SFERA Archivio dei prodotti della Ricerca dell'Università di Ferrara

MELONI, Simone
 Distribuzione geografica
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Continente #
NA - Nord America 3.666
AS - Asia 458
EU - Europa 406
SA - Sud America 9
OC - Oceania 3
AF - Africa 2
Continente sconosciuto - Info sul continente non disponibili 1
Totale 4.545
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Nazione #
US - Stati Uniti d'America 3.662
SG - Singapore 233
IT - Italia 120
CN - Cina 105
GB - Regno Unito 65
FI - Finlandia 64
ID - Indonesia 55
DE - Germania 37
PL - Polonia 28
UA - Ucraina 25
ES - Italia 13
KR - Corea 12
CH - Svizzera 11
SA - Arabia Saudita 10
FR - Francia 9
RU - Federazione Russa 8
TW - Taiwan 8
HK - Hong Kong 6
IR - Iran 6
NL - Olanda 6
RO - Romania 6
SE - Svezia 6
BR - Brasile 5
JP - Giappone 5
BE - Belgio 4
IN - India 4
VN - Vietnam 4
AU - Australia 3
CA - Canada 3
DK - Danimarca 2
EC - Ecuador 2
QA - Qatar 2
TR - Turchia 2
AN - Antille olandesi 1
CO - Colombia 1
EG - Egitto 1
EU - Europa 1
GR - Grecia 1
IE - Irlanda 1
IL - Israele 1
IQ - Iraq 1
MO - Macao, regione amministrativa speciale della Cina 1
MY - Malesia 1
PE - Perù 1
PK - Pakistan 1
SC - Seychelles 1
TH - Thailandia 1
Totale 4.545
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Città #
Fairfield 826
Woodbridge 367
Santa Clara 352
Seattle 352
Ashburn 344
Houston 292
Cambridge 282
Wilmington 277
Singapore 176
Ann Arbor 111
Princeton 96
San Diego 58
Jakarta 54
Ferrara 44
Beijing 38
Helsinki 38
Lappeenranta 25
Warsaw 25
Shanghai 24
London 20
Norwalk 18
Redwood City 17
Falls Church 14
Rome 10
Bologna 9
Chicago 7
Taipei 7
Hounslow 6
Lausanne 6
Zhengzhou 6
Atlanta 5
Mountain View 5
New Bedfont 5
Riyadh 5
Berlin 4
Boardman 4
Dong Ket 4
Harbin 4
Redmond 4
Castellón 3
Central 3
Chengdu 3
Donostia / San Sebastian 3
Dresden 3
Eindhoven 3
Erlangen 3
Forlì 3
Frankfurt am Main 3
Los Angeles 3
Moscow 3
New Delhi 3
Oxford 3
Suzhou 3
Tolentino 3
Barcelona 2
Changchun 2
Chiswick 2
Cluj-napoca 2
Daejeon 2
Doha 2
Edmonton 2
Fisciano 2
Folsom 2
Guangzhou 2
Halle 2
Hangzhou 2
Katowice 2
Mecca 2
Milan 2
Milton Keynes 2
Munich 2
Parma 2
Prescot 2
Quito 2
Stockholm 2
Trieste 2
Vercelli 2
Würzburg 2
Xi'an 2
Zaragoza 2
Anzola Dell'emilia 1
Aprilia 1
Asaka 1
Athens 1
Bangkok 1
Bayreuth 1
Bitam 1
Bogotá 1
Bremen 1
Castellana Grotte 1
Chambéry 1
Como 1
Council Bluffs 1
Delhi 1
Dubendorf 1
Dublin 1
Enschede 1
Ferrara di Monte Baldo 1
Folkestone 1
Gainesville 1
Totale 4.058
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Nome #
How far does the defect tolerance of lead-halide perovskites range? The example of Bi impurities introducing efficient recombination centers 218
Halide Versus Nonhalide Salts: The Effects of Guanidinium Salts on the Structural, Morphological, and Photovoltaic Performances of Perovskite Solar Cells 114
Origin of unusual bandgap shift and dual emission in organic-inorganic lead halide perovskites 110
Metastable Wetting on Superhydrophobic Surfaces: Continuum and Atomistic Views of the Cassie-Baxter-Wenzel Transition 82
Cassie-Baxter and Wenzel States on a Nanostructured Surface: Phase Diagram, Metastabilities, and Transition Mechanism by Atomistic Free Energy Calculations 79
Calculations of free energy barriers for local mechanisms of hydrogen diffusion in alanates 77
Efficient particle labeling in atomistic simulations 71
MiMiC: A Novel Framework for Multiscale Modeling in Computational Chemistry 71
Massively parallel molecular dynamics simulation of formation of clathrate-hydrate precursors at planar water-methane interfaces: Insights into heterogeneous nucleation 70
Hydrodynamics from statistical mechanics: combined dynamical-NEMD and conditional sampling to relax an interface between two immiscible liquids 70
An observable for vacancy characterization and diffusion in crystals 69
Quasi-one-dimensional K-O chain in PTCDA thin films: Evidence from first-principles calculations 69
Self-recovery superhydrophobic surfaces: modular design 69
Relaxation of a steep density gradient in a simple fluid: Comparison between atomistic and continuum modeling 69
Chemistry between magnesium and multiple molecules in tris(8-hydroxyquinoline) aluminum films 69
Combining Rare Events Techniques: Phase Change in Si Nanoparticles 69
Wetting and recovery of nano-patterned surfaces beyond the classical picture 69
Clathrate structure-type recognition: Application to hydrate nucleation and crystallisation 68
Boron ripening in amorphous silicon by large scale molecular dynamics simulations 68
Molecular and solid-state (8-hydroxy-quinoline)aluminum interaction with magnesium: A first-principles study 68
Ionic polarization-induced current-voltage hysteresis in CH3NH3PbX3 perovskite solar cells 67
Temperature accelerated Monte Carlo (TAMC): a method for sampling the free energy surface of non-analytical collective variables 66
Methane Clathrate Hydrate Nucleation Mechanism by Advanced Molecular Simulations 66
Valence and conduction band tuning in halide perovskites for solar cell applications 66
A novel implicit Newton-Raphson geometry optimization method for density functional theory calculations 66
The influence of silicon nanoclusters on the optical properties of a-SiNx samples: A theoretical study 65
Structural and electronic properties of metal-doped organic semiconductors 65
Entropic stabilization of mixed A-cation ABX3 metal halide perovskites for high performance perovskite solar cells 65
Ab initio simulation of carbon clustering on an Ni(111) surface: A model of the poisoning of nickel-based catalysts 64
Probing the Structures of Hydrated Nafion in Different Morphologies Using Temperature-Accelerated Molecular Dynamics Simulations 64
Hydrophilicity and Water Contact Angle on Methylammonium Lead Iodide 64
Equilibrium and Rate Constants, and Reaction Mechanism of the HF Dissociation in the HF(H2O)(7) Cluster by ab Initio Rare Event Simulations 63
Geometry as a Catalyst: How Vapor Cavities Nucleate from Defects 63
SO2Cl2, SOCl2: Energy dispersive X-ray diffraction, ab initio and molecular dynamics calculation 63
Mechanisms of self-diffusion in stoichiometric and substoichiometric amorphous silicon dioxide 63
Interface structure and defects of silicon nanocrystals embedded into a-SiO(2) 61
Energy-dispersive X-ray diffraction on thin films and its application to superconducting samples 61
Computational Materials Science application programming interface (CMSapi): a tool for developing applications for atomistic simulations 61
Modified single sweep method for reconstructing free-energy landscapes 60
Theory and methods for rare events 60
Extreme Scalability of DFT-Based QM/MM MD Simulations Using MiMiC 60
Collective molecular mechanisms in the CH3NH3PbI3 dissolution by liquid water 59
Hierarchical macro-nanoporous metals for leakage-freeygrosu@cicenergigune.com high-thermal conductivity shape-stabilized phase change materials 56
Pressure control in interfacial systems: Atomistic simulations of vapor nucleation 56
Dual effect of humidity on cesium lead bromide: Enhancement and degradation of perovskite films 51
Mechanism of the Cassie-Wenzel transition via the atomistic and continuum string methods 51
Pore Morphology Determines Spontaneous Liquid Extrusion from Nanopores 51
Calculations of free energy barriers for local mechanisms of hydrogen diffusion in alanates 50
Computational characterization of the dependence of halide perovskite effective masses on chemical composition and structure 49
The monoclinic l2 structure of bassanite, calcium sulphate hemihydrate (CaSO4.0.5H2O) 48
Extended Intermolecular Interactions Governing Photocurrent-Voltage Relations in Ternary Organic Solar Cells 47
Activated wetting of nanostructured surfaces: reaction coordinates, finite size effects, and simulation pitfalls 47
Free energies for rare events: temperature accelerated MD and MC 46
Atomistic structure of amorphous silicon nitride from classical molecular dynamics simulations 46
Viscosity at the nanoscale: confined liquid dynamics and thermal effects in self-recovering nanobumpers 45
Collapse of superhydrophobicity on nanopillared surfaces 45
Order-disorder phase change in embedded Si nanoparticles 42
Mechanisms and Nucleation Rate of Methane Hydrate by Dynamical Nonequilibrium Molecular Dynamics 41
Low-energy electron scattering from the water molecule: Angular distributions and rotational excitation 40
Nucleation of silicon nanoparticles in amorphous silicon dioxide matrices 40
Unraveling the Salvinia Paradox: Design Principles for Submerged Superhydrophobicity 39
Dissociative versus molecular adsorption of phenol on Si (100) 2×1: A first-principles calculation 38
Intrusion and extrusion of a liquid on nanostructured surfaces 37
Focus Article: Theoretical aspects of vapor/gas nucleation at structured surfaces 37
MiMiC: Multiscale Modeling in Computational Chemistry 30
Molecular Basis of CLC Antiporter Inhibition by Fluoride 30
The Role of Grain Boundaries on Ionic Defect Migration in Metal Halide Perovskites 28
Liquid intrusion in and extrusion from non-wettable nanopores for technological applications 26
Surface patterning for wetting and liquid flow control 25
Giant Negative Compressibility by Liquid Intrusion into Superhydrophobic Flexible Nanoporous Frameworks 23
Crystal-Size-Induced Band Gap Tuning in Perovskite Films 23
Understanding the formation of gas bubbles at liquid–liquid interfaces 21
Accuracy of Molecular Simulation-Based Predictions of koffValues: A Metadynamics Study 21
PINPOINT - Perovskite-Inspired materials-based iNdoor PhotovOltaics for powering the Internet of Things. 19
Atomistic origins of the limited phase stability of Cs+-rich FAxCs(1-x)PbI3 mixtures 18
The interplay among gas, liquid and solid interactions determines the stability of surface nanobubbles 18
ADRENALINE - hAliDe peRovskites sEqueNtiAL deposItioN mEchanism (by ab initio 18
Hydrophobicity of molecular-scale textured surfaces: The case of zeolitic imidazolate frameworks, an atomistic perspective 17
Double Life of Methanol: Experimental Studies and Nonequilibrium Molecular-Dynamics Simulation of Methanol Effects on Methane-Hydrate Nucleation 17
Impact of Donor Halogenation on Reorganization Energies and Voltage Losses in Bulk-heterojunction Solar Cells 16
Optimization of the wetting-drying characteristics of hydrophobic metal organic frameworks via crystallite size: The role of hydrogen bonding between intruded and bulk liquid 16
Mild-Temperature Supercritical Water Confined in Hydrophobic Metal–Organic Frameworks 16
Early Stage of the Dehydrogenation of NaAlH4 by Ab Initio Rare Event Simulations 16
Editorial 16
The Salvinia Paradox: how the hydrophilic patches help keeping the plant’s surface dry 16
Defect Dynamics in MAPbI3 Polycrystalline Films: The Trapping Effect of Grain Boundaries 16
Wavefunction-Based Electrostatic-Embedding QM/MM Using CFOUR through MiMiC 15
Intrusion and extrusion of liquids in highly confining media: bridging fundamental research to applications 15
Simultaneous transformation of ambient heat and undesired vibrations into electricity via nanotriboelectrification during non-wetting liquid intrusion-extrusion into-from nanopores 13
NAUTILUS - ENergy scAvenging by liqUid InTrusion in Lyophobic poroUs Systems 13
MOF to prevent degradation of hybrid halide perovskites 13
Materiali porosi per l’energy storage, energy scavenging e altre applicazioni technologiche 13
Subnanometer Topological Tuning of the Liquid Intrusion/Extrusion Characteristics of Hydrophobic Micropores 13
Kinetics and energetics of metal halide perovskite conversion reactions at the nanoscale 13
Photoprotection in metal halide perovskites by ionic defect formation 11
Effect of the Topology on Wetting and Drying of Hydrophobic Porous Materials 10
Classical nucleation of vapor between hydrophobic plates 10
The impact of secondary channels on the wetting properties of interconnected hydrophobic nanopores 10
Exploring the Heat of Water Intrusion into a Metal–Organic Framework by Experiment and Simulation 10
Mechanism of Water Intrusion into Flexible ZIF-8: Liquid Is Not Vapor 9
Totale 4.657
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Categoria #
all - tutte 38.855
article - articoli 0
book - libri 0
conference - conferenze 0
curatela - curatele 0
other - altro 0
patent - brevetti 0
selected - selezionate 0
volume - volumi 839
Totale 39.694
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/20201.110 0 0 0 0 0 225 272 211 222 59 80 41
2020/2021932 42 79 75 83 77 95 54 140 35 161 44 47
2021/2022627 68 64 24 18 34 51 42 35 23 76 33 159
2022/2023171 90 6 6 5 7 38 3 6 6 0 3 1
2023/2024250 6 0 12 4 8 6 0 30 6 14 32 132
2024/2025711 59 33 196 25 284 114 0 0 0 0 0 0
Totale 4.765