CRIS Current Research Information System

RIVALTA, IVAN
 Distribuzione geografica
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Continente #
NA - Nord America 5.620
AS - Asia 5.104
EU - Europa 3.903
SA - Sud America 349
AF - Africa 245
Continente sconosciuto - Info sul continente non disponibili 7
OC - Oceania 7
Totale 15.235
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Nazione #
US - Stati Uniti d'America 5.568
CN - Cina 1.725
SG - Singapore 1.478
IT - Italia 1.056
GB - Regno Unito 781
VN - Vietnam 663
DE - Germania 515
HK - Hong Kong 403
SE - Svezia 376
KR - Corea 301
BR - Brasile 260
IN - India 257
RU - Federazione Russa 207
FR - Francia 165
IE - Irlanda 145
NL - Olanda 109
JO - Giordania 98
ZA - Sudafrica 84
FI - Finlandia 79
EE - Estonia 63
JP - Giappone 61
UA - Ucraina 61
CH - Svizzera 57
CI - Costa d'Avorio 51
AT - Austria 45
ES - Italia 44
AR - Argentina 39
ID - Indonesia 39
BE - Belgio 36
TG - Togo 36
SC - Seychelles 35
BG - Bulgaria 31
PL - Polonia 30
CA - Canada 29
EC - Ecuador 20
DK - Danimarca 18
HR - Croazia 17
MX - Messico 15
NG - Nigeria 14
NO - Norvegia 14
BD - Bangladesh 13
PK - Pakistan 12
CO - Colombia 11
CZ - Repubblica Ceca 10
LT - Lituania 10
CL - Cile 9
PT - Portogallo 9
IQ - Iraq 7
MA - Marocco 7
RO - Romania 7
LB - Libano 6
TW - Taiwan 6
AU - Australia 5
EU - Europa 5
GR - Grecia 5
TR - Turchia 5
SA - Arabia Saudita 4
SI - Slovenia 4
AE - Emirati Arabi Uniti 3
DZ - Algeria 3
IR - Iran 3
MY - Malesia 3
PY - Paraguay 3
SN - Senegal 3
UY - Uruguay 3
UZ - Uzbekistan 3
CR - Costa Rica 2
EG - Egitto 2
ET - Etiopia 2
GA - Gabon 2
KW - Kuwait 2
KZ - Kazakistan 2
LA - Repubblica Popolare Democratica del Laos 2
NP - Nepal 2
VE - Venezuela 2
AL - Albania 1
AN - Antille olandesi 1
AO - Angola 1
AZ - Azerbaigian 1
BA - Bosnia-Erzegovina 1
BO - Bolivia 1
CU - Cuba 1
CV - Capo Verde 1
CW - ???statistics.table.value.countryCode.CW??? 1
CY - Cipro 1
GE - Georgia 1
GT - Guatemala 1
HN - Honduras 1
HU - Ungheria 1
IL - Israele 1
IM - Isola di Man 1
IS - Islanda 1
JM - Giamaica 1
LI - Liechtenstein 1
MD - Moldavia 1
MG - Madagascar 1
MK - Macedonia 1
MU - Mauritius 1
NZ - Nuova Zelanda 1
PA - Panama 1
Totale 15.227
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Città #
Singapore 1.058
Fairfield 705
Southend 657
Ashburn 652
Hefei 634
Hong Kong 402
Santa Clara 361
Woodbridge 355
Houston 342
Bologna 322
Seoul 301
Seattle 298
Wilmington 252
Chandler 233
Cambridge 227
Dallas 199
Beijing 179
Princeton 177
Boardman 169
Ann Arbor 160
Dong Ket 145
Dublin 145
Ho Chi Minh City 141
Hanoi 111
Amman 98
Milan 85
Nanjing 74
Westminster 70
Redondo Beach 65
Bengaluru 62
Berlin 60
Los Angeles 54
Abidjan 51
Tokyo 50
Redmond 49
Cesena 47
Falkenstein 40
Jinan 40
Zurich 38
Saint Petersburg 37
San Diego 37
Turin 37
Lomé 36
Shenyang 36
Brussels 34
Buffalo 33
Shanghai 33
Helsinki 32
Lappeenranta 32
Olalla 32
Sofia 30
Rome 29
Dearborn 28
Munich 28
Jakarta 27
São Paulo 27
Vienna 27
Guangzhou 26
Frankfurt am Main 25
Amsterdam 24
Bremen 24
Padova 24
Secaucus 24
Changsha 23
Kyiv 23
London 23
Nuremberg 23
Tianjin 23
Warsaw 23
Tongling 22
Nanchang 21
Falls Church 20
Hebei 19
Norwalk 19
Hangzhou 18
Pisa 18
Cardiff 16
Da Nang 16
Forlì 15
New York 15
Stockholm 15
Turku 15
Zhengzhou 15
Comacchio 14
Des Moines 14
Jiaxing 14
Chicago 13
Düsseldorf 13
Phoenix 13
Fuzhou 12
Haiphong 12
Lyon 12
Mandi 12
Parma 12
Toronto 12
Trieste 12
Biên Hòa 11
Haikou 11
Jacksonville 11
Ravenna 11
Totale 10.421
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Nome #
Boosting the guerbet reaction: A cooperative catalytic system for the efficient bio-ethanol refinery to second-generation biofuels 289
Retinal photoisomerization versus counterion protonation in light and dark-adapted bacteriorhodopsin and its primary photoproduct 264
First-principles characterization of the singlet excited state manifold in DNA/RNA nucleobases 211
Is DFT enough? Towards Accurate High-Throughput Computational Screening of Azobenzenes for Molecular Solar Thermal Applications 204
Combined computational-experimental study of Ru(0)-catalyzed Guerbet reaction 194
Probing deactivation pathways of DNA nucleobases by two-dimensional electronic spectroscopy: first principles simulations 194
A theoretical study of ethylene dehydrogenation by bare Niobium atom and cation 185
Bimetallic Co-M (M = Cu, Ag, and Au) Carbonyl Complexes Supported by N-Heterocyclic Carbene Ligands: Synthesis, Structures, Computational Investigation, and Catalysis for Ammonia Borane Dehydrogenation 185
Quantum-Classical Protocol for Efficient Characterization of Absorption Lineshape and Fluorescence Quenching upon Aggregation: The Case of Zinc Phthalocyanine Dyes 184
The Guerbet reaction kinetic enigma; how co-catalysts play a crucial role in the catalytic cycle 180
COBRAMM 2.0 — A software interface for tailoring molecular electronic structure calculations and running nanoscale (QM/MM) simulations 175
Influence of stabilisers on the catalytic activity of supported Au colloidal nanoparticles for the liquid phase oxidation of glucose to glucaric acid: understanding the catalyst performance from NMR relaxation and computational studies 174
Characterizing Counterion-Dependent Aggregation of Rhodamine B by Classical Molecular Dynamics Simulations 172
Multiple Decay Mechanisms and 2D-UV Spectroscopic Fingerprints of Singlet Excited Solvated Adenine-Uracil Monophosphate 171
Two-dimensional electronic spectroscopy as a tool for tracking molecular conformations in DNA/RNA aggregates 169
Ultraviolet vision: photophysical properties of the unprotonated retinyl Schiff base in the Siberian hamster cone pigment 164
Ab initio simulations of two-dimensional electronic spectra: The SOS//QM/MM approach 163
Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table 160
UV-induced long-lived decays in solvated pyrimidine nucleosides resolved at the MS-CASPT2/MM level 157
Tracking excited state decay mechanisms of pyrimidine nucleosides in real time 153
Modeling solvent effects and convergence of 31P‐NMR shielding calculations with COBRAMM 148
Bidimensional electronic spectroscopy on indole in gas phase and in water from first principles 148
The highly excited-state manifold of guanine: calibration for nonlinear electronic spectroscopy simulations 148
Allostery in Its Many Disguises: From Theory to Applications 146
Characterization of Protein Tyrosine Phosphatase 1B Inhibition by Chlorogenic Acid and Cichoric Acid 145
Towards Accurate Simulation of Two-Dimensional Electronic Spectroscopy 144
Ultrafast Carotenoid to Retinal Energy Transfer in Xanthorhodopsin Revealed by the Combination of Transient Absorption and Two-Dimensional Electronic Spectroscopy 144
Activation of methane by the iron dimer cation. A theoretical study 143
Acetylene cyclotrimerization by early second-row transition metals in the gas phase. A theoretical study 143
Allosteric pathways in imidazole glycerol phosphate synthase 142
Spectral lineshapes in nonlinear electronic spectroscopy 142
BOOSTING THE GUERBET REACTION: A COOPERATIVE HOMOGENEOUS CATALYTIC SYSTEM FOR BIOETHANOL REFINERY TO SECOND-GENERATION BIOFUELS 141
Fine Tuning of Retinal Photoinduced Decay in Solution 141
Excited state evolution of DNA stacked adenines resolved at the CASPT2//CASSCF/Amber level: from the bright to the excimer state and back 140
Modeling the high-energy electronic state manifold of adenine: Calibration for nonlinear electronic spectroscopy 140
Characterization of an amorphous iridium water-oxidation catalyst electrodeposited from organometallic precursors 136
Effect of Capping Ligands for the Synthesis of Gold Nanoparticles and on the Catalytic Performance for the Oxidation of 5-Hydroxymethyl-2-furfural 134
Two State Reactivity Paradigm in Catalysis. The Example of X-H (X = O, N, C) and C-C Bonds Activation Mediated by Transition Metal Compounds 134
Adsorption of ethylene, vinyl, acetic acid, and acetate species on PdAu(111) and PdAu(100) surface alloys: A cluster model study 133
The effect of solvent relaxation in the ultrafast time-resolved spectroscopy of solvated benzophenone 132
Theoretical study of the gas-phase ethane C-H and C-C bonds activation by bare niobium cation 132
ACS Sustainable Chemistry & Engineering 129
Atomic configurations of Pd atoms in PdAu(1 1 1) and PdAu(1 0 0) surface alloys: Ab initio density functional calculations 129
How to bring alcohols out of the Guerbet’s labyrinth: an efficient homogeneous catalytic approach 128
Characterizing Conical Intersections in DNA/RNA Nucleobases with Multiconfigurational Wave Functions of Varying Active Space Size 128
Modelling quenching mechanisms of disordered molecular systems in the presence of molecular aggregates 128
Structure-activity relationships of ZrO2 crystalline phases in the catalytic transfer hydrogenation of methyl levulinate with ethanol 127
Two-Dimensional Electronic Spectroscopy of Benzene, Phenol, and Their Dimer: An Efficient First-Principles Simulation Protocol 125
Two-dimensional UV spectroscopy: A new insight into the structure and dynamics of biomolecules 125
Optimal-tuning of range-separated density functionals to describe the optical and photophysical properties of rhodamine B dimers 124
Protospacer Adjacent Motif-Induced Allostery Activates CRISPR-Cas9 124
Allosteric Pathways in the PPARγ 3-RXRα nuclear receptor complex 124
Community Network Analysis of Allosteric Proteins 124
Tracking Conformational Dynamics of Polypeptides by Nonlinear Electronic Spectroscopy of Aromatic Residues: A First-Principles Simulation Study 123
UNRAVELLING THE MECHANISM OF THE GUERBET REACTION USING A RUTHENIUM CATALYST: A SYNERGISTIC COMPUTATIONAL AND EXPERIMENTAL STUDY 122
The carbonyl-lock mechanism underlying non-aromatic fluorescence in biological matter 122
Allosteric Communication Disrupted by a Small Molecule Binding to the Imidazole Glycerol Phosphate Synthase Protein-Protein Interface 122
Triplet Oxygen Evolution Catalyzed by a Biomimetic Oxomanganese Complex: Functional Role of the Carboxylate Buffer 122
Eigenvector centrality for characterization of protein allosteric pathways 121
Theoretical Model of the Protochlorophyllide Oxidoreductase from a Hierarchy of Protocols 120
Resolving the Singlet Excited State Manifold of Benzophenone by First-Principles Simulations and Ultrafast Spectroscopy 120
Spectral tuning of ultraviolet cone pigments: An interhelical lock mechanism 119
Experimental and theoretical study on the homogeneous catalyzed Guerbet reaction with ruthenium-NHC complexes 118
The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry 118
Solution NMR and computational methods for understanding protein allostery 118
Experimental and theoretical study on the homogeneous catalyzed Guerbet reaction with ruthenium-NHC complexes 117
Disentangling Peptide Configurations via Two-Dimensional Electronic Spectroscopy: Ab Initio Simulations Beyond the Frenkel Exciton Hamiltonian 117
Computational Studies of the Oxygen-Evolving Complex of Photosystem II and Biomimetic Oxomanganese Complexes for Renewable Energy ApplicationsApplications of Molecular Modeling to Challenges in Clean Energy 117
Tracking the primary photoconversion events in rhodopsins by ultrafast optical spectroscopy 116
Structural Studies of Oxomanganese Complexes for Water Oxidation Catalysis 116
Modeling multidimensional spectral lineshapes from first principles: Application to water-solvated adenine 116
RUTHENIUM BIFUNCTIONAL BASED CATALYTIC SYSTEMS TO TUNE EFFICENCY AND SELECTIVITY IN ALCOHOL HOMOLOGATION 115
Modelling retinal chromophores photoisomerization: from minimal models in vacuo to ultimate bidimensional spectroscopy in rhodopsins 115
Photo-Active Biological Molecular Materials: From Photoinduced Dynamics to Transient Electronic Spectroscopies 114
Predicting the exchange coupling constant in a diiron complex 113
Theoretical investigation of the mechanism of acid-catalyzed oxygenation of a Pd(II)-hydride to produce a Pd(II)-hydroperoxide 113
Structural-functional role of chloride in photosystem II 112
Oxomanganese complexes for natural and artificial photosynthesis 112
The role of quantum chemistry in the elucidation of the elementary mechanisms of catalytic processes: From atoms, to surfaces, to enzymes 112
Connected Component Analysis of Dynamical Perturbation Contact Networks 111
Key role of the REC lobe during CRISPR-Cas9 activation by 'sensing', 'regulating', and 'locking' the catalytic HNH domain 110
Polymerization isomerism in co-m (M = cu, ag, au) carbonyl clusters: Synthesis, structures and computational investigation 109
UNRAVELLING THE MECHANISM OF THE GUERBET REACTION USING A RUTHENIUM CATALYST: A SYNERGISTIC COMPUTATIONAL AND EXPERIMENTAL STUDY 108
Singular Interface Dynamics of the SARS-CoV-2 Delta Variant Explained with Contact Perturbation Analysis 107
SYNERGISTIC COMPUTATIONAL AND EXPERIMENTAL STUDY OF THE MECHANISM OF THE RU-CATALYSED GUERBET REACTION 106
Homogeneous Green Conversion of the Bio-Based Platform HMF (5-Hydroxymethylfurfural) into BHMF (2,5-Bis(hydroxymethyl)furan): Synthesis and LCA (Life Cycle Assessment) 105
Modelling Time-Resolved Two-Dimensional Electronic Spectroscopy of the Primary Photoisomerization Event in Rhodopsin 105
Interaction of CO with PdAu(111) and PdAu(100) bimetallic surfaces: A theoretical cluster model study 104
Reengineering rate-limiting, millisecond enzyme motions by introduction of an unnatural amino acid 104
Theoretical and experimental study on the role of benzoquinone in the homogeneous catalyzed Guerbet reaction 103
The geometric effect in palladium-gold catalysis. Is the coupling the rate-determining step in the vinyl-acetate synthesis? 103
The influence of surface oxygen and hydroxyl groups on the dehydrogenation of ethylene on PdAu surface alloys. A theoretical cluster model study 103
On the insertion mechanism of molecular oxygen into a Pd(II)-H bond. Something to add 103
Noncollinear spins provide a self-consistent treatment of the low-spin state of a biomimetic oxomanganese synthetic trimer inspired by the oxygen evolving complex of photosystem II 102
Facile ecofriendly synthesis of monastrol and its structural isomers via biginelli reaction 101
Simulating Plasmon Resonances of Gold Nanoparticles with Bipyramidal Shapes by Boundary Element Methods 101
The recognition of a new pathway for the reaction of molecular oxygen with a Pd(II)-hydride to produce a Pd(II)-hydroperoxide 99
S1-state model of the O2-evolving complex of photosystem II 98
Pd, Rh, Ir and Pt adsorption on gold: A theoretical study of different surfaces 97
Unravelling the Mechanism of the Guerbet Reaction Catalyzed by a Ruthenium Catalyst: a Synergistic Computational and Experimental Study 96
Totale 13.444
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Categoria #
all - tutte 45.994
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 45.994
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021786 0 0 0 0 0 72 69 43 171 80 54 297
2021/20221.562 160 24 108 95 165 73 57 168 86 38 327 261
2022/20231.819 124 195 77 209 107 119 51 163 368 73 152 181
2023/2024822 81 108 44 79 71 94 69 78 19 61 78 40
2024/20253.438 89 482 269 225 524 175 235 209 65 164 274 727
2025/20263.814 641 1.077 868 611 576 41 0 0 0 0 0 0
Totale 15.698