| The Chemical Bond between Au(I) and the Noble Gases. Comparative Study of NgAuF and NgAu+ (Ng = Ar, Kr, Xe) by Density Functional and Coupled Cluster … L Belpassi, I Infante, F Tarantelli, L Visscher Journal of the American Chemical Society 130 (3), 1048-1060, 2008 | 277 | 2008 |
| Influence of the dye molecular structure on the TiO 2 conduction band in dye-sensitized solar cells: disentangling charge transfer and electrostatic effects E Ronca, M Pastore, L Belpassi, F Tarantelli, F De Angelis Energy & Environmental Science 6 (1), 183-193, 2013 | 273 | 2013 |
| How π back-donation quantitatively controls the CO stretching response in classical and non-classical metal carbonyl complexes G Bistoni, S Rampino, N Scafuri, G Ciancaleoni, D Zuccaccia, L Belpassi, ... Chemical science 7 (2), 1174-1184, 2016 | 170 | 2016 |
| Ion pairing in cationic olefin− gold (I) complexes D Zuccaccia, L Belpassi, F Tarantelli, A Macchioni Journal of the American Chemical Society 131 (9), 3170-3171, 2009 | 169 | 2009 |
| Counterion effect in the reaction mechanism of NHC gold (I)-catalyzed alkoxylation of alkynes: computational insight into experiment G Ciancaleoni, L Belpassi, D Zuccaccia, F Tarantelli, P Belanzoni Acs Catalysis 5 (2), 803-814, 2015 | 118 | 2015 |
| A Phosphine Gold (I) π-Alkyne Complex: Tuning the Metal− Alkyne Bond Character and Counterion Position by the Choice of the Ancillary Ligand D Zuccaccia, L Belpassi, L Rocchigiani, F Tarantelli, A Macchioni Inorganic chemistry 49 (7), 3080-3082, 2010 | 116 | 2010 |
| Revealing charge-transfer effects in gas-phase water chemistry D Cappelletti, E Ronca, L Belpassi, F Tarantelli, F Pirani Accounts of chemical research 45 (9), 1571-1580, 2012 | 112 | 2012 |
| On the Dewar–Chatt–Duncanson model for catalytic gold (I) complexes N Salvi, L Belpassi, F Tarantelli Chemistry–A European Journal 16 (24), 7231-7240, 2010 | 112 | 2010 |
| Solvent-, silver-, and acid-free NHC-Au-X catalyzed hydration of alkynes. The pivotal role of the counterion M Gatto, P Belanzoni, L Belpassi, L Biasiolo, A Del Zotto, F Tarantelli, ... ACS Catalysis 6 (11), 7363-7376, 2016 | 110 | 2016 |
| The chemical bond in gold (I) complexes with N-heterocyclic carbenes D Marchione, L Belpassi, G Bistoni, A Macchioni, F Tarantelli, ... Organometallics 33 (16), 4200-4208, 2014 | 92 | 2014 |
| Charge-Transfer Energy in the Water− Hydrogen Molecular Aggregate Revealed by Molecular-Beam Scattering Experiments, Charge Displacement Analysis, and ab Initio Calculations L Belpassi, ML Reca, F Tarantelli, LF Roncaratti, F Pirani, D Cappelletti, ... Journal of the American Chemical Society 132 (37), 13046-13058, 2010 | 92 | 2010 |
| Unexpected Anion Effect in the Alkoxylation of Alkynes Catalyzed by N‐Heterocyclic Carbene (NHC) Cationic Gold Complexes L Biasiolo, M Trinchillo, P Belanzoni, L Belpassi, V Busico, G Ciancaleoni, ... Chemistry–A European Journal 20 (45), 14594-14598, 2014 | 89 | 2014 |
| When the Tolman Electronic Parameter Fails: A Comparative DFT and Charge Displacement Study of [(L)Ni(CO)3]0/– and [(L)Au(CO)]0/+ G Ciancaleoni, N Scafuri, G Bistoni, A Macchioni, F Tarantelli, ... Inorganic Chemistry 53 (18), 9907-9916, 2014 | 88 | 2014 |
| Extensive experimental and computational study of counterion effect in the reaction mechanism of NHC-gold (I)-catalyzed alkoxylation of alkynes M Trinchillo, P Belanzoni, L Belpassi, L Biasiolo, V Busico, A D’Amora, ... Organometallics 35 (5), 641-654, 2016 | 78 | 2016 |
| Charge-displacement analysis via natural orbitals for chemical valence: Charge transfer effects in coordination chemistry G Bistoni, S Rampino, F Tarantelli, L Belpassi The Journal of Chemical Physics 142 (8), 2015 | 70 | 2015 |
| Recent advances and perspectives in four-component Dirac–Kohn–Sham calculations L Belpassi, L Storchi, HM Quiney, F Tarantelli Physical Chemistry Chemical Physics 13 (27), 12368-12394, 2011 | 70 | 2011 |
| Ligand effects on bonding and ion pairing in cationic gold (I) catalysts bearing unsaturated hydrocarbons D Zuccaccia, L Belpassi, A Macchioni, F Tarantelli European Journal of Inorganic Chemistry 2013 (24), 4121-4135, 2013 | 68 | 2013 |
| NHC-gold-alkyne complexes: Influence of the carbene backbone on the ion pair structure G Ciancaleoni, L Biasiolo, G Bistoni, A Macchioni, F Tarantelli, ... Organometallics 32 (15), 4444-4447, 2013 | 67 | 2013 |
| An ab initio benchmark and DFT validation study on gold (I)-catalyzed hydroamination of alkynes G Ciancaleoni, S Rampino, D Zuccaccia, F Tarantelli, P Belanzoni, ... Journal of Chemical Theory and Computation 10 (3), 1021-1034, 2014 | 66 | 2014 |
| Disentanglement of donation and back-donation effects on experimental observables: a case study of gold-ethyne complexes G Bistoni, L Belpassi, F Tarantelli Angew. Chem., Int. Ed 52 (44), 11599-11602, 2013 | 64 | 2013 |
Pirani FernandoUniversità di PerugiaVerified email at unipg.it
