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de Gironcoli, Stefano Maria
 Distribuzione geografica
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Continente #
NA - Nord America 6.509
EU - Europa 5.982
AS - Asia 1.616
Continente sconosciuto - Info sul continente non disponibili 49
SA - Sud America 23
AF - Africa 9
OC - Oceania 9
Totale 14.197
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Nazione #
US - Stati Uniti d'America 6.225
SE - Svezia 1.281
IE - Irlanda 986
CN - Cina 896
IT - Italia 855
RU - Federazione Russa 764
UA - Ucraina 675
GB - Regno Unito 386
TR - Turchia 380
DE - Germania 353
CA - Canada 282
FI - Finlandia 250
HK - Hong Kong 160
FR - Francia 138
CH - Svizzera 85
VN - Vietnam 61
BE - Belgio 52
EU - Europa 48
NL - Olanda 45
IN - India 33
LB - Libano 27
GR - Grecia 22
BR - Brasile 21
UZ - Uzbekistan 21
AT - Austria 19
PL - Polonia 16
CZ - Repubblica Ceca 14
JP - Giappone 10
ES - Italia 8
AU - Australia 7
KR - Corea 7
RO - Romania 7
SG - Singapore 7
SK - Slovacchia (Repubblica Slovacca) 7
TW - Taiwan 5
PT - Portogallo 3
CL - Cile 2
ET - Etiopia 2
HU - Ungheria 2
IR - Iran 2
LT - Lituania 2
LU - Lussemburgo 2
NG - Nigeria 2
NO - Norvegia 2
NZ - Nuova Zelanda 2
SI - Slovenia 2
A2 - ???statistics.table.value.countryCode.A2??? 1
AE - Emirati Arabi Uniti 1
BG - Bulgaria 1
CG - Congo 1
CU - Cuba 1
CY - Cipro 1
DZ - Algeria 1
EE - Estonia 1
EG - Egitto 1
HR - Croazia 1
IL - Israele 1
IS - Islanda 1
LA - Repubblica Popolare Democratica del Laos 1
LK - Sri Lanka 1
MD - Moldavia 1
MO - Macao, regione amministrativa speciale della Cina 1
MX - Messico 1
MY - Malesia 1
NE - Niger 1
RS - Serbia 1
ZA - Sudafrica 1
Totale 14.197
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Città #
Chandler 1.271
Dublin 986
Jacksonville 868
Ann Arbor 670
Scuola 450
Wilmington 406
Izmir 370
New York 364
Saint Petersburg 334
Houston 301
Ashburn 296
Woodbridge 285
Toronto 270
Nanjing 268
Princeton 150
Hong Kong 143
Ogden 108
Beijing 106
Nanchang 104
Helsinki 89
Trieste 60
Dong Ket 55
Brooklyn 54
Brussels 52
Lausanne 51
Tianjin 44
Hebei 43
Kunming 43
Shenyang 40
Milan 39
Boardman 36
Pisa 35
Changsha 34
Falls Church 31
Lappeenranta 28
Jiaxing 23
Verona 21
Washington 20
Hangzhou 18
Moscow 17
Seattle 17
Lanzhou 16
Orange 16
San Diego 15
Chicago 13
Dearborn 13
Hanover 13
Shanghai 13
Changchun 12
Frankfurt Am Main 12
Altavilla Vicentina 11
Bremen 11
Candelo 11
Pignone 11
Guangzhou 10
Ningbo 10
Norwalk 10
Indiana 9
Redwood City 9
Torino 9
Ulan-ude 9
Auburn Hills 8
Council Bluffs 8
Inglewood 8
Taizhou 8
Zhengzhou 8
Bratislava 7
Cambridge 7
Dongguan 7
Rome 7
São Paulo 7
Trento 7
Turin 7
Central 6
Frankfurt am Main 6
Los Angeles 6
Mountain View 6
Mumbai 6
Rockville 6
West Jordan 6
Bologna 5
Den Haag 5
Las Vegas 5
London 5
Naples 5
Padova 5
Redmond 5
Salerno 5
Strasbourg 5
Florence 4
Genoa 4
Hanoi 4
Jinan 4
Latina 4
Plauen 4
San Francisco 4
Southend 4
Azzano Decimo 3
Barcelona 3
Borås 3
Totale 9.050
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Nome #
Efficient calculation of exact exchange and RPA correlation energies in the adiabatic-connection fluctuation-dissipation theory 229
QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials 213
The (1x1)-> hexagonal structural transition on Pt(100) studied by high-energy resolution core level photoemission 209
Advanced capabilities for materials modelling with Quantum ESPRESSO 190
Hydrogen and coordination bonding supramolecular structures of trimesic acid on Cu(110) 164
Reproducibility in density functional theory calculations of solids 145
Lithium Adsorption on Graphene at Finite Temperature 143
Phonons in nonlocal van der Waals density functional theory 141
Ab initio calculation of phonon dispersions in semiconductors 134
Publisher's Note: Molecular bonding with the RPAx: From weak dispersion forces to strong correlation [Phys. Rev. B 93, 195108 (2016)] 132
Ab initio phonon dispersions of Fe and Ni 131
Ab initio lattice dynamics of MgSiO3 perovskite at high pressure 130
alpha beta phase transition in tin: A theoretical study based on density-functional perturbation theory 130
Ab initio self-consistent total-energy calculations within the EXX/RPA formalism 129
Ab initio phonon calculations in solids 126
Hubbard-Corrected DFT Energy Functionals: The LDA + U Description of Correlated Systems 126
zeta-Glycine: insight into the mechanism of a polymorphic phase transition 126
Molecular bonding with the RPAx: From weak dispersion forces to strong correlation 125
SixC1−xO2 alloys: A possible route to stabilize carbon-based silica-like solids? 122
A parallel orbital-updating based plane-wave basis method for electronic structure calculations 120
Ab initio study of phonons in wurtzite AlxGa1-xN alloys 119
Methane dehydrogenation on Rh@Cu(111): a first-principles study of a model catalyst 117
Linear response approach to the calculation of the effective interaction parameters in the LDA+U method 117
Vibrational properties of MnO and NiO from DFT plus U-based density functional perturbation theory 116
The reconstruction of Rh(001) upon oxygen adsorption 116
Templated growth of metal-organic coordination chains at surfaces 114
Structure and phase stability of GaxIn1−xP solid solutions from computational alchemy 114
Correlation energy within exact-exchange adiabatic connection fluctuation-dissipation theory: Systematic development and simple approximations 113
Engineering the reactivity of metal catalysts: A model study of methane dehydrogenation on Rh(111) 113
The reconstruction of nickel and rhodium (001) surfaces upon carbon, nitrogen or oxygen adsorptions 113
High-pressure thermal expansion, bulk modulus, and phonon structure of diamond 113
Adsorption of ethylene on stepped Ag(n10) surfaces 113
Adsorption of chlorine on Ag(111): no subsurface Cl at low coverage 112
Ab-initio calculation of phonon dispersions in II-VI semiconductors 112
Activated adsorption of ethylene on atomic-oxygen-covered Ag(100) and Ag(210): Formation of an oxametallacycle 112
Ab-initio dynamical properties of the Be(0001) surface 112
Phonons in Si-Ge systems: An ab initio interatomic-force-constant approach 111
Effects of disorder on the Raman spectra of GaAs/AlAs superlattices 107
Ab initio calculation of the thermal properties of Cu: Performance of the LDA and GGA 106
Phonons and related crystal properties from density-functional perturbation theory 106
Ab initio study of Be (0001) surface thermal expansion 106
Adsorption of ethylene on the Ag(001) surface 105
Structure and dynamics of the missing-row reconstruction on O/Cu(001) and O/Ag(001) 105
First-principles codes for computational crystallography in the Quantum-ESPRESSO package 104
What determines the catalyst's selectivity in the ethylene epoxidation reaction 104
Phonon dispersions in GaxAl1−xAs alloys 104
Phonon softening and elastic instabilities in the cubic-to-orthorhombic structural transition of CsH 104
Ab initio study of Be (1010) surface dynamical properties 103
Disproportionation phenomena on free and strained Sn/Ge(111) and Sn/Si(111) surfaces 103
DFT study of a weakly pi-bonded C2H4 on oxygen-covered Ag(100) 103
Quantum ESPRESSO toward the exascale 103
On-surface and sub-surface oxygen adsorption on Ag(210): vibrational properties 102
Anomalous Pressure-Induced Transition(s) in Ice XI 101
Direct methane-to-methanol conversion: Insight from first-principles calculations 101
Analysis of methane-to-methanol conversion on clean and defective Rh surfaces 101
Piezoelectric properties of III-V semiconductors from first-principles linear-response theory 101
Vacancy self-diffusion parameters in tungsten: Finite electron-temperature LDA calculations 101
Floating bonds and gap states in a-Si and a-Si : H from first principles calculations 100
Ab initio Al-27 NMR chemical shifts and quadrupolar parameters for Al2O3 phases and their precursors 100
Ag-Cu catalysts for ethylene epoxidation: Selectivity and activity descriptors 100
Infrared reflectivity by transverse-optical phonons in (GaAs)m/(AlAs)n ultrathin-layer superlattices 100
Taming multiple valency with density functionals: a case study of defective ceria 100
The mechanism for the 3 x 3 distortion of Sn/Ge(111) 100
Interaction of hydrogen with cerium oxide surfaces: a quantum mechanical computational study 99
Toward an accurate and efficient theory of physisorption. I. Development of an augmented density-functional theory model 98
Anomalous thermodynamic properties in ferropericlase throughout its spin crossover transition 98
Beyond the random phase approximation with a local exchange vertex 98
Electronic and atomistic structures of clean and reduced ceria surfaces 97
Photoactivated processes in optical fibers: generation and conversion mechanisms of twofold coordinated Si and Ge atoms 97
On-surface and subsurface adsorption of oxygen on stepped Ag(210) and Ag(410) surfaces 97
Co-adsorption of ethylene and oxygen on the Ag(001) surface 97
Structural and electronic properties of a wide-gap quaternary solid solution: Zn,Mg S,Se 97
Adsorption of atomic oxygen on Ag(001): a study based on density-functional theory 96
Reply to "Comment on 'Taming multiple valency with density functionals: A case study of defective ceria'" 96
Vibrational properties of isolated AlAs monolayers embedded in GaAs: a theoretical study of the effects of disorder 96
Structural models of activated gamma-alumina surfaces revisited: Thermodynamics, NMR and IR spectroscopies from ab initio calculations 95
CO/Pt(111): GGA density functional study of site preference for adsorption 95
Structure and thermodynamics of SixGe1−x alloys from ab initio Monte Carlo simulations 95
Nonlocal van der Waals density functional made simple and efficient 94
Structure and dynamics of oxygen adsorbed on Ag(100) vicinal surfaces 94
Geometric and electronic structure of the N/Rh(100) system by core-level photoelectron spectroscopy: Experiment and Theory 94
Successful a priori modeling of CO adsorption on Pt(111) using periodic hybrid density functional theory 92
Thermoelastic properties of MgSiO3-perovskite: Insights on the nature of the Earth's lower mantle 91
Interplay between bonding and magnetism in the binding of NO to Rh clusters 91
Piezoelectricity in III-V and II-VI semiconductors: A systematic ab-initio calculation 91
Temperature-dependent surface relaxations of Ag(111) 91
Structural and elastic properties of strained Mg1-xSrxSe revealed 90
The Ni3Al(111) surface structure: experiment and theory 90
Phonon softening and superconductivity in tellurium under pressure 89
The Interaction of Ethylene with Perfect and Defective Ag(001) Surfaces 88
Substrate doping: A strategy for enhancing reactivity on gold nanocatalysts by tuning sp bands 88
Isobaric first-principles molecular dynamics of liquid water with nonlocal van der Waals interactions 88
Complete C-13 NMR Chemical Shifts Assignment for Cholesterol Crystals by Combined CP-MAS Spectral Editing and ab Initio GIPAW Calculations with Dispersion Forces 87
In-plane Raman scattering of (001)-Si/Ge superlattices: Theory and experiment 87
Core level shifts of undercoordinated Pt atoms 87
Structural, electronic, and magnetic properties of Fe2SiO4 fayalite: Comparison of LDA and GGA results 87
Lattice dynamics of metals from density-functional perturbation theory 87
First-principles study of the thermal expansion of Be(10(1)over-bar0) 86
Order-disorder phase boundary between ice VII and VIII obtained by first principles 86
Nature of the Volume Isotope Effect in Ice 86
Totale 10.987
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Categoria #
all - tutte 60.797
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 60.797
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2018/2019898 0 0 0 0 0 0 0 0 0 0 137 761
2019/20201.967 300 154 358 56 174 46 292 151 170 110 151 5
2020/20211.601 174 6 9 157 47 288 210 9 190 187 85 239
2021/20221.561 237 162 11 176 282 54 86 183 40 51 77 202
2022/20233.811 557 397 358 361 169 782 375 278 350 26 60 98
2023/20241.926 126 35 82 51 283 714 48 130 314 122 21 0
Totale 14.811