CINECA IRIS Institutional Research Information System

FLORIS, FRANCA MARIA
 Distribuzione geografica
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Continente #
NA - Nord America 4.089
AS - Asia 1.511
EU - Europa 1.200
SA - Sud America 267
AF - Africa 54
OC - Oceania 5
Totale 7.126
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Nazione #
US - Stati Uniti d'America 3.996
CN - Cina 454
SG - Singapore 437
IT - Italia 415
HK - Hong Kong 256
BR - Brasile 220
DE - Germania 174
SE - Svezia 171
BG - Bulgaria 118
TR - Turchia 102
CA - Canada 70
GB - Regno Unito 70
VN - Vietnam 65
RU - Federazione Russa 60
FI - Finlandia 58
UA - Ucraina 49
IN - India 45
KR - Corea 43
BD - Bangladesh 26
FR - Francia 25
JP - Giappone 22
SN - Senegal 17
AR - Argentina 16
BE - Belgio 16
PK - Pakistan 13
CH - Svizzera 12
ZA - Sudafrica 11
ES - Italia 10
MX - Messico 9
IQ - Iraq 7
SA - Arabia Saudita 7
CO - Colombia 6
CZ - Repubblica Ceca 6
KE - Kenya 6
AU - Australia 5
CL - Cile 5
DZ - Algeria 5
ID - Indonesia 5
UY - Uruguay 5
VE - Venezuela 5
AE - Emirati Arabi Uniti 4
AT - Austria 4
EC - Ecuador 4
JO - Giordania 4
MA - Marocco 4
BB - Barbados 3
IE - Irlanda 3
KZ - Kazakistan 3
PL - Polonia 3
AZ - Azerbaigian 2
BJ - Benin 2
BO - Bolivia 2
CR - Costa Rica 2
EG - Egitto 2
JM - Giamaica 2
LB - Libano 2
PR - Porto Rico 2
PY - Paraguay 2
SY - Repubblica araba siriana 2
TH - Thailandia 2
TN - Tunisia 2
UZ - Uzbekistan 2
BS - Bahamas 1
DK - Danimarca 1
ET - Etiopia 1
GA - Gabon 1
GE - Georgia 1
GH - Ghana 1
GY - Guiana 1
HU - Ungheria 1
KW - Kuwait 1
KY - Cayman, isole 1
LU - Lussemburgo 1
MD - Moldavia 1
MG - Madagascar 1
MV - Maldive 1
MY - Malesia 1
NG - Nigeria 1
NL - Olanda 1
NP - Nepal 1
OM - Oman 1
PA - Panama 1
PE - Perù 1
PH - Filippine 1
PS - Palestinian Territory 1
RS - Serbia 1
SV - El Salvador 1
TT - Trinidad e Tobago 1
Totale 7.126
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Città #
Woodbridge 544
Fairfield 420
Ashburn 333
Ann Arbor 302
Houston 284
Santa Clara 269
Singapore 252
Hong Kong 250
Chandler 223
Seattle 201
Serra 158
Wilmington 158
Cambridge 146
Dallas 120
Sofia 118
Beijing 111
Shanghai 89
Izmir 70
Hefei 68
Los Angeles 64
New York 64
Jacksonville 62
Princeton 58
Ottawa 57
Boardman 55
Milan 50
Lawrence 49
Seoul 43
Medford 42
Livorno 39
Bremen 37
San Diego 33
Dearborn 32
Nanjing 31
Des Moines 30
Council Bluffs 28
Istanbul 23
Munich 22
Buffalo 21
Marseille 20
São Paulo 18
Columbus 17
Dakar 17
Dong Ket 17
San Jose 17
Boulder 16
Pisa 16
Pune 16
Nanchang 15
Redondo Beach 15
Brussels 14
Tokyo 14
Rio de Janeiro 12
The Dalles 12
Bern 10
Dhaka 10
London 9
Norwalk 9
Potsdam 9
San Francisco 9
Turku 9
Ogden 8
Pescia 8
Phoenix 8
Redwood City 8
Tianjin 8
Changsha 7
Hebei 7
Helsinki 7
Jüchen 7
Kunming 7
Falls Church 6
Florence 6
Shenyang 6
Brasília 5
Ho Chi Minh City 5
Lanzhou 5
Leawood 5
Montevideo 5
Nairobi 5
New Delhi 5
Amman 4
Brooklyn 4
Curitiba 4
Enterprise 4
Hangzhou 4
Jiaxing 4
Johannesburg 4
Manchester 4
Orange 4
Rome 4
Salvador 4
Toronto 4
Vienna 4
Ankara 3
Anápolis 3
Auburn Hills 3
Barbacena 3
Bridgetown 3
Campo Grande 3
Totale 5.455
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Nome #
Excess densities and equimolar surfaces for spherical cavities in water 233
Dispersion and repulsion contributions to the solvation energy: refinements to a simple computational model in the continuum approximation 230
Theoretical determination of the Gibbs energy of solution and transfer between immiscible solvents, with comments on the dynamics of phase transfer 222
ABINITIO EFFECTIVE PAIR POTENTIALS FOR SIMULATIONS OF THE LIQUID-STATE, BASED ON THE POLARIZABLE CONTINUUM MODEL OF THE SOLVENT 219
A computational ab initio model for the evaluation of thermodynamic functions for solvent transfer processes 210
MCSCF study of the S(N)2 Menshutkin reaction in aqueous solution within the polarizable continuum model 192
Evaluation of the dispersion contribution to the solvation energy. Computational model in the continuum approximation 191
Modeling the Cavitation Free Energy 191
Coupling Quantum Monte Carlo to a Nonlinear Polarizable Continuum Model for Spherical Solutes 178
Study of dispersion forces with Quantum Monte Carlo: toward a continuum model for solvation 175
Nonideal Effects on the Excess Volume from Small to Large Cavities in TIP4P water 172
Introducing QMC/MMpol: Quantum Monte Carlo in Polarizable Force Fields for Excited States 172
A MCSCF study of the SN2 Menshutkin reaction in Aqueous Solution within the Polarizable Continuum Model 164
Shannon Entropy in Atoms: A Test for the Assessment of Density Functionals in Kohn-Sham Theory 161
Effect of increasing pressure on excess volumes for cavities in TIP4P water 160
Electronic excitations in a dielectric continuum solvent with quantum Monte Carlo: Acrolein in water 159
Localized Polycentric Orbital Basis Set for Quantum Monte Carlo Calculations Derived from the Decomposition of Kohn-Sham Optimized Orbitals 158
Shannon entropy and correlation energy for electrons in atoms 153
Excess Volumes from the Pressure Derivative of the Excess Chemical Potential: Testing Simple Models for Cavity Formation in Water 152
Volume Errors and equimolar surfaces 150
Interaction potentials for small molecules 147
Ab initio effective pair potentials for simulations of the liquid state, based on the polarizable continuum model of the solvent 145
Solubility of water in liquid hydrocarbons: a bridge between the polarizable continuum model and the mobile order theory 142
Theoretical Modeling of the Symmetric (C2v) Electrophilic Attachment of Chlorine to Ethylene in Aqueous Solution 139
The formation of a cavity in water: Changes of water distribution and prediction of the excess chemical potential of a hard-sphere solute under increasing pressure 138
Extending the polarizable continuum model to effective ab initio pair potentials in multicomponent solutions: A test on calcium-water and calcium-ammonia potentials 137
Preferential solvation of Ca(2+) in aqueous solutions containing ammonia: A Molecular dynamics study 137
A study of aqueous solutions of lanthanide ions by molecular dynamics simulation with ab initio effective pair potentials 136
MCSCF Study of Chemical Reactions in Solution within the Polarizable Continuum Model and VB Analysis of the Reaction Mechanism 131
FREE-ENERGIES AND STRUCTURES OF HYDRATED CATIONS, BASED ON EFFECTIVE PAIR POTENTIALS 131
Hydration shell structure of the calcium ion from simulations with ab initio effective pair potentials. 127
Theoretical study of the proton transfer between water and [FeH(C0)4]- in aqueous solution and relevance to the water gas shift reaction catalyzed by iron penta-carbonyl in the condensed phase 126
Quantum Monte Carlo formulation of volume polarization in dielectric continuum theory 124
On the effect of solute-solvent Pauli repulsion on n → π* transition for acrolein in water solution 124
Free energy and entropy for inserting cavities in water: Comparison of Monte Carlo simulation and scaled particle theory results 123
Solvent Effects on Excited-State Structures: A Quantum Monte Carlo and Density Functional Study 122
Critical conditions (zero ionization potential) in model N_2-like molecular ions 115
Erratum:Note: Volume errors and equimolar surfaces? [J. Chem. Phys. 136, 116102 (2012)] 114
Degenerate lithium-hydrogen exchange reactions: an alternative mechanism for metalation of CH4 in gas phase and in THF solution 112
Evaluation of dispersion-repulsion contributions to the solvation energy. Calibration of the uniform approximation with the aiad of RISM calculations 110
Method to Compute the Solute-Solvent Dispersion Contribution to the Electronic Excitation Energy in Solution 102
A study of aqueous solutions of lanthanide ions by molecular dynamics simulation with effective pair potentials 100
Calculation of potential energy surfaces with quantum Monte Carlo as a useful tool for the design of green chemical syntheses: The HOCO radical test case. 93
Poster P15: Excited states of molecular solutes with Quantum Monte Carlo: vertical transition and geometry optimization 88
Intermolecular Pauli repulsion: a QMC study of molecules in ground and excited state in free space and in solution 87
Debrecen, DFT15 Poster: Localized polycentric orbital basis set for Quantum Monte Carlo calculations derived from the decomposition of Kohn-Sham optimized orbitals 85
null 84
Tallberg, DFT17 Poster A20: Shannon entropy and correlation energy for electrons in atoms 74
How increasing pressure affects the ion hydration structure and shell properties at ambient temperature 72
Poster 0157: A novel continuum model for the calculation of solute-solvent dispersion contribution to the electronic excitation energy in solution. 65
A density functional and quantum Monte Carlo study of glutamic acid in vacuo and in a dielectric continuum medium 56
Ionic hydration at ambient and higher pressures: Computed chemical potentials from simulations and finite-size effects 48
Hydrophilic Versus Hydrophobic Coupling in the Pressure Dependence of the Chemical Potential of Alkali Metal and Halide Ions in Water 45
Totale 7.221
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Categoria #
all - tutte 19.772
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 19.772
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021344 0 0 0 0 0 0 52 53 71 79 27 62
2021/2022570 25 17 38 35 76 72 30 33 18 28 27 171
2022/2023661 75 74 27 120 63 94 13 53 108 1 25 8
2023/2024337 37 26 32 13 52 74 4 16 6 19 14 44
2024/20251.682 10 69 10 69 205 185 172 51 128 186 163 434
2025/2026750 55 211 177 49 104 150 4 0 0 0 0 0
Totale 7.221