CINECA IRIS Institutional Research Information System

CACELLI, IVO
 Distribuzione geografica
Salva come PNG Salva come JPEG
Continente #
NA - Nord America 11.994
AS - Asia 4.689
EU - Europa 3.821
SA - Sud America 663
AF - Africa 123
OC - Oceania 12
Continente sconosciuto - Info sul continente non disponibili 7
Totale 21.309
Salva come PNG Salva come JPEG
Nazione #
US - Stati Uniti d'America 11.662
CN - Cina 1.535
SG - Singapore 1.357
SE - Svezia 1.081
IT - Italia 1.014
HK - Hong Kong 812
BR - Brasile 569
BG - Bulgaria 344
GB - Regno Unito 298
CA - Canada 266
UA - Ucraina 264
KR - Corea 262
DE - Germania 212
TR - Turchia 191
VN - Vietnam 176
FI - Finlandia 157
RU - Federazione Russa 143
CH - Svizzera 121
IN - India 85
FR - Francia 60
JP - Giappone 55
BD - Bangladesh 41
AR - Argentina 31
ZA - Sudafrica 29
MX - Messico 27
SN - Senegal 26
BE - Belgio 25
IQ - Iraq 25
ES - Italia 23
SA - Arabia Saudita 20
UZ - Uzbekistan 18
ID - Indonesia 17
PK - Pakistan 17
MA - Marocco 16
VE - Venezuela 16
EC - Ecuador 15
PL - Polonia 15
CO - Colombia 14
JO - Giordania 10
KE - Kenya 10
NL - Olanda 10
CI - Costa d'Avorio 9
DZ - Algeria 8
AU - Australia 7
IE - Irlanda 7
AT - Austria 6
EG - Egitto 6
EU - Europa 6
JM - Giamaica 6
MY - Malesia 6
OM - Oman 6
RO - Romania 6
UY - Uruguay 6
AE - Emirati Arabi Uniti 5
BB - Barbados 5
CZ - Repubblica Ceca 5
IL - Israele 5
PS - Palestinian Territory 5
TN - Tunisia 5
TT - Trinidad e Tobago 5
TW - Taiwan 5
BH - Bahrain 4
BS - Bahamas 4
DO - Repubblica Dominicana 4
GR - Grecia 4
GT - Guatemala 4
LT - Lituania 4
NO - Norvegia 4
NZ - Nuova Zelanda 4
AL - Albania 3
AM - Armenia 3
AO - Angola 3
AZ - Azerbaigian 3
BJ - Benin 3
CL - Cile 3
DK - Danimarca 3
KW - Kuwait 3
KZ - Kazakistan 3
NI - Nicaragua 3
NP - Nepal 3
PE - Perù 3
PH - Filippine 3
BY - Bielorussia 2
CR - Costa Rica 2
HN - Honduras 2
HR - Croazia 2
KH - Cambogia 2
LB - Libano 2
LY - Libia 2
NG - Nigeria 2
PR - Porto Rico 2
PT - Portogallo 2
PY - Paraguay 2
RS - Serbia 2
SR - Suriname 2
TH - Thailandia 2
A2 - ???statistics.table.value.countryCode.A2??? 1
BA - Bosnia-Erzegovina 1
BO - Bolivia 1
BZ - Belize 1
Totale 21.291
Salva come PNG Salva come JPEG
Città #
Woodbridge 1.636
Ann Arbor 1.374
Fairfield 1.056
Houston 1.039
Ashburn 941
Hong Kong 810
Singapore 753
Chandler 714
Santa Clara 532
Seattle 415
Milan 379
Jacksonville 368
Dallas 363
Cambridge 358
Sofia 344
Wilmington 343
Hefei 334
Beijing 307
Shanghai 269
Seoul 260
Ottawa 236
New York 230
Serra 196
Princeton 143
Boardman 137
Lawrence 132
Los Angeles 132
Medford 123
Bern 118
Izmir 118
Nanjing 118
London 104
Des Moines 98
Council Bluffs 76
Dearborn 72
Jüchen 71
San Diego 71
Columbus 69
The Dalles 59
Istanbul 55
Buffalo 52
Dong Ket 50
Nanchang 49
Redondo Beach 44
Tokyo 43
São Paulo 40
Chicago 38
Boulder 34
Kunming 30
Marseille 29
San Jose 27
Dakar 26
Shenyang 26
Brussels 25
Munich 24
Changsha 23
Ho Chi Minh City 21
Indiana 21
Johannesburg 21
Falls Church 20
Rome 20
Belo Horizonte 18
Rio de Janeiro 18
Tianjin 18
Tashkent 17
Hebei 16
Fuzhou 15
Hanoi 15
Jiaxing 14
Norwalk 14
Ogden 14
Quanzhou 14
Redwood City 14
Brooklyn 13
Orange 13
Verona 13
Jakarta 12
Brasília 11
Curitiba 11
Warsaw 11
Amman 10
Dhaka 10
Florence 10
Hangzhou 10
Paris 10
Phoenix 10
Porto Alegre 10
Washington 10
Abidjan 9
Auburn Hills 9
Frankfurt am Main 9
Guangzhou 9
Montreal 9
Pune 9
Shenzhen 9
Bremen 8
Nairobi 8
Salvador 8
Stockholm 8
Hyderabad 7
Totale 16.069
Salva come PNG Salva come JPEG
Nome #
Eumelanin broadband absorption develops from aggregation-modulated chromophore interactions under structural and redox control 232
Transition probability and photoionization cross section calculations for CH4 and HF by one-center expansion and Stieltjes technique 226
H2S photoabsorption and photoionization cross sections by Stieltjes imaging 223
Photoionization and photoabsorption cross section calculations in molecules : CH4, NH3, H2O and HF 219
Molecular photoionization cross section and asymmetry parameters by L2 basis function calculations: H2O 218
Solvent effect on the optical properties of [(NH3)(5)Ru-pyrazine](+m) (m=2,3) complexes by ab initio calculations 213
On the calculation of two-photon ionization cross section 209
Accurate yet feasible post-Hartree-Fock computation of magnetic interactions in large biradicals through a combined variational/perturbative approach: setup and validation 209
Continuum by L2 methods : molecular photoionization cross section 207
Theoretical Study of Photochemical Isomerization of Colchicine 207
Independent Electron Models: Hartree-Fock for Many-Electron Atoms 206
Two photon bound bound electronic transition calculations in molecules: results for NH3 and HF 205
O 1s -> sigma* resonance in O-2: Inadequacy of only two exchange-split components 204
BALOO: A fast and versatile code for accurate multireference variational/perturbative calculations 203
Electronic properties by Green's Function calculations. Renormalized optical potential results: Ne, Ar, HF, H2O, NH3 202
Modified virtual orbitals for CI calculations of energy splitting in organic diradicals 200
Photoionization cross section calculations of HCl by the Stieltjes technique. Effect of the channel coupling 199
Sensors for DNA Detection: Theoretical Investigation of the Conformational Properties of Immobilized Single-Strand DNA 199
Angular distribution of photoelectrons from two-photon ionization in molecules : H2O 198
Differential photoionization cross section calculations for HI using the random-phase approximation with L(2) basis functions 198
Accuracy of quantum mechanically derived force-fields parameterized from dispersion-corrected DFT data: the benzene dimer as a prototype for aromatic interactions 198
Theoretical study of the dissociation of the HF+ and DF+ ions in the B 2Sigma+ state by classical trajectories 195
Photoionization cross section calculations for H2O and NH3 by one center expansion and Stieltjes technique 194
Calculation of the differential photoionization cross section of HF 193
Two-photon ionization cross section calculation for H2O 192
Two-photon transition probability calculations: electronic transitions in methane 191
Analysis of Electron Transfer in Substituted Biphenylmethane 191
Theoretical study of the dissociation of HF+ in the B 2Sigma+ state by quantum mechanical methods 189
Calculation of the photoabsorption of HF in the Vacuum UV 189
Atomistic simulation of a nematogen using a force field derived from quantum chemical calculations 189
Two-photon ionization calculations. Results for H2O 188
Photoionization cross section calculations using Dyson amplitudes: results for Ne 185
Accurate interaction energies by spin component scaled Möller-Plesset second order perturbation theory calculations with optimized basis sets (SCS-MP2mod): Development and application to aromatic heterocycles 184
GAUSSIAN-TYPE ORBITALS BASIS-SETS FOR THE CALCULATION OF CONTINUUM PROPERTIES IN MOLECULES - THE DIFFERENTIAL PHOTOIONIZATION CROSS-SECTION OF LI-2 AND LIH 183
Predicting light absorption properties of anthocyanidins in solution: a multi-level computational approach 182
MOLECULAR DIFFERENTIAL PHOTOIONIZATION CROSS-SECTION CALCULATIONS WITH L2 BASIS FUNCTIONS IN THE RANDOM-PHASE APPROXIMATION - RESULTS FOR H2O 181
THE CALCULATION OF PHOTOIONIZATION CROSS-SECTIONS OF SIMPLE POLYATOMIC-MOLECULES BY L2 METHODS 180
Atomistic simulation of a nematogen using a force field derived from quantum chemical calculations 180
Solvent effect on the optical properties of (NH3)5RU-pyrazine+M (M=2,3) complexes by ab initio calculations. 179
An automated approach for the parameterization of accurate intermolecular force-fields. Pyridine as a case study 178
Performance of polynomial Gaussian functions in describing the molecular electronic continuum 177
Calculation of the differential photoionization cross section of formaldehyde 176
BASIS SET AND GAUGE DEPENDENCE OF ABINITIO RADIATIVE LIFETIMES FOR THE A 2-SIGMA+ STATE OF THE HF+ MOLECULE 175
Parameterization and validation of intramolecular force fields derived from DFT calculations 175
An Integrated Protocol for the Accurate Calculation of Magnetic Interactions in Organic Magnets 175
Systematic and Automated Development of Quantum Mechanically Derived Force Fields: The Challenging Case of Halogenated Hydrocarbons 175
Intermolecular interactions in eumelanins: A computational bottom-up approach. I. small building blocks 175
GAUSSIAN-TYPE ORBITAL BASIS-SETS FOR THE CALCULATION OF CONTINUUM PROPERTIES IN MOLECULES - THE PHOTOIONIZATION CROSS-SECTION OF H-2 174
Quantitative prediction and interpretation of spin energy gaps in polyradicals: the virtual magnetic balance 174
Theoretical study of the absorption spectrum of [(NH3)(5)Ru-(4,4 '-bipyridine)](2+) in solution 173
Banana-shaped molecules peculiarly oriented in a magnetic field: 2H NMR spectroscopy and Quantum Mechanical calculations 172
The Hartree-Fock Method 172
Computer Simulation of Solid and Liquid Benzene with an Atomistic Interaction Potential Derived from ab Initio Calculations 171
Complementary and Partially Complementary DNA duplexes tethered to a functionalized substrate: a molecular dynamics approach to biosensing 171
Why Thiocolchicine does not undergo Photochemical Isomerization: a Theoretical Study 170
A two-state computational investigation of the methane C-H and ethane C-C oxidative addition to [CpM(PH$_3$]n+ (M=Co,Rh,Ir; n=0,1) 169
Magnetic coupling in bis-nitronylnitroxide radicals: the role of aromatic bridges 168
Modeling benzene with single-site potentials from ab initio calculations: a step toward hybrid models of complex molecules 167
Electron pairing as a stabilizing factor in open-shell organometallics. The case of 15-electron CpMCl(2)(PH3) (M=Cr and Mo) 166
Parameterization and validation of an accurate force-field for the simulation of alkylamine functionalized Silicon (111) surfaces 165
Magnetic gaps in organic tri-radicals: From a simple model to accurate estimates 165
Intermolecular Force-Fields of large molecules by the Fragmentation Reconstruction Method (FRM): application to a nematic liquid crystal 164
Magnetic interactions in phenyl-bridged nitroxide diradicals: conformational effects by multireference and broken symmetry DFT approaches 164
Perturbative multireference configuration interaction (CI-MRPT2) calculations in a focused dynamical approach: A computational study of solvatochromism in pyrimidine 164
Modeling benzene with single-site potentials from ab initio calculations: A step toward hybrid models of complex molecules 163
Absorption and electroabsorption spectra of [(NH3)5Ru-(4,4'-bipyridine)-Ru(NH3)5]4+ in water by ab initio calculations 162
Gaussian Type Orbitals basis sets for the calculation of continuum properties in molecules: the differential photoionization cross section of acetylene 162
DIFFERENTIAL PHOTOIONIZATION CROSS-SECTION CALCULATIONS FOR H2S USING THE RANDOM-PHASE-APPROXIMATION WITH L(2) BASIS FUNCTIONS 161
Geometry optimization of large and flexible van der Waals dimers: a Fragmentation-Reconstruction Approach 161
Outer shell ionization potentials for Ethane by a many body Green's Function method 161
Line shape study of three-photon ionization through intermediate states of Rb atoms. 160
Integrated computational approaches for spectroscopic studies of molecular systems in the gas phase and in solution: Pyrimidine as a test case 160
Stability of the nematic phase of 4-n-pentyl-4 '-cyanobiphenyl studied by computer simulation using a hybrid model 160
Theoretical prediction of the Abraham hydrogen bond acidity and basicity factors from a Reaction Field method 159
Organic Functionalization and Optimal Coverage of a Silicon (111) Surface in Solvent: a Computational Study 159
Structure-properties relationships in triplet ground state organic diradicals. A computational study 159
Computer simulation of p-phenyls with interaction potentials from ab-initio calculations 158
Liquid crystal properties of the n-alkyl-cyanobiphenyl series from atomistic simulations with Ab initio derived force fields 158
Conformational Effects on the Magnetic Properties of an Organic Diradical: A Computational Study 158
Theoretical study of the 15- and 17-electron structures of Cyclopentadienyl-Cromium(III) and of Cyclopentadienyl-Molybdenum(III) complexes. Dicloride and dimethyl compounds 157
I/V characteristics of a molecular switch 157
Gaussian-type-orbital basis sets for the calculation of continuum properties in molecules: The differential photoionization cross section of molecular nitrogen 157
How the odd-even effects on the inter-molecular potentials propagate to the order parameter in the 4-cyano-4 ' n-alkylbiphenyl series 156
Ab initio calculations of the Franck-Condon factors for ionization of HF and DF in the X 2Pi and A 2Sigma+ states 155
DNA hybridization mechanism on silicon nanowires: a molecular dynamics approach 152
Structure and dynamics of mesogens using intermolecular potentials derived from ab initio calculations 152
Computational Screening of Weak Hydrogen Bond Networks: Predicting Stable Structures for Difluoromethane Oligomers 149
CALCULATION OF THE DIFFERENTIAL 2-PHOTON IONIZATION CROSS-SECTION OF H2S 148
[(NH3)5Ru(1,2,4,5-tetrazine)]2+: Synthesis and Experimental and Theoretical Study of its Solvatochromism in the Visible Spectral Region 148
Transport properties of binuclear metal complexes of the VIII group using a simplified NEGF-DFT approach 148
Theoretical study of a molecular junction with asymmetric current/voltage characteristics 147
Computer simulation of mesogens with ab initio interaction potentials - An Application to oligophenyls 146
The role of the multiconfigurational character of nitronyl-nitroxide in the singlet-triplet energy gap of its diradicals 146
STRUCTURE AND PROPERTIES OF FRACTIONAL CHARGE MOLECULAR-SYSTEMS - QUARK MOLECULAR-HYDROGEN IONS 145
Theoretical study of building blocks for molecular switches based on electrically induced conformational changes 144
A General Treatment to Study Molecular Complexes Stabilized by Hydrogen-, Halogen-, and Carbon-Bond Networks: Experiment and Theory of (CH2F2)n⋅⋅⋅(H2O)m 143
Line shape study of two-color three-photon ionization of Rb atoms 142
Oilgomers based on weak hydrogen bond networks: a rotational study of the tetramer of difluoemethane 142
Noncovalent Interactions in the Catechol Dimer 142
Computer simulation of solid and liquid benzene with an atomistic interaction potential obtained from ab-initio calculations 141
Totale 17.533
Salva come PNG Salva come JPEG
Categoria #
all - tutte 56.276
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 56.276
Salva come PNG Salva come JPEG


Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021702 0 0 0 0 0 0 77 94 164 100 86 181
2021/20221.671 82 104 58 172 277 215 48 92 65 76 64 418
2022/20231.911 288 288 118 204 174 297 29 156 260 14 73 10
2023/20241.375 243 151 225 92 201 226 31 39 21 15 14 117
2024/20254.352 10 169 19 222 399 313 326 277 387 494 554 1.182
2025/20262.691 251 712 477 436 379 422 14 0 0 0 0 0
Totale 21.443