of the formation of unsaturated dialdehydes and dialdehyde epoxides F Motta, G Ghigo, G Tonachini The Journal of Physical Chemistry A 106 (17), 4411-4422, 2002 | 53 | 2002 |
From benzene to muconaldehyde: Theoretical mechanistic investigation on some tropospheric oxidation channels G Ghigo, G Tonachini Journal of the American Chemical Society 121 (36), 8366-8372, 1999 | 52 | 1999 |
Computational assessment of the fluorescence emission of phenol oligomers: a possible insight into the fluorescence properties of humic-like substances (HULIS) F Barsotti, G Ghigo, D Vione Journal of Photochemistry and Photobiology A: Chemistry 315, 87-93, 2016 | 49 | 2016 |
The oxidized soot surface: Theoretical study of desorption mechanisms involving oxygenated functionalities and comparison with temperature programed desorption experiments G Barco, A Maranzana, G Ghigo, M Causà, G Tonachini The Journal of chemical physics 125 (19), 2006 | 46 | 2006 |
CLEPS 1.0: A new protocol for cloud aqueous phase oxidation of VOC mechanisms C Mouchel-Vallon, L Deguillaume, A Monod, H Perroux, C Rose, G Ghigo, ... Geoscientific Model Development 10 (3), 1339-1362, 2017 | 44 | 2017 |
Modeling soot and its functionalization under atmospheric or combustion conditions by density functional theory within molecular (polycyclic-aromatic-hydrocarbon-like) and … G Ghigo, A Maranzana, G Tonachini, CM Zicovich-Wilson, M Causà The Journal of Physical Chemistry B 108 (10), 3215-3223, 2004 | 44 | 2004 |
New insights into the protogenic and spectroscopic properties of commercial tannic acid: the role of gallic acid impurities G Ghigo, S Berto, M Minella, D Vione, E Alladio, VM Nurchi, J Lachowicz, ... New Journal of Chemistry 42 (10), 7703-7712, 2018 | 37 | 2018 |
First Ring Formation by Radical Addition of Propargyl to But-1-ene-3-yne in Combustion. Theoretical Study of the C7H7 Radical System D Trogolo, A Maranzana, G Ghigo, G Tonachini The Journal of Physical Chemistry A 118 (2), 427-440, 2014 | 37 | 2014 |
Tailoring fluorescent strigolactones for in vivo investigations: a computational and experimental study C Prandi, G Ghigo, EG Occhiato, D Scarpi, S Begliomini, B Lace, ... Organic & Biomolecular Chemistry 12 (18), 2960-2968, 2014 | 32 | 2014 |
Polycyclic aromatic hydrocarbon formation mechanism in the “particle phase”. A theoretical study A Indarto, A Giordana, G Ghigo, A Maranzana, G Tonachini Physical Chemistry Chemical Physics 12 (32), 9429-9440, 2010 | 32 | 2010 |
o-Benzenedisulfonimide and its chiral derivative as Brønsted acids catalysts for one-pot three-component Strecker reaction. Synthetic and mechanistic aspects M Barbero, S Cadamuro, S Dughera, G Ghigo Organic & Biomolecular Chemistry 10 (20), 4058-4068, 2012 | 31 | 2012 |
The 1Δg Dioxygen Ene Reaction with Propene: A Density Functional and Multireference Perturbation Theory Mechanistic Study A Maranzana, G Ghigo, G Tonachini Chemistry–A European Journal 9 (11), 2616-2626, 2003 | 29 | 2003 |
A theoretical study of the excited states of CrH: Potential energies, transition moments, and lifetimes G Ghigo, BO Roos, PC Stancil, PF Weck The Journal of chemical physics 121 (17), 8194-8200, 2004 | 27 | 2004 |