ALFE', Dario
 Distribuzione geografica
Continente #
NA - Nord America 2.930
EU - Europa 474
AS - Asia 461
OC - Oceania 4
AF - Africa 3
Continente sconosciuto - Info sul continente non disponibili 1
SA - Sud America 1
Totale 3.874
Nazione #
US - Stati Uniti d'America 2.862
CN - Cina 413
IT - Italia 309
CA - Canada 66
NL - Olanda 57
GB - Regno Unito 51
PK - Pakistan 30
DE - Germania 18
SG - Singapore 9
IE - Irlanda 7
BG - Bulgaria 6
UA - Ucraina 5
AU - Australia 3
BE - Belgio 3
CH - Svizzera 3
FI - Finlandia 3
IN - India 3
SE - Svezia 3
CI - Costa d'Avorio 2
FR - Francia 2
HK - Hong Kong 2
JP - Giappone 2
MY - Malesia 2
AT - Austria 1
BR - Brasile 1
DK - Danimarca 1
ES - Italia 1
EU - Europa 1
GH - Ghana 1
HN - Honduras 1
HR - Croazia 1
LT - Lituania 1
MX - Messico 1
NZ - Nuova Zelanda 1
PT - Portogallo 1
RO - Romania 1
Totale 3.874
Città #
Chandler 1.023
Lawrence 212
Boston 186
Nanjing 179
Des Moines 152
Millbury 152
Ashburn 75
Naples 75
Ottawa 65
Amsterdam 57
Hebei 52
Wilmington 51
Jiaxing 42
Nanchang 39
Shenyang 36
Grugliasco 32
Lahore 29
Changsha 26
Napoli 25
Rome 18
Tianjin 18
Fairfield 12
Chippenham 11
Falls Church 10
Aprilia 7
Bari 7
Beijing 7
Frankfurt am Main 7
London 7
Manchester 7
Norwalk 7
Cagliari 6
Sofia 6
Vajont 6
Houston 5
Salerno 5
Trieste 5
Washington 5
Woodbridge 5
Bitonto 4
Council Bluffs 4
Hangzhou 4
Padova 4
Bristol 3
Cambridge 3
Dearborn 3
Delabole 3
Dublin 3
Kronberg 3
Pune 3
Redwood City 3
Thiene 3
Zanica 3
Zurich 3
Brussels 2
Edinburgh 2
Fremont 2
Gragnano 2
Hong Kong 2
Jacksonville 2
Kuala Lumpur 2
Lappeenranta 2
Los Angeles 2
Marigliano 2
Montesilvano Marina 2
New Orleans 2
Portici 2
San Sperate 2
Singapore 2
York 2
Ann Arbor 1
Avellino 1
Bloomsbury 1
Bologna 1
Choloma 1
Cormeilles-en-Parisis 1
Davis 1
Frankfurt An Der Oder 1
Ghent 1
Giugliano in Campania 1
Gujranwala 1
Hamilton 1
Haywards Heath 1
Helsinki 1
Islington 1
Kamampa 1
Lisbon 1
Liverpool 1
Lombardi 1
Madrid 1
Maletto 1
Mazzano Romano 1
Miami 1
Milan 1
Montecorvino Pugliano 1
Ningbo 1
Port Jefferson 1
Rende 1
Sacramento 1
Saint Albans 1
Totale 2.780
Nome #
Structural relaxation and low-energy properties of twisted bilayer graphene 58
Crucial role of atomic corrugation on the flat bands and energy gaps of twisted bilayer graphene at the magic angle θ∼1.08∘ 49
First principles study of two rhodium surfaces upon carbon-monoxide and oxygen adsorption 38
Boosting the accuracy and speed of quantum Monte Carlo: Size consistency and time step 37
Fast and accurate quantum Monte Carlo for molecular crystals 37
1ST EXPERIMENTAL TESTS AT THE NEW SYNCHROTRON-RADIATION FACILITY ELETTRA IN TRIESTE 37
Ab initio molecular dynamic simulation on the elasticity of Mg3Al2Si3O12 pyrope 34
Elasticity of CaSiO(3) perovskite at high pressure and high temperature 32
Hydrogen dissociation on Mg(0001) studied via quantum Monte Carlo calculations 31
An ab initio study of the relative stabilities and equations of state of Fe(3)S polymorphs 31
Ab initio lattice dynamics calculations on the combined effect of temperature and silicon on the stability of different iron phases in the Earth's inner core 31
Ab initio molecular dynamics study of elasticity of akimotoite MgSiO3 at mantle conditions 30
Hard Numbers for Large Molecules: Toward Exact Energetics for Supramolecular Systems 30
A comparison between quantum chemistry and quantum Monte Carlo techniques for the adsorption of water on the (001) LiH surface 29
Development of a machine learning potential for graphene 29
Ab initio molecular dynamics, a simple algorithm for charge extrapolation 29
Spin-flop ordering from frustrated ferro- and antiferromagnetic interactions: A combined theoretical and experimental study of a Mn/Fe(100) monolayer 29
Dehydrogenation of pure and Ti-doped Na3AlH6 surfaces from first principles calculations 29
Ab initio calculations of the thermodynamics and phase diagram of zirconium 29
Ab initio free energy calculations on the polymorphs of iron at core conditions 29
Oxygen in the Earth's core: a first-principles study 28
Thermal Expansion of Supported and Freestanding Graphene: Lattice Constant versus Interatomic Distance 28
Epitaxy of nanocrystalline Silicon Carbide on Si(111) at Room Temperature 28
Ideal solution theory 28
A new belt-type apparatus for neutron-based rheological measurements at gigapascal pressures 28
First-principles simulations of direct coexistence of solid and liquid aluminum 28
Physisorption of Water on Graphene: Subchemical Accuracy from Many-Body Electronic Structure Methods 27
Nanoscale π-π Stacked molecules are bound by collective charge fluctuations 27
On core convection and the geodynamo: Effects of high electrical and thermal conductivity 27
Unravelling the roles of surface chemical composition and geometry for the graphene-metal interaction through C1s core-level spectroscopy 27
Thermodynamics of hexagonal-close-packed iron under Earth's core conditions 27
Ab initio study of the phase separation of argon in molten iron at high pressures 27
Ab initio chemical potentials of solid and liquid solutions and the chemistry of the Earth's core 27
Ab initio calculation of lattice dynamics and thermodynamic properties of beryllium 27
Pressure-induced amorphization of CuFeS2 studied by Fe-57 nuclear resonant inelastic scattering 27
Extension of molecular electronic structure methods to the solid state: computation of the cohesive energy of lithium hydride 27
Composition and temperature of the Earth's core constrained by combining ab initio calculations and seismic data 27
Phonon density of states of iron up to 153 gigapascals 27
Perspective: How good is DFT for water? 26
Efficient localized basis set for quantum Monte Carlo calculations on condensed matter 26
Water on BN doped benzene: A hard test for exchange-correlation functionals and the impact of exact exchange on weak binding 26
Ab initio melting curve of molybdenum by the phase coexistence method 26
Interfacial two-dimensional oxide enhances photocatalytic activity of graphene/titania via electronic structure modification 26
Elasticity of Mg2SiO4 ringwoodite at mantle conditions 25
The ab initio simulation of the Earth's core 25
The reconstruction of Rh(001) upon oxygen adsorption 25
The water-benzene interaction: Insight from electronic structure theories 25
Thermodynamic stability of Fe/O solid solution at inner-core conditions 25
Melting curve of MgO from first-principles simulations 25
DMC-ICE13: ambient and high pressure polymorphs of ice from Diffusion Monte Carlo and Density Functional Theory 24
Energy benchmarks for methane-water systems from quantum Monte Carlo and second-order Møller-Plesset calculations 24
Gross thermodynamics of two-component core convection 24
Melting curve of materials: theory versus experiments 24
Structural, vibrational and thermodynamic properties of Mg2SiO4 and MgSiO3 minerals from first-principles simulations 23
Ab initio statistical mechanics of surface adsorption and desorption. II. Nuclear quantum effects 23
Transport properties for liquid silicon-oxygen-iron mixtures at Earth's core conditions 23
Structure and elasticity of hydrous ringwoodite: A first principle investigation 23
Equation of state of hexagonal closed packed iron under Earth's core conditions from quantum Monte Carlo calculations 23
Ab initio calculations on the free energy and high P-T elasticity of face-centred-cubic iron 23
Assessing the accuracy of quantum Monte Carlo and density functional theory for energetics of small water clusters 23
Melting of Iron under Earth's Core Conditions from Diffusion Monte Carlo Free Energy Calculations 23
Properties of the water to boron nitride interaction: From zero to two dimensions with benchmark accuracy 22
On the accuracy of van der Waals inclusive density-functional theory exchange-correlation functionals for ice at ambient and high pressures 22
Structural properties and enthalpy of formation of magnesium hydride from quantum Monte Carlo calculations 22
The melting curve of iron at the pressures of the Earth's core from ab initio calculations 22
First-Principles Simulations of Lithium Melting: Stability of the bcc Phase Close to Melting 22
Ab initio melting curve of the fcc phase of aluminum 22
Ab initio thermodynamics and phase diagram of solid magnesium: A comparison of the LDA and GGA 22
Unusual reversibility in molecular break-up of PAHs: The case of pentacene dehydrogenation on Ir(111) 22
Structure of magnesium selenate enneahydrate, MgSeO4·9H2O, from 5 to 250K using neutron time-of-flight Laue diffraction 21
Ab initio molecular dynamics simulations for thermal equation of state of B2-type NaCl 21
Constraints on the composition of the Earth's core from ab initio calculations 21
Ab initio statistical mechanics of surface adsorption and desorption. I. H(2)O on MgO (001) at low coverage 21
Lattice electrical resistivity of magnetic bcc iron from first-principles calculations 21
Absolute rate of thermal desorption from first-principles simulation 21
Adsorption of a water molecule on the MgO(100) surface as described by cluster and slab models 21
Temperature and composition of the Earth's core 21
Complementary approaches to the ab initio calculation of melting properties 21
Hydrogen dissociation and diffusion on Ni- and Ti-doped Mg(0001) surfaces 21
Communication: Energy benchmarking with quantum Monte Carlo for water nano-droplets and bulk liquid water 21
Molecular dynamics study of the point defects in bcc uranium 21
Partitioning of Oxygen Between Ferropericlase and Earth's Liquid Core 20
Performance of van der Waals Corrected Functionals for Guest Adsorption in the M2(dobdc) Metal-Organic Frameworks 20
HREEL spectra of various oxygen structures on Rh(110) 20
Thermal and electrical conductivity of solid iron and iron-silicon mixtures at Earth's core conditions 20
Non-adiabatic ab initio molecular dynamics of supersonic beam epitaxy of silicon carbide at room temperature 20
Ab initio melting curve of copper by the phase coexistence approach 20
Bulk and surface energetics of crystalline lithium hydride: Benchmarks from quantum Monte Carlo and quantum chemistry 20
The energetics of oxide surfaces by quantum Monte Carlo 20
Iron under Earth's core conditions: Liquid-state thermodynamics and high-pressure melting curve from ab initio calculations 20
Schottky defect formation energy in MgO calculated by diffusion Monte Carlo 20
Structure, hydrogen bonding and thermal expansion of ammonium carbonate monohydrate 20
Assessment of density functional theory for iron(II) molecules across the spin-crossover transition 20
Quantum Monte Carlo calculations of the structural properties and the B1-B2 phase transition of MgO 20
Electronic correlations and transport in iron at Earth’s core conditions 20
Evidence for stable square ice from quantum Monte Carlo 19
Toward accurate adsorption energetics on clay surfaces 19
Comparison of polynomial approximations to speed up planewave-based quantum Monte Carlo calculations 19
Theory & Practice - The Ab Initio Treatment of High Pressure & Temperature Mineral Properties & Behaviour 19
Diamond and beta-tin structures of Si studied with quantum Monte Carlo calculations 19
Totale 2.533
Categoria #
all - tutte 15.188
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 15.188


Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2018/2019221 0 0 0 0 0 0 0 0 0 0 152 69
2019/2020500 388 6 2 9 10 0 5 0 1 8 50 21
2020/2021173 7 1 10 1 7 47 4 44 20 2 30 0
2021/2022839 8 0 21 14 12 30 13 41 21 5 7 667
2022/20231.865 284 176 27 339 183 252 4 150 302 59 76 13
2023/2024479 44 186 106 23 20 55 11 29 5 0 0 0
Totale 4.166