Archivio istituzionale della ricerca dell'Università degli Studi di Palermo

DUCA, Dario
 Distribuzione geografica
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Continente #
NA - Nord America 8.335
EU - Europa 5.591
AS - Asia 4.048
SA - Sud America 628
AF - Africa 141
OC - Oceania 6
Continente sconosciuto - Info sul continente non disponibili 4
Totale 18.753
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Nazione #
US - Stati Uniti d'America 8.137
SG - Singapore 1.495
RU - Federazione Russa 1.325
IT - Italia 1.112
CN - Cina 1.082
FR - Francia 717
FI - Finlandia 499
BR - Brasile 482
HK - Hong Kong 452
DE - Germania 449
UA - Ucraina 443
VN - Vietnam 386
PL - Polonia 270
GB - Regno Unito 259
IE - Irlanda 208
JP - Giappone 155
CA - Canada 121
SE - Svezia 99
KR - Corea 93
CI - Costa d'Avorio 60
IN - India 60
AR - Argentina 52
BD - Bangladesh 51
MX - Messico 46
BE - Belgio 41
IQ - Iraq 38
NL - Olanda 31
TR - Turchia 29
RO - Romania 26
ES - Italia 25
IR - Iran 23
PK - Pakistan 23
ZA - Sudafrica 23
CO - Colombia 21
VE - Venezuela 20
EC - Ecuador 17
ID - Indonesia 17
UZ - Uzbekistan 17
AT - Austria 15
JO - Giordania 15
MY - Malesia 15
AZ - Azerbaigian 13
MA - Marocco 13
PY - Paraguay 13
DK - Danimarca 11
KE - Kenya 11
NP - Nepal 11
PH - Filippine 11
CZ - Repubblica Ceca 10
SA - Arabia Saudita 10
CH - Svizzera 8
CL - Cile 7
EG - Egitto 7
IL - Israele 7
LB - Libano 7
PE - Perù 7
TN - Tunisia 7
AE - Emirati Arabi Uniti 6
BO - Bolivia 6
DZ - Algeria 6
HN - Honduras 6
AL - Albania 5
BG - Bulgaria 5
ET - Etiopia 5
GR - Grecia 5
KZ - Kazakistan 5
OM - Oman 5
PA - Panama 5
AU - Australia 4
BY - Bielorussia 4
HR - Croazia 4
LT - Lituania 4
PR - Porto Rico 4
BH - Bahrain 3
MD - Moldavia 3
NI - Nicaragua 3
PS - Palestinian Territory 3
PT - Portogallo 3
SY - Repubblica araba siriana 3
TW - Taiwan 3
BA - Bosnia-Erzegovina 2
CR - Costa Rica 2
DO - Repubblica Dominicana 2
EE - Estonia 2
GE - Georgia 2
GT - Guatemala 2
JM - Giamaica 2
KG - Kirghizistan 2
NE - Niger 2
NG - Nigeria 2
NO - Norvegia 2
NZ - Nuova Zelanda 2
UY - Uruguay 2
XK - ???statistics.table.value.countryCode.XK??? 2
A2 - ???statistics.table.value.countryCode.A2??? 1
AF - Afghanistan, Repubblica islamica di 1
AO - Angola 1
BB - Barbados 1
CG - Congo 1
CY - Cipro 1
Totale 18.736
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Città #
Ashburn 1.308
Singapore 950
Fairfield 812
Chandler 541
Woodbridge 523
Hong Kong 426
San Jose 388
Wilmington 358
Houston 350
Palermo 349
Ann Arbor 338
Seattle 326
Cambridge 278
Jacksonville 238
Zgierz 238
Dublin 208
Beijing 197
Moscow 183
Medford 173
Santa Clara 151
Des Moines 148
Tokyo 146
Frankfurt am Main 137
Ho Chi Minh City 122
Nanjing 117
Los Angeles 116
Lauterbourg 110
Princeton 106
Hanoi 92
Dallas 83
Munich 83
Mcallen 80
Altamura 77
New York 77
Montréal 72
Tulsa 68
Hefei 61
Abidjan 60
Council Bluffs 60
Lawrence 53
Buffalo 52
San Diego 49
Boardman 45
Milan 42
Dearborn 40
Brussels 39
Chicago 39
Helsinki 37
São Paulo 37
Changsha 36
Hebei 35
The Dalles 34
Shenyang 31
Ludwigshafen am Rhein 30
Nanchang 28
Guangzhou 27
Venice 27
Columbus 26
Jinan 26
Orem 26
Shanghai 25
Tianjin 25
Warsaw 24
Da Nang 22
Haiphong 22
London 22
Montreal 19
Johannesburg 17
Lappeenranta 17
Saint Petersburg 17
Amsterdam 16
Baghdad 16
Kumar 16
Seongnam 16
Washington 16
Belo Horizonte 15
Central 15
Rio de Janeiro 15
Amman 14
Catania 14
Jiaxing 14
Rome 14
Auburn Hills 13
Baku 13
Berlin 13
Nuremberg 13
Tehran 13
Villabate 13
Zhengzhou 13
Atlanta 12
Boston 12
Cary 12
Denver 12
Düsseldorf 12
Falls Church 12
Hangzhou 12
Brasília 11
Chennai 11
Ningbo 11
Paris 11
Totale 11.519
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Nome #
Growth of sub-nanometric palladium clusters on boron nitride nanotubes: A DFT study 955
Cation Environment of BaCeO3-Based Protonic Conductors II: New Computational Models 269
Y:BaZrO3 Perovskite Compounds II: Designing Protonic Conduction by Using MD Models 262
Boron Nitride‐supported Sub‐nanometer Pd6 Clusters for Formic Acid Decomposition: A DFT Study 261
Adsorbed CO on group 10 metal fragments: A DFT study 252
H-ZSM-5 Modified Zeolite: Quantum Chemical Models of Acidic Sites 250
Y:BaZrO3 Perovskite Compounds I: DFT Study on the Unprotonated and Protonated Local Structures 243
A Combined Theoretical and Experimental Approach for Platinum Catalyzed 1,2-Propanediol Aqueous Phase Reforming 230
Confined But-2-ene catalytic isomerization inside H-ZSM-5 models: A DFT study 223
CASSCF/CASPT2 analysis of the fragmentation of H2 on a Pd4 cluster 223
A DFT study of IRMOF-3 catalysed Knoevenagel condensation 223
Cation Environment in BaCeO3-Based Protonic Conductors: a Computational Study 219
In situ ATR-IR studies in aqueous phase reforming of hydroxyacetone on Pt/ZrO2and Pt/AlO(OH) catalysts: The role of aldol condensation 219
Density Functional Theory Investigation on the Nucleation of Homo- and Heteronuclear Metal Clusters on Defective Graphene 218
DFT Studies on Catalytic Properties of Isolated and Carbon Nanotube Supported Pd9 Cluster – I: Adsorption, Fragmentation and Diffusion of Hydrogen 211
Molecular-Level Characterization of Heterogeneous Catalytic Systems by Algorithmic Time Dependent Monte Carlo 211
Butene Isomerization and Double-Bond Migration on the H-ZSM-5 Outer Surface: A Density Functional Theory Study 211
Construction and characterization of models of hypercrosslinked polystyrene 207
Synthesis, characterization and conformational analysis of chloro-bis(glycylglycinate)germanium(IV) chloride 205
A computational and experimental investigation of the anchoring of organosilanes on the halloysite silicic surface 202
IDEA: interface dynamics and energetics algorithm 202
Density Functional Theory Investigation on the Nucleation and Growth of Small Palladium Clusters on a Hyper-Cross-Linked Polystyrene Matrix 199
Investigation of Polyol Adsorption on Ru, Pd, and Re Using vdW Density Functionals 197
H2 hitting on graphene supported palladium cluster: molecular dynamics simulations 197
DFT insights into the oxygen-assisted selective oxidation of benzyl alcohol on manganese dioxide catalysts 195
A computational and experimental investigation of halloysite silicic surface modifications after alkaline treatment 194
Computational Aspects in heterogeneous nano-catalysis 193
Hydrogenolysis of hydroxymatairesinol on Y derived catalysts: a computational study 192
Shape-Dependence of Pd Nanocrystal Carburization during Acetylene Hydrogenation 191
Catalysis in confined spaces: computational study of H-ZSM5 zeolite reactivity 188
α-d-Glucopyranose Adsorption on a Pd30 Cluster Supported on Boron Nitride Nanotube 186
Graph-Based Analysis of Ethylene Glycol Decomposition on a Palladium Cluster 185
DFT calculations on subnanometric metal catalysts: a short review on new supported materials 183
SCSA Code: Applications on the Cyclopeptide Renieramide 181
Alkali-Metal Azides Interacting with Metal–Organic Frameworks 181
Studio teorico della reazione di idroisomerizzazione del cis-butene su cluster di palladio supportato 178
Computational Investigation of Alkynols and alkyndiols Hydrogenation on a Palladium Cluster 178
l-Arabinose Conformers Adsorption on Ruthenium Surfaces: A DFT Study 177
Structural and kinetic DFT characterization of materials to rationalize catalytic performances 176
Oxygen-Assisted Hydroxymatairesinol Dehydrogenation: A Selective Secondary-Alcohol Oxidation over a Gold Catalyst 175
N-Doped Carbon Networks: Alternative Materials Tracing New Routes for Activating Molecular Hydrogen 174
Benzyl alcohol to benzaldehyde oxidation on MnOx clusters: Unraveling atomistic features 173
Computational approaches used in the POLYCAT EU project 171
CO on Nickel: some computational insights about steric hindrance in loaded surfaces 167
Systematic conformational search analysis of the SRR and RRR epimers of 7-hydroxymatairesinol 167
Disclosing the emissive surface traps in green-emitting carbon nanodots 167
Comparison of different theory models and basis sets in the calculation of 13C NMR chemical shifts natural products 166
BUTENE/H-ZSM-5:STUDIO COMPUTAZIONALE DI MODELLI DI SUPERFICIE E CATALITICI. 163
DFT studies on catalytic properties of isolated and carbon nanotube supported Pd9 cluster. Part II. Hydro-isomerization of butene isomers 161
COMPUTATIONAL APPROACHES EMPLOYED IN THE SusFuelCat PROJECT 160
Metodi quantomeccanici e Monte Carlo applicati a sistemi nanostrutturati 159
Factors Controlling the Energy of Nitrogen Monolayer Coverage on High Surface Area Catalyst Oxide Carriers 157
Propan-2-ol dehydration on H-ZSM-5 and H-Y zeolite: a DFT study 155
HPS-based catalysts: a computational study 154
H2 transformations on graphene supported palladium cluster: Dft-md simulations and neb calculations 150
Catalytic activity of T22 H-ZSM-5 zeolite on the trans–cis 2-butene isomerization 149
MOF DERIVATIVES AS MOLECULAR TOOLS TO TRAP METAL AZIDES 148
DFT investigation of polyalcohols reforming on palladium cluster 148
Computational Investigation of Palladium Supported Boron Nitride Nanotube Catalysts 146
DFT study of reduction reactions on a palladium cluster supported on a carbon nanotube 145
Computational investigation of isoeugenol transformations on a platinum cluster – I: Direct deoxygenation to propylcyclohexane 144
Information science and computational methods in the modern chemistry education 144
Quantum chemical models of acidic sites in H-ZSM-5 zeolites 144
Curriculum didattico del Chimico Moderno: Discipline Informatiche e Computazionali 143
CO on Ni group metals: a theoretical study 143
L-arabinose adsorption on hydrogenated and hydrated ruthenium catalyst 141
X-ray absorption spectra of Cu(II)- and Cu(III)- complexes of N,N’-1,2-phenylenebis(2-mercapto-2-methyl-propionamide) 139
A new algorithm to explain adsorption-desorption processes on metal surfaces 138
Empathes: A general code for nudged elastic band transition states search 138
Adsorption and reaction of small molecules on palladium clusters: DFT studies 136
Modeling of catalytic materials: advances in studying different supports 135
Alkane dehydrogenation on defective BN quasi-molecular nanoflakes: DFT studies 135
Theoretical study of palladium cluster structures on carbonaceous supports 134
MOF derivatives as cage for alkali-metal azides: a DFT study 134
Computational study of metal-free N-doped carbon networks as hydrogenation catalysts 134
A computational approach to study Aqueous Phase Reforming 129
Hydrogen Arrangements on Defective Quasi-Molecular BN Fragments 129
Computational studies on systems derived from barium zirconate perovskite structure 128
Studi computazionali di proprietà catalitiche di zeoliti acide 127
Conformational analysis and DFT calculations of 8 alpha-hydroxy-germacradiene-6,12-olide derivatives 127
Growth of Palladium Clusters on a Boron Nitride Nanotube Support 126
Structure Sensitivity of 2‐Methyl--butyn-2-ol Hydrogenation on Pd: Computational and Experimental Modeling 125
DFT study on zeolites’ intrinsic Brønsted acidity: The case of BEA 122
Palladium clusters on BNNT as catalysts for biomass conversion 122
Alternative Algebraic Perspectives on CO/H2 PROX over MnO2 Composite Catalysts 121
DFT Study of Pt Particle Growth inside β-Zeolite Cages 121
Relativistic coupled cluster calculations ofhe electronic structure of KrH+, XeH+ and RnH+ 121
DFT insights into competing mechanisms of guaiacol hydrodeoxygenation on a platinum cluster 120
DFT study of but-2-ene isomerization on H-ZSM-5 modified catalyst 116
Theoretical study of a palladium cluster on carbonaceous supports 114
Theoretical modeling of IRMOF-3: a computational approach on a heterogeneous Basic catalyst 113
Decomposition of guaiacol on a subnanometric platinum cluster: a DFT investigation followed by microkinetic analysis 109
DFT and kinetic evidences of the preferential CO oxidation pattern of manganese dioxide catalysts in hydrogen stream (PROX) 109
Grid time dependent Monte Carlo simulations of nano catalytic systems 106
Propan-2-ol dehydration on acidic zeolite fragments: a DFT study 106
Chimica Inorganica 105
Computational study of dimethyl- and trimethyl-tin(IV) complexes of porphyrin derivatives 105
Selective hydrogenation of 2-methyl-butyn-2-ol on Pd catalysts 104
Hydro-dimerization of PtCl2(C2H4)2 : model reaction to capture details on catalytic mechanisms 103
Computation of adsorbate IR spectrum by means of ab initio molecular dynamics 103
Totale 17.215
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Categoria #
all - tutte 62.282
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 62.282
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021458 0 0 0 0 0 0 0 0 0 196 112 150
2021/20221.303 78 259 20 64 50 43 62 53 142 133 123 276
2022/20231.578 164 274 37 137 172 242 121 115 178 31 67 40
2023/2024794 37 127 34 125 65 155 52 53 7 24 15 100
2024/20252.023 60 100 134 201 77 62 155 154 137 212 278 453
2025/20266.755 568 256 386 503 688 1.031 957 823 485 1.058 0 0
Totale 19.308