Implementation of surface hopping molecular dynamics using semiempirical methods E Fabiano, TW Keal, W Thiel Chemical Physics 349 (1-3), 334-347, 2008 | 277 | 2008 |
Photoinduced nonadiabatic dynamics of pyrimidine nucleobases: On-the-fly surface-hopping study with semiempirical methods Z Lan, E Fabiano, W Thiel The Journal of Physical Chemistry B 113 (11), 3548-3555, 2009 | 231 | 2009 |
“Darker-than-Black” PbS quantum dots: enhancing optical absorption of colloidal semiconductor nanocrystals via short conjugated ligands C Giansante, I Infante, E Fabiano, R Grisorio, GP Suranna, G Gigli Journal of the American Chemical Society 137 (5), 1875-1886, 2015 | 178 | 2015 |
Semiclassical neutral atom as a reference system in density functional theory LA Constantin, E Fabiano, S Laricchia, F Della Sala Physical Review Letters 106 (18), 186406, 2011 | 146 | 2011 |
Nonradiative deexcitation dynamics of 9H-adenine: An OM2 surface hopping study E Fabiano, W Thiel The Journal of Physical Chemistry A 112 (30), 6859-6863, 2008 | 128 | 2008 |
Photoinduced Nonadiabatic Dynamics of 9H‐Guanine Z Lan, E Fabiano, W Thiel ChemPhysChem 10 (8), 1225-1229, 2009 | 123 | 2009 |
QM/MM Nonadiabatic Decay Dynamics of 9H‐Adenine in Aqueous Solution Z Lan, Y Lu, E Fabiano, W Thiel ChemPhysChem 12 (10), 1989-1998, 2011 | 104 | 2011 |
Generalized gradient approximations of the noninteracting kinetic energy from the semiclassical atom theory: Rationalization of the accuracy of the frozen density embedding … S Laricchia, E Fabiano, LA Constantin, F Della Sala Journal of chemical theory and computation 7 (8), 2439-2451, 2011 | 103 | 2011 |
Theoretical study of singlet and triplet excitation energies in oligothiophenes E Fabiano, FD Sala, R Cingolani, M Weimer, A Görling The Journal of Physical Chemistry A 109 (13), 3078-3085, 2005 | 87 | 2005 |
Kinetic‐energy‐density dependent semilocal exchange‐correlation functionals F Della Sala, E Fabiano, LA Constantin International Journal of Quantum Chemistry 116 (22), 1641-1694, 2016 | 86 | 2016 |
Semilocal Pauli–Gaussian kinetic functionals for orbital-free density functional theory calculations of solids LA Constantin, E Fabiano, F Della Sala The journal of physical chemistry letters 9 (15), 4385-4390, 2018 | 80 | 2018 |
Live-cell-permeant thiophene fluorophores and cell-mediated formation of fluorescent fibrils I Palama, F Di Maria, I Viola, E Fabiano, G Gigli, C Bettini, G Barbarella Journal of the American Chemical Society 133 (44), 17777-17785, 2011 | 77 | 2011 |
Bright oligothiophene N-succinimidyl esters for efficient fluorescent labeling of proteins and oligonucleotides G Barbarella, M Zambianchi, A Ventola, E Fabiano, F Della Sala, G Gigli, ... Bioconjugate chemistry 17 (1), 58-67, 2006 | 76 | 2006 |
Colorless to all-black full-NIR high-contrast switching in solid electrochromic films prepared with organic mixed valence systems based on dibenzofulvene derivatives GA Corrente, E Fabiano, F Manni, G Chidichimo, G Gigli, A Beneduci, ... Chemistry of Materials 30 (16), 5610-5620, 2018 | 74 | 2018 |
Laplacian-level kinetic energy approximations based on the fourth-order gradient expansion: Global assessment and application to the subsystem formulation of density functional … S Laricchia, LA Constantin, E Fabiano, F Della Sala Journal of chemical theory and computation 10 (1), 164-179, 2014 | 71 | 2014 |
Meta-GGA exchange-correlation functional with a balanced treatment of nonlocality LA Constantin, E Fabiano, F Della Sala Journal of Chemical Theory and Computation 9 (5), 2256-2263, 2013 | 69 | 2013 |
Generalized gradient approximation bridging the rapidly and slowly varying density regimes: A PBE-like functional for hybrid interfaces E Fabiano, LA Constantin, F Della Sala Physical Review B 82 (11), 113104, 2010 | 67 | 2010 |
Approximate switching algorithms for trajectory surface hopping E Fabiano, G Groenhof, W Thiel Chemical Physics 351 (1-3), 111-116, 2008 | 62 | 2008 |
Nonuniform scaling applied to surface energies of transition metals L Chiodo, LA Constantin, E Fabiano, F Della Sala Physical Review Letters 108 (12), 126402, 2012 | 61 | 2012 |
[1]Benzothieno[3,2-b]benzothiophene-Based Organic Dyes for Dye-Sensitized Solar Cells AL Capodilupo, E Fabiano, L De Marco, G Ciccarella, G Gigli, C Martinelli, ... The Journal of organic chemistry 81 (8), 3235-3245, 2016 | 60 | 2016 |