Leonardo belpassi
Leonardo belpassi
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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
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
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
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
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
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
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
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
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
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
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
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
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
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
Molecular-beam scattering experiments and theoretical calculations probing charge transfer in weakly bound complexes of water
LF Roncaratti, L Belpassi, D Cappelletti, F Pirani, F Tarantelli
The Journal of Physical Chemistry A 113 (52), 15223-15232, 2009
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
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
Disentanglement of donation and back‐donation effects on experimental observables: A case study of gold–ethyne complexes
G Bistoni, L Belpassi, F Tarantelli
Angewandte Chemie International Edition 52 (44), 11599-11602, 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
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
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