IRIS - Res&Arch Institutional Research Information System - Research & Archive

BELPASSI, LEONARDO
 Distribuzione geografica
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Continente #
NA - Nord America 5.100
AS - Asia 3.111
EU - Europa 2.611
Continente sconosciuto - Info sul continente non disponibili 512
SA - Sud America 485
AF - Africa 76
OC - Oceania 4
Totale 11.899
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Nazione #
US - Stati Uniti d'America 4.873
SG - Singapore 1.507
IT - Italia 572
IE - Irlanda 510
HK - Hong Kong 458
CN - Cina 422
RU - Federazione Russa 421
BR - Brasile 363
VN - Vietnam 261
UA - Ucraina 200
SE - Svezia 177
FR - Francia 165
DE - Germania 163
GB - Regno Unito 125
CA - Canada 112
FI - Finlandia 108
IN - India 76
BD - Bangladesh 66
KR - Corea 63
AR - Argentina 38
TR - Turchia 38
MX - Messico 30
CO - Colombia 28
IQ - Iraq 27
PL - Polonia 25
ES - Italia 23
NL - Olanda 23
ID - Indonesia 22
PK - Pakistan 22
ZA - Sudafrica 22
SA - Arabia Saudita 21
UZ - Uzbekistan 20
AT - Austria 18
BE - Belgio 16
EC - Ecuador 16
JP - Giappone 16
CH - Svizzera 15
HN - Honduras 14
IL - Israele 14
CL - Cile 12
VE - Venezuela 12
GT - Guatemala 11
MA - Marocco 11
NI - Nicaragua 11
PH - Filippine 11
CR - Costa Rica 10
TT - Trinidad e Tobago 10
GR - Grecia 9
JO - Giordania 8
RO - Romania 8
SC - Seychelles 8
SV - El Salvador 8
TN - Tunisia 8
ET - Etiopia 7
LB - Libano 7
MY - Malesia 7
AZ - Azerbaigian 6
LT - Lituania 6
NP - Nepal 6
PY - Paraguay 6
AE - Emirati Arabi Uniti 5
CW - ???statistics.table.value.countryCode.CW??? 5
DO - Repubblica Dominicana 5
EG - Egitto 5
IR - Iran 5
JM - Giamaica 5
PE - Perù 5
AU - Australia 4
CZ - Repubblica Ceca 4
KG - Kirghizistan 4
PA - Panama 4
AM - Armenia 3
EE - Estonia 3
EU - Europa 3
NO - Norvegia 3
PR - Porto Rico 3
PS - Palestinian Territory 3
TH - Thailandia 3
BO - Bolivia 2
DZ - Algeria 2
GE - Georgia 2
GY - Guiana 2
HU - Ungheria 2
KZ - Kazakistan 2
MD - Moldavia 2
NG - Nigeria 2
PT - Portogallo 2
QA - Qatar 2
RS - Serbia 2
SK - Slovacchia (Repubblica Slovacca) 2
SN - Senegal 2
TZ - Tanzania 2
VC - Saint Vincent e Grenadine 2
AL - Albania 1
BA - Bosnia-Erzegovina 1
BB - Barbados 1
CI - Costa d'Avorio 1
DK - Danimarca 1
GP - Guadalupe 1
IS - Islanda 1
Totale 11.381
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Città #
Singapore 1.115
San Jose 598
Dublin 508
Chandler 481
Hong Kong 457
Ashburn 453
San Mateo 231
Santa Clara 199
Boardman 163
Perugia 162
Council Bluffs 144
Moscow 133
Jacksonville 119
Altamura 116
Dong Ket 112
Wilmington 111
Beijing 110
Medford 110
Princeton 110
Lauterbourg 107
Lawrence 101
Los Angeles 81
Ann Arbor 71
New York 68
Andover 66
Redmond 61
Seoul 57
Ho Chi Minh City 54
North Bergen 46
Munich 45
The Dalles 44
Des Moines 41
Dallas 39
Hanoi 32
Phoenix 31
Montreal 30
Saint Petersburg 29
Chicago 26
Falls Church 26
Frankfurt am Main 25
São Paulo 25
Helsinki 23
Milan 23
Norwalk 23
Piscataway 22
San Paolo di Civitate 21
Brooklyn 20
Denver 20
Atlanta 19
Orem 18
Toronto 17
Bologna 16
Brussels 16
Rome 16
Warsaw 16
Boston 15
Houston 15
London 15
Manchester 14
Rio de Janeiro 14
Tokyo 14
Poplar 13
San Francisco 13
Chennai 12
Izmir 12
New Delhi 12
Stockholm 12
Buffalo 11
Johannesburg 11
Managua 11
Shanghai 11
Woodbridge 11
Haiphong 10
Redwood City 10
Tashkent 10
Amsterdam 9
Guatemala City 9
Mexico City 9
Baghdad 8
Falkenstein 8
Guayaquil 8
Nuremberg 8
Secaucus 8
Turku 8
Vienna 8
Addis Ababa 7
Bogotá 7
Brasília 7
Charlotte 7
Columbus 7
Da Nang 7
Guangzhou 7
Jeddah 7
Philadelphia 7
Pittsburgh 7
San José 7
San Salvador 7
Amman 6
Baku 6
Caracas 6
Totale 7.238
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Nome #
Experimental Evidence of Chemical Components in the Bonding of Helium and Neon with Neutral Molecules 180
Cationic Gold(I) Diarylallenylidene Complexes: Bonding Features and Ligand Effects 176
Weak Halogen Bond in Gas-Phase Systems: Molecular Beam Scattering Experiments and Ab-Initio Calculations 174
13C NMR Spectroscopy of N-Heterocyclic Carbenes Can Selectively Probe σ Donation in Gold(I) Complexes 169
Anomalous ligand effect in gold(I)-catalyzed intramolecular hydroamination of alkynes 164
Counterion Effect in the Reaction Mechanism of NHC Gold(I)-Catalyzed Alkoxylation of Alkynes: Computational Insight into Experiment 153
Molecular-beam study of the ammonia–noble gas systems: Characterization of the isotropic interaction and insights into the nature of the intermolecular potential 153
Density Relaxation in Time-Dependent Density Functional Theory: Combining Relaxed Density Natural Orbitals and Multireference Perturbation Theories for an Improved Description of Excited States 151
Selectively measuring π back-donation in gold(I) complexes by NMR spectroscopy 144
Insight into the halogen-bond nature of noble gas-chlorine systems by molecular beam scattering experiments, ab initio calculations and charge displacement analysis 144
Charge-displacement analysis via natural orbitals for chemical valence: Charge transfer effects in coordination chemistry 135
Understanding the Reactivity of Mn-Oxo Porphyrins for Substrate Hydroxylation: Theoretical Predictions and Experimental Evidence Reconciled 134
The nature of the lead-iodine bond in PbI2: A case study for the modelling of lead halide perovskites 126
Dioxygen insertion into the gold(I)–hydride bond: spin orbit coupling effects in the spotlight for oxidative addition 122
The Role of Electronic Distribution and Charge Trasfer in Weak Halogen Bond by Molecular Beam Scattering Experiments and Ab-initio Calculations 121
Charge-Displacement Analysis of the Interaction in the Ammonia-Noble Gas Complexes 121
Alkyne Activation with Gold(III) Complexes: A Quantitative Assessment of the Ligand Effect by Charge-Displacement Analysis 121
Fluorescent signal transduction in a self-assembled Hg2+ chemosensor tuned by various interactions in micellar aqueous environment 121
Interaction of O2 with CH4, CF4, and CCl4 by Molecular Beam Scattering Experiments and Theoretical Calculations 120
A quantitative view of charge transfer in the hydrogen bond: the water dimer case 120
Spin‐forbidden reactivity of transition metal‐oxo species: exploring the potential energy surfaces 120
Helium Accepts Back-Donation In Highly Polar Complexes: New Insights into the Weak Chemical Bond 118
Advances in Charge Displacement Analysis 117
Selective Emergence of the Halogen Bond in Ground and Excited States of Noble-Gas-Chlorine Systems 117
Merging of E2 and E1cb reaction mechanisms: a combined theoretical and experimental study 116
Modulating the Bonding Properties of N-Heterocyclic Carbenes (NHCs): A Systematic Charge-Displacement Analysis 116
Charge displacement analysis — A tool to theoretically characterize the charge transfer contribution of halogen bonds 115
Spin–orbit coupling is the key to unraveling intriguing features of the halogen bond involving astatine 114
Revealing Charge Transfer in Gas-Phase: Systems with Halogen and Hydrogen Bonds 112
Catching the role of anisotropic electronic distribution and charge transfer in halogen bonded complexes of noble gases 112
Full Parallel Implementation of an All-Electron Four-Component Dirac–Kohn–Sham Program 112
Charge-displacement analysis for excited states 112
Charge transfer energy in the water-hydrogen molecular aggregate probed by molecular-beam scattering experiments, charge displacement analysis, and ab-initio calculations 110
An efficient parallel all-electron 4-component Dirac-Kohn-Sham method using a distributed matrix approach 110
A combined NMR/DFT study on the ion pair structure of [(PR12R2)Au([small eta]2-3-hexyne)]BF4 complexes 110
Chemical Bond Mechanism for Helium Revealed by Electronic Excitation 109
Spin-Forbidden Reactions: Adiabatic Transition States Using Spin-Orbit Coupled Density Functional Theory 108
An indirect approach to the determination of the nuclear quadrupole moment by 4-component relativistic DFT in molecular calculations 106
A Phosphine Gold(I) pi-Alkyne Complex: Tuning Metal-Alkyne Bond Character and Counterion Position by the Choice of the Ancillary Ligand 105
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 methods 105
Influence of the dye molecular structure on the TiO2 conduction band in dye-sensitized solar cells: disentangling charge transfer and electrostatic effects 105
Ground and excited electronic states of AuH2 via detachment energies on AuH2− using state-of-the-art relativistic calculations 105
Revealing Charge-Transfer Effects in Gas-Phase Water Chemistry 105
Disentanglement of donation and back-donation effects on experimental observables. A case study for gold-ethyne complexes 104
Intermolecular Interaction in the H2S–H2 Complex: Molecular Beam Scattering Experiments and Ab-Inito Calculations 104
The ligand effect on the oxidative addition of dioxygen to gold(I)–hydride complexes 104
Efficient parallel all-electron 4-component Dirac-Kohn-Sham program using a distributed matrix approach. II 103
Cyclization of 2-Alkynyldimethylaniline on Gold(I) Cationic and Neutral Complexes 101
Ligand Effect on Bonding in Gold(III) Carbonyl Complexes 101
An ab initio benchmark and DFT validation study on Gold(I)-catalyzed hydroamination of alkynes 101
Extensive Experimental and Computational Study of Counterion Effect in the Reaction Mechanism of NHC-Gold(I)-Catalyzed Alkoxylation of Alkynes 100
On the Dewar-Chatt-Duncanson model for catalytic gold(I) complexes 99
On the role of charge transfer in the stabilization of weakly bound complexes involving water and hydrogen sulphide molecules 98
Strong electron-donating ligands accelerate the protodeauration step in gold(I)-catalyzed reactions: a quantitative understanding of the ligand effect 98
When the Tolman electronic parameter fails: a comparative DFT and charge displacement study of [(L)Ni(CO)₃](0/-) and [(L)Au(CO)](0/+) 98
Mechanistic study of alkyne insertion into Cu−Al and Au−Al bonds: a paradigm shift for coinage metal chemistry 96
An ab initio electronic density study of the CH4–Ar, CH4–Xe, CH4–H2O and CH4–H2S complexes: insights into the nature of the intermolecular interaction 96
Ligand Effects on Bonding and Ion Pairing in Cationic Gold(I) Catalysts Bearing Unsaturated Hydrocarbons 96
Charge transfer in beryllium bonds and cooperativity of beryllium and halogen bonds. A new perspective 95
An ETS-NOCV-based computational strategies for the characterization of concerted transition states involving CO2 95
All-electron four-component Dirac-Kohn-Sham procedure for large molecules and clusters containing heavy elements 93
Leading interaction components in the structure and reactivity of noble gases compounds 93
Parallelization of a relativistic DFT code 92
The Chemical Bond in Gold(I) Complexes with N-Heterocyclic Carbenes 90
Turn-off and -on fluorescence switching of a self-assembled sensor for mercury(II) induced by anionic micelles 90
The gold(III)–CO bond: a missing piece in the gold carbonyl complex landscape 89
Tuning the Gold(I)-Carbon σ Bond in Gold-Alkynyl Complexes through Structural Modifications of the NHC Ancillary Ligand: Effect on Spectroscopic Observables and Reactivity 89
Chemical bond analysis for the entire periodic table: energy decomposition and natural orbitals for chemical valence in the four-component relativistic framework 88
Coinage Metal Effect on the Reduction of Carbon Dioxide with Monomeric Metal-Hydride Complexes 88
Radical-like reactivity for dihydrogen activation by coinage metal–aluminyl complexes: computational evidence inspired by experimental main group chemistry 88
How π back-donation quantitatively controls the CO stretching response in classical and non-classical metal carbonyl complexes 88
The mechanism of the gold(I)-catalyzed Meyer-Schuster rearrangement of 1-phenyl-2-propyn-1-ol via 4-endo-dig cyclization 88
Solvent-, Silver-, and Acid-Free NHC-Au-X Catalyzed Hydration of Alkynes. The Pivotal Role of the Counterion 88
H2O-CH4 and H2S-CH4 complexes: a direct comparison through molecular beam experiments and ab initio calculations 87
Experimental and theoretical evidence of charge transfer in weakly bound complexes of water 86
Efficient Computation of Geometries for Gold Complexes 85
Recent advances and perspectives in four-component Dirac-Kohn-Sham calculations 83
Quantitative assessment of the carbocation/carbene character of the gold-carbene bond 83
Reactivity of a Gold-Aluminyl Complex with Carbon Dioxide: A Nucleophilic Gold? 83
Electron density fitting for the Coulomb problem in relativistic density functional theory 82
Unraveling the Anion/Ligand Interplay in the Reaction Mechanism of Gold(I)-Catalyzed Alkoxylation of Alkynes 82
On the stability of helium compounds: insights from charge displacement analysis 82
Hydration of alkynes catalyzed by [Au(X)(L)(ppy)]X in the green solvent γ-valerolactone under acid-free conditions: the importance of the pre-equilibrium step 82
Chemical Characterization of Super-Heavy Elements by Four-Component DFT 81
Nature and Stability of Weak Halogen Bonds in the Gas Phase: Molecular Beam Scattering Experiments and Ab Initio Charge Displacement Calculations 81
Hydration and alkoxylation of alkynes catalyzed by NHC–Au–OTf 81
Computational strategies for a four-component Dirac-Kohn-Sham program: Implementation and first applications 80
Relativistic quantum chemistry involving heavy atoms 80
Role of Ion Pairing in the Mechanisms of Au(I)-catalysed Reactions: Theory and Experiment 80
How reduced are nucleophilic gold complexes? 79
Nuclear electric quadrupole moment of gold 79
Diffusion NMR measurements on cationic linear gold(I) complexes 79
Fluorinated beta-diketonate diglyme lanthanide complexes as new second-order nonlinear optical chromophores: the role of f electrons in the dipolar and octupolar contribution to quadratic hyperpolarizability 79
Ion Pairing in Cationic Olefin-Gold(I) Complexes 78
Intermolecular Interaction in the NH3−H2 and H2O−H2 Complexes by Molecular Beam Scattering Experiments: The Role of Charge Transfer 78
Relationship between the anion/cation relative orientation and the catalytic activity of nitrogen acyclic carbene–gold catalysts 78
Computational strategies based on electron density fitting in relativistic Density Functional Theory 77
Cooperative small molecule activation by apolar and weakly polar bonds through the lens of a suitable computational protocol 76
Widening the Landscape of Small Molecule Activation with Gold-Aluminyl Complexes: A Systematic Study of E−H (E=O, N) Bonds, SO2 and N2O Activation 76
Experimental and theoretical investigation of the cycloisomerization of N-propargylcarboxamide catalyzed by NHC-Au-X in green solvents 76
Totale 10.434
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Categoria #
all - tutte 55.030
article - articoli 0
book - libri 0
conference - conferenze 0
curatela - curatele 0
other - altro 0
patent - brevetti 0
selected - selezionate 0
volume - volumi 0
Totale 55.030
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2021/2022646 0 0 0 0 34 25 20 264 33 41 101 128
2022/20231.731 116 334 31 109 137 178 3 77 652 4 61 29
2023/2024667 48 76 26 2 11 3 188 4 82 23 111 93
2024/20251.613 20 144 43 109 275 86 28 73 333 91 283 128
2025/20263.903 246 231 227 510 486 328 678 199 463 379 119 37
2026/20271.443 72 126 276 835 134 0 0 0 0 0 0 0
Totale 11.899