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

TARANTELLI, Francesco
 Distribuzione geografica
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Continente #
NA - Nord America 8.172
EU - Europa 6.051
AS - Asia 5.516
SA - Sud America 1.004
AF - Africa 124
Continente sconosciuto - Info sul continente non disponibili 10
OC - Oceania 8
Totale 20.885
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Nazione #
US - Stati Uniti d'America 8.021
SG - Singapore 2.611
UA - Ucraina 1.249
IE - Irlanda 1.082
RU - Federazione Russa 926
BR - Brasile 784
HK - Hong Kong 725
VN - Vietnam 681
CN - Cina 673
IT - Italia 613
SE - Svezia 607
DE - Germania 414
FR - Francia 351
FI - Finlandia 333
GB - Regno Unito 180
KR - Corea 140
IN - India 128
TR - Turchia 96
BD - Bangladesh 76
AR - Argentina 75
IQ - Iraq 60
CA - Canada 59
MX - Messico 57
PL - Polonia 44
PK - Pakistan 42
CH - Svizzera 41
ZA - Sudafrica 39
CO - Colombia 37
JP - Giappone 37
SA - Arabia Saudita 37
AT - Austria 34
BE - Belgio 33
UZ - Uzbekistan 33
EC - Ecuador 31
NL - Olanda 28
ID - Indonesia 27
ES - Italia 26
VE - Venezuela 26
PH - Filippine 25
TN - Tunisia 22
LB - Libano 20
CL - Cile 19
JO - Giordania 16
CZ - Repubblica Ceca 15
MA - Marocco 15
GR - Grecia 14
PT - Portogallo 14
PY - Paraguay 12
MY - Malesia 11
PE - Perù 11
RO - Romania 11
AE - Emirati Arabi Uniti 10
EU - Europa 10
NP - Nepal 10
EG - Egitto 9
LT - Lituania 9
AZ - Azerbaigian 8
KZ - Kazakistan 8
CR - Costa Rica 7
ET - Etiopia 7
KE - Kenya 7
AU - Australia 6
KG - Kirghizistan 6
OM - Oman 6
IR - Iran 5
UY - Uruguay 5
AL - Albania 4
BO - Bolivia 4
IL - Israele 4
JM - Giamaica 4
LY - Libia 4
NI - Nicaragua 4
PA - Panama 4
PS - Palestinian Territory 4
BB - Barbados 3
BG - Bulgaria 3
DO - Repubblica Dominicana 3
DZ - Algeria 3
LV - Lettonia 3
SN - Senegal 3
BA - Bosnia-Erzegovina 2
BW - Botswana 2
EE - Estonia 2
GE - Georgia 2
GT - Guatemala 2
HN - Honduras 2
HR - Croazia 2
IS - Islanda 2
KH - Cambogia 2
MD - Moldavia 2
MU - Mauritius 2
NG - Nigeria 2
NO - Norvegia 2
NZ - Nuova Zelanda 2
QA - Qatar 2
RS - Serbia 2
TJ - Tagikistan 2
AM - Armenia 1
BH - Bahrain 1
BS - Bahamas 1
Totale 20.861
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Città #
Singapore 1.852
Chandler 1.155
Dublin 1.081
Hong Kong 723
San Mateo 670
San Jose 609
Jacksonville 600
Dong Ket 417
Boardman 404
Ashburn 337
Santa Clara 308
Moscow 292
Medford 277
Wilmington 277
Princeton 276
Lauterbourg 241
Des Moines 239
Ann Arbor 203
Perugia 201
Altamura 175
Andover 172
Beijing 168
Lawrence 151
Seoul 135
Ho Chi Minh City 101
The Dalles 101
Munich 87
Los Angeles 86
Saint Petersburg 81
New York 70
São Paulo 62
Hanoi 58
Norwalk 54
Redmond 49
Helsinki 47
Izmir 44
Piscataway 43
Frankfurt am Main 37
Tokyo 34
Brussels 33
Dallas 31
San Paolo di Civitate 30
Brooklyn 28
Turku 27
Chicago 25
Rio de Janeiro 25
Shanghai 25
Baghdad 24
Orem 23
Warsaw 23
Denver 22
Falls Church 22
Johannesburg 22
Woodbridge 20
Atlanta 18
Belo Horizonte 18
Bologna 18
London 18
Mexico City 18
Boston 17
Montreal 17
Poplar 17
Chennai 16
Phoenix 16
San Francisco 16
Tashkent 16
Toronto 16
Brasília 15
Haiphong 15
Milan 15
New Delhi 15
Redwood City 15
Da Nang 14
Guayaquil 14
Riyadh 14
Houston 13
Nuremberg 13
Stockholm 13
Ankara 12
Manchester 12
Amman 11
Columbus 11
Jeddah 11
Lahore 11
Medellín 11
Den Haag 10
Guangzhou 10
Guarulhos 10
Miami 10
Mumbai 10
Pune 10
Recife 10
Rome 10
Seattle 10
Council Bluffs 9
Curitiba 9
Fortaleza 9
Campinas 8
Frankfurt Am Main 8
Islamabad 8
Totale 12.894
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Nome #
Experimental Evidence of Chemical Components in the Bonding of Helium and Neon with Neutral Molecules 163
Anomalous ligand effect in gold(I)-catalyzed intramolecular hydroamination of alkynes 153
13C NMR Spectroscopy of N-Heterocyclic Carbenes Can Selectively Probe σ Donation in Gold(I) Complexes 151
Weak Halogen Bond in Gas-Phase Systems: Molecular Beam Scattering Experiments and Ab-Initio Calculations 148
Counterion Effect in the Reaction Mechanism of NHC Gold(I)-Catalyzed Alkoxylation of Alkynes: Computational Insight into Experiment 145
Molecular-beam study of the ammonia–noble gas systems: Characterization of the isotropic interaction and insights into the nature of the intermolecular potential 140
Density Relaxation in Time-Dependent Density Functional Theory: Combining Relaxed Density Natural Orbitals and Multireference Perturbation Theories for an Improved Description of Excited States 134
Insight into the halogen-bond nature of noble gas-chlorine systems by molecular beam scattering experiments, ab initio calculations and charge displacement analysis 130
Ab initio block-Lanczos calculation of the Auger spectra of SiF$_4$: strong two-hole localization effects and foreign imaging 125
Selectively measuring π back-donation in gold(I) complexes by NMR spectroscopy 125
Reactive dynamics from the hyperspherical perspective: ab initio potential energy surface and kinetic paths for the O (3P) + H2 reaction 118
Charge-displacement analysis via natural orbitals for chemical valence: Charge transfer effects in coordination chemistry 118
A CI investigation on the core ionized and core-rydberg excited states of NH2 117
A theoretical investigation of the copper-super-oxide system. A model for the mechanism of copper-zinc superoxide dismutase 115
A CI investigation of the core ionized states derived from 1A1 and 3B1 methylene 115
Benchmarking a model potential to investigate intermolecular interactions 111
All ab initio Auger spectra of HF and LiF: energies, intensities and vibrational shifts and broadenings 111
A Green’s function study and a configuration interaction investigation on the doubly ionized statesof H2O 111
Charge-Displacement Analysis of the Interaction in the Ammonia-Noble Gas Complexes 111
Penning ionization of N2O molecules by He* (2 3,1S) and Ne* (3P2,0) metastable atoms: A crossed beam study 110
A photoelectron and double photoionization study of the valence electronic structure of 1,4-bromofluorobenzene 108
A DFT investigation of base-catalyzed β-elimination reactions in water solution for systems activated by the pyridine ring: Theory vs. Experiment 108
Computing molecular energy surfaces on a grid 107
A CI investigation on the ionized states of BeH2 107
Helium Accepts Back-Donation In Highly Polar Complexes: New Insights into the Weak Chemical Bond 107
Alkyne Activation with Gold(III) Complexes: A Quantitative Assessment of the Ligand Effect by Charge-Displacement Analysis 107
A non-empirical LCAO MO SCF investigation of the ground and core hole states of some simple AH2 systems 106
Selective Emergence of the Halogen Bond in Ground and Excited States of Noble-Gas-Chlorine Systems 106
Aggregation state effect in Auger spectroscopy. The fluorine KLL spectrum of KF 105
A quantitative view of charge transfer in the hydrogen bond: the water dimer case 105
A theoretical investigation of the ground and core hole states of [Cu(NH3)2CO]+ and [Cu(NH3)3 CO]+. Models for the reversible binding of CO to Cu(I) complexes 104
An experimental and theoretical investigation on the effect of the substituent in the monohalo derivatives of the C2H4 molecule 104
Dioxygen insertion into the gold(I)–hydride bond: spin orbit coupling effects in the spotlight for oxidative addition 104
Modulating the Bonding Properties of N-Heterocyclic Carbenes (NHCs): A Systematic Charge-Displacement Analysis 104
An efficient parallel all-electron 4-component Dirac-Kohn-Sham method using a distributed matrix approach 103
Block Lanczos and many-body theory: Application to the one-particle Green's function 101
An (e,2e) spectroscopic investigation and a Green’s function study of the ionization of fluoroethylene 101
A theoretical study on the co-ordination of dinitrogen and related molecules to nickel(0): ab initio calculations on the model compounds [Ni(PH3)2(N2)], [Ni(PH3)2(N2CH2)], and [Ni(PH3)2(N2H2)] 101
Many dicationic states and two-hole population analysis as a bridge to Auger spectra: strong local-ization phenomena in BF3 101
Calcolo della struttura elettronica di grandi sistemi molecolari, aggregati, cluster e sistemi estesi con metodi quantistici ab initio 100
Advances in Charge Displacement Analysis 100
An indirect approach to the determination of the nuclear quadrupole moment by 4-component relativistic DFT in molecular calculations 99
(e,2e) spectroscopy of silicon compounds. Ionization potentials and electron momentum distributions for valence shell orbitals of SiF4 99
Full Parallel Implementation of an All-Electron Four-Component Dirac–Kohn–Sham Program 99
Charge-displacement analysis for excited states 99
Theoretical investigations of molecular triple ionization spectra 98
Charge transfer energy in the water-hydrogen molecular aggregate probed by molecular-beam scattering experiments, charge displacement analysis, and ab-initio calculations 98
Ionization of fluoromethanes: CHF3 and CF4. A Green's function study and an (e,2e) spectroscopic investigation 98
Linear algebra computation benchmarks on a model grid platform 98
A theoretical investigation on the activation of dinitrogen 97
Intermolecular Interaction in the H2S–H2 Complex: Molecular Beam Scattering Experiments and Ab-Inito Calculations 97
Catching the role of anisotropic electronic distribution and charge transfer in halogen bonded complexes of noble gases 97
A combined NMR/DFT study on the ion pair structure of [(PR12R2)Au([small eta]2-3-hexyne)]BF4 complexes 97
Ionization of N 2 O molecules by collision with He * ( 3,1 S) and Ne * ( 3 P 2,0 ) metastable atoms 96
Merging of E2 and E1cb reaction mechanisms: a combined theoretical and experimental study 96
An (e,2e) spectroscopic investigation and a Green’s function study of the ionization of chloro- andbromo-ethylene 96
pKa of zinc-bound water and nucleophilicity of hydroxo-containing species. Ab initio calculations on models for zinc-enzymes 96
Highly excited electronic states of molecular clusters and their decay 95
Ab initio calculations on model systems miming molecular batteries 95
Interaction of O2 with CH4, CF4, and CCl4 by Molecular Beam Scattering Experiments and Theoretical Calculations 95
Revealing Charge Transfer in Gas-Phase: Systems with Halogen and Hydrogen Bonds 95
Chemical Bond Mechanism for Helium Revealed by Electronic Excitation 95
Spin-Forbidden Reactions: Adiabatic Transition States Using Spin-Orbit Coupled Density Functional Theory 95
Adiabatic and non-adiabatic effects of nuclear dynamics in spectra of decaying states: Auger spectrum of HF 94
A theoretical investigation on the electronic structure of Cp6Ti6O8-nCln clusters ( n = 0, 2, 4, 6, 8 ) 94
A theoretical investigation on the interaction of formaldehyde with transition metal complexes 94
Revealing Charge-Transfer Effects in Gas-Phase Water Chemistry 94
Dynamical core-hole screening in weak chemisorption systems 93
Ionization of Luorinated methanes and ethilenes through (e,2e) process and Green's function approach to predict ionization potentials 93
Ab initio calculations on model systems miming molecular batteries 93
The Role of Electronic Distribution and Charge Trasfer in Weak Halogen Bond by Molecular Beam Scattering Experiments and Ab-initio Calculations 93
A Phosphine Gold(I) pi-Alkyne Complex: Tuning Metal-Alkyne Bond Character and Counterion Position by the Choice of the Ancillary Ligand 92
Influence of the dye molecular structure on the TiO2 conduction band in dye-sensitized solar cells: disentangling charge transfer and electrostatic effects 92
An ab initio benchmark and DFT validation study on Gold(I)-catalyzed hydroamination of alkynes 92
The ligand effect on the oxidative addition of dioxygen to gold(I)–hydride complexes 91
Ligand Effect on Bonding in Gold(III) Carbonyl Complexes 91
Interaction components in HX2+ bond 90
Valence ionization of HCl. An investigation of many-body effects 90
An Xalpha investigation of photoelectron spectra and bond structure of fluorides and oxyfluorides of nitrogen and phosphorus 89
Cyclization of 2-Alkynyldimethylaniline on Gold(I) Cationic and Neutral Complexes 89
Efficient parallel all-electron 4-component Dirac-Kohn-Sham program using a distributed matrix approach. II 89
Evidence of a borderline region between E1cb and E2 elimination reaction mechanisms: a combined experimental and theoretical study of systems activated by the pyridine ring 88
On the role of charge transfer in the stabilization of weakly bound complexes involving water and hydrogen sulphide molecules 88
The electronic structure of TiCl4 and VCl4 by MS-SCF-Xalpha method. Assignment of photo-electron and electronic spectra 88
An experimental ESCA investigation of some copper complexes involving CO 88
A theoretical investigation on the interaction of formaldehyde with transition metal complexes 88
Disentanglement of donation and back-donation effects on experimental observables. A case study for gold-ethyne complexes 88
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 88
On the existence of free doubly negative molecular ions 87
An ab initio study on the coordination of formaldehyde, carbon dioxide, dinitrogen and related molecules to iron(0) and nickel(0) fragments 87
Strong electron-donating ligands accelerate the protodeauration step in gold(I)-catalyzed reactions: a quantitative understanding of the ligand effect 87
Autoionization widths by Stieltjes imaging applied to Lanczos pseudospectra 87
The halogen-bond nature in noble gas-dihalogen complexes from scattering experiments and Ab initio calculations 87
Cooperative role of halogen and hydrogen bonding in the stabilization of water adducts with apolar molecules 86
Double photoionization of thiophene and bromine-substituted thiophenes 85
F. Tarantelli, L.S. CederbaumOn the choice of orbital bases for configuration interaction 85
Band shape and vibrational structure in Auger spectra: Theory and application to carbon monoxide 85
Total photoionization cross-sections of excited electronic states by the algebraic diagrammatic construction-Stieltjes-Lanczos method 85
Tracing electron solvation in Li-(NH3)n clusters with K-shell photodetachment spectroscopy 85
When the Tolman electronic parameter fails: a comparative DFT and charge displacement study of [(L)Ni(CO)₃](0/-) and [(L)Au(CO)](0/+) 85
Totale 10.170
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Categoria #
all - tutte 94.622
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 94.622
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021699 0 0 0 0 0 0 0 0 0 60 193 446
2021/20222.215 51 409 47 106 70 22 26 692 37 150 211 394
2022/20233.890 308 512 62 326 320 579 5 179 1.426 5 113 55
2023/20241.126 108 155 60 16 11 10 210 18 156 31 185 166
2024/20253.045 35 328 62 136 462 105 42 191 672 179 563 270
2025/20266.388 479 380 371 1.002 792 595 1.111 326 792 540 0 0
Totale 21.609