ArTS Archivio della ricerca di Trieste

DE VITA, ALESSANDRO
 Distribuzione geografica
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Continente #
NA - Nord America 6710
EU - Europa 3687
AS - Asia 379
Continente sconosciuto - Info sul continente non disponibili 8
SA - Sud America 6
AF - Africa 3
OC - Oceania 2
Totale 10795
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Nazione #
US - Stati Uniti d'America 6702
PL - Polonia 1597
UA - Ucraina 578
SE - Svezia 483
IT - Italia 298
TR - Turchia 192
FI - Finlandia 176
GB - Regno Unito 146
CN - Cina 124
DE - Germania 111
IE - Irlanda 97
BG - Bulgaria 95
FR - Francia 38
BE - Belgio 20
VN - Vietnam 18
JP - Giappone 17
SI - Slovenia 14
IN - India 11
EU - Europa 7
NL - Olanda 7
CA - Canada 6
HK - Hong Kong 5
KR - Corea 5
CH - Svizzera 4
DK - Danimarca 4
AT - Austria 3
GR - Grecia 3
AU - Australia 2
BR - Brasile 2
ES - Italia 2
IR - Iran 2
MA - Marocco 2
MY - Malesia 2
NO - Norvegia 2
PE - Perù 2
RO - Romania 2
A2 - ???statistics.table.value.countryCode.A2??? 1
AE - Emirati Arabi Uniti 1
CL - Cile 1
CU - Cuba 1
CZ - Repubblica Ceca 1
EC - Ecuador 1
HR - Croazia 1
HU - Ungheria 1
IL - Israele 1
LI - Liechtenstein 1
LU - Lussemburgo 1
MX - Messico 1
RU - Federazione Russa 1
SC - Seychelles 1
SK - Slovacchia (Repubblica Slovacca) 1
TW - Taiwan 1
Totale 10795
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Città #
Warsaw 1596
Fairfield 1007
Woodbridge 981
Ann Arbor 756
Houston 641
Jacksonville 500
Wilmington 481
Ashburn 433
Chandler 417
Seattle 394
Cambridge 327
Izmir 184
Princeton 176
Dublin 96
Sofia 94
Trieste 85
Beijing 69
San Diego 47
Düsseldorf 41
London 36
Boardman 34
Falls Church 28
Des Moines 26
Milan 26
Frankfurt am Main 23
Dong Ket 18
Brussels 17
Buffalo 16
Phoenix 15
Verona 15
Chicago 14
Helsinki 12
Dearborn 11
Shanghai 11
Fremont 10
Norwalk 10
Grafing 9
Redwood City 9
Hefei 8
Kocaeli 8
Mestre 8
Tokyo 8
Redmond 7
Scuola 6
Amsterdam 5
Auburn Hills 5
Costa Mesa 5
Hangzhou 5
Los Angeles 5
Nanjing 5
Wuhan 5
Asaka 4
Mumbai 4
Sacile 4
Baotou 3
Berlin 3
Bremen 3
Indiana 3
Lignano Sabbiadoro 3
Múggia 3
Paularo 3
Staple 3
Zhengzhou 3
Atlanta 2
Barletta 2
Changshahsien 2
Innsbruck 2
Latisana 2
Lima 2
Mountain View 2
Oslo 2
Pignone 2
Rabat 2
Richardson 2
Stockholm 2
Storrs Mansfield 2
Søborg 2
Toronto 2
Zurich 2
Adelaide 1
Alexandria 1
Andover 1
Antwerpen 1
Arlington 1
Barking 1
Basel 1
Basingstoke 1
Bath 1
Bielefeld 1
Budapest 1
Cagliari 1
Central 1
Central District 1
Changsha 1
Chengdu 1
Cisterna di Latina 1
Clearwater 1
Copenhagen 1
Dainichicho 1
Dallas 1
Totale 8837
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Nome #
Molecular dynamics with on-the-fly machine learning of quantum-mechanical forces 303
Low Speed Crack Propagation via Kink Formation and Advance on the Silicon (110) Cleavage Plane 296
Building machine learning force fields for nanoclusters 287
Two-dimensional core-shell donor-acceptor assemblies at metal-organic interfaces promoted by surface-mediated charge transfer 276
Re-evaluating how charge transfer modifies the conformation of adsorbed molecules 274
Two-Dimensional Ketone-Driven Metal-Organic Coordination on Cu(111) 272
Bifunctional Behavior of a Porphyrin in Hydrogen-Bonded Donor-Acceptor Molecular Chains on a Gold Surface 258
Modelling defects in Ni-Al with EAM and DFT calculations 251
Imeall: A computational framework for the calculation of the atomistic properties of grain boundaries 246
Site accessibility tailors DNA cleavage by restriction enzymes in DNA confined monolayers 234
Efficient nonparametric n -body force fields from machine learning 222
A microscopic model for surface-induced diamond-to-graphite transitions 194
Bioactivity of TiN-coated titanium implants 186
Trapping of Charged Gold Adatoms by Dimethyl Sulfoxide on a Gold Surface 177
"Learn-on-the-fly'': a hybrid classical and quantum-mechanical molecular dynamics simulation 175
Accuracy of buffered-force QM/MM simulations of silica 166
Atomically Smooth Stress-Corrosion Cleavage of a Hydrogen-Implanted Crystal 145
Ab initio based multiscale modelling for materials science 141
Growth of Platinum Clusters via Addition of Pt(II) Complexes:  A First Principles Investigation 141
Anomalous coarsening driven by reversible charge transfer at metal-organic interfaces 136
Structural and energetic basis for hybridization limits in high-density DNA monolayers 135
Fine-Tuning the Electrostatic Properties of an Alkali-Linked Organic Adlayer on a Metal Substrate 135
Stereoselectivity and electrostatics in charge-transfer Mn- and Cs-TCNQ4 networks on Ag(100) 133
Portrait of the potential barrier at metal-organic nanocontacts 132
A spectroscopic and ab initio study of the formation of graphite and carbon nanotubes from thermal decomposition of silicon carbide 132
Atomic-Level Studies of Molecular Self-Assembly on Metallic Surfaces 129
Supramolecular self-assembly and selective step decoration on the Au(111) surface 126
Self-assembly of decoupled borazines on metal surfaces: The role of the peripheral groups 126
Electronic Structure and Localized States at Carbon Nanotube Tips 125
Macroscopic scattering of cracks initiated at single impurity atoms 122
Dipole formation due to ion exchange processes at the metal-ceramic Al/MgAl2O4 (001) interface 120
A first principles based polarizable O(N) interatomic force field for bulk silica 120
Structural and electronic properties of composite B x C y N z nanotubes and heterojunctions 119
Role of Surface Reconstructions in (111) Silicon Fracture 117
Defect energetics in MgO treated by first-principles methods 117
Validity of linear elasticity in the crack-tip region of ideal brittle solids 115
DFT modelling of ceramic materials and interfaces 114
Thermal Contraction and Disordering of the Al(110) Surface 114
Boron-Mediated Growth of Long Helicity-Selected Carbon Nanotubes 114
Supramolecular self assembly driven by electrostatic repulsion: the 1D aggregation of rubrene pentagons on Au(111) 112
Crack path analysis and mechanical properties of a multilayered ceramic composite 111
Molecular dynamics studies of the dissociated screw dislocation in silicon 110
Influence of Subsurface Layers on the Adsorption of Large Organic Molecules on Close-Packed Metal Surfaces 110
A Novel Quantum/Classical Hybrid Simulation Technique 109
Ionic Hydrogen Bonds Controlling Two-Dimensional Supramolecular Systems at a Metal Surface 109
Low speed fracture instabilities in a brittle crystal 105
null 104
A framework for machine-learning-augmented multiscale atomistic simulations on parallel supercomputers 104
``DNA as a Selective Metallization Template" 103
Insulator at the Ultrathin Limit: MgO on Ag(001) 103
Creep of Aluminum Metal Matrix composites reinforced with Magnesium Spinel 102
Structure and energetics of diphenylalanine self-assembling on Cu(110) 102
Toward Fractioning of Isomers through Binding-Induced Acceleration of Azobenzene Switching 102
Does the surface matter? Hydrogen bonded chain formation of an oxalic amide derivative in a two- and three-dimensional environment 100
Accurate interatomic force fields via machine learning with covariant kernels 99
A novel molecular dynamics approach to large semiconductor systems 98
2D Supramolecular Assemblies of Benzene 1,3,5-tri-yl Tribenzoic Acid: Temperature-Induced Phase Transformations and Hierarchical Organization with Macrocyclic Molecules 98
Enhanced creep resistance via ion exchange processes in Al/MgAl2O4 composites 97
Electrical Conductivity of an Alumina Matrix and FeAl Particles Composites 96
Influence of ad-dimers on the incorporation of carbon in the Si(100) surface 96
STEREOCHEMICAL EFFECTS IN SUPRAMOLECULAR SELF-ASSEMBLY AT SURFACES: 1-D VERSUS 2-DENANTIOMORPHIC ORDERING FOR PVBA AND PEBA ON AG(111) 95
Multiscale hybrid simulation methods for material systems 91
Mesoscopic chiral reshaping of the Ag(110) surface induced by the organic molecule PVBA 90
Two-Dimensional Self-Assembly of Supramolecular Clusters and Chains 90
Hybrid Atomistic Modelling of Materials Processes 89
Atomic structure of carbon-induced Si(001)c(4×4) reconstruction as a Si-Si homodimer and C-Si heterodimer network 89
Microscopic growth mechanisms for carbon nanotubes 89
Energetics of substitutional carbon in hydrogenated Si(100) 84
Dimer diffusion as a driving mechanism of the step bunching instability during homoepitaxial growth 81
Adatom-induced surface reconstruction in the C60/Al(111) system 79
Conformational adaptation in supramolecular assembly on surfaces 78
Deposition of calcium ion on rutile (110): a first principle investigation 76
A long-range ordered array of copper tetrameric units embedded in an on-surface metal organic framework 76
Multiscale Modeling of Defectsin Semiconductors:A Novel Molecular-Dynamics SchemeTheory of Defects in Semiconductors 75
A first principles investigation of the calcium ion deposition on rutile (110) 73
``A First Principles investigation of Ca2+ deposition on Rutile (110)'' 67
Nucleation and Growth of Platinum Clusters in Solution and on Biopolymers 65
Dissociative chemisorption of O2 inducing stress corrosion cracking in silicon crystals 65
Modeling (100) hydrogen-induced platelets in silicon: a multiscale molecular dynamics approach 60
``One MgO Monolayer- an Insulator at the Ultrathin limit" 59
Tracking the Chiral Recognition of Adsorbed Dipeptides at theSingle-Molecule Level 59
Dynamics of dissociative chemisorption: Cl2/Si(111)-(2×1) 59
``Mesoscopic correlation of Supramolecular Chirality in One-Dimensional Hydrogen Bonded Assemblies” 58
Hybrid Quantum/Classical Modeling of Material Systems: The “Learn on the Fly” Molecular Dynamics SchemeTrends in Computational Nanomechanics 55
Parametrisation to tailor commodity clusters to application 53
"Nucleation of platinum clusters on biopolymers: a first principles study of the molecular mechanism" 51
First-principles study of the TiO2(110) surface reduction upon Na adsorption 49
Theoretical Analysis of Fluorine Addition to Single Wall Carbon Nanotubes: Functionalisation Routes and Addition Patterns 48
``Initial Nucleation of Platinum Clusters after Reduction of K2PtCl4 in Aqueous Solution: a First Principles Study'' 46
Substrate-induced Supramolecular ordering of functional molecules: Theoretical Modelling and STM Investigation of thePEBA/Ag(111)System 46
Probing Peripheral H-Bonding Functionalities in BN-Doped Polycyclic Aromatic Hydrocarbons 45
"Learn on the fly": a multiscale hybrid simulation method for material systems Psi-k Network Newsletter, No. 66, December 2004 p123. 43
First principles molecular dynamics simulationsof nucleation processes in a biomineralisation context 42
Modeling nucleation and insulating properties of oxide surfaces and ultrathin films 19
Totale 11139
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Categoria #
all - tutte 16123
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 16123
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2017/2018288 0000 00 00 496313244
2018/20191670 4312213153 5060 591 45193607288
2019/20202874 174157173540 250359 242281 24215919899
2020/20211846 180109196243 154178 123173 8619558151
2021/20221081 51584895 1784 5026 13612669321
2022/20231243 112132112146 143292 4151 151000
Totale 11139