DE GIRONCOLI, STEFANO MARIA
 Distribuzione geografica
Continente #
AS - Asia 1.390
NA - Nord America 1.292
EU - Europa 382
SA - Sud America 242
Continente sconosciuto - Info sul continente non disponibili 49
AF - Africa 26
OC - Oceania 1
Totale 3.382
Nazione #
US - Stati Uniti d'America 1.228
SG - Singapore 582
CN - Cina 308
BR - Brasile 184
VN - Vietnam 147
HK - Hong Kong 135
IT - Italia 122
FR - Francia 107
KR - Corea 47
DE - Germania 29
IN - India 29
CA - Canada 28
GB - Regno Unito 28
BD - Bangladesh 23
NL - Olanda 21
FI - Finlandia 19
JP - Giappone 18
EC - Ecuador 16
ID - Indonesia 13
AR - Argentina 12
CO - Colombia 12
IQ - Iraq 12
PL - Polonia 11
IL - Israele 10
PH - Filippine 9
TR - Turchia 9
ES - Italia 7
HN - Honduras 7
TH - Thailandia 7
MY - Malesia 6
UZ - Uzbekistan 6
ZA - Sudafrica 6
CH - Svizzera 5
MX - Messico 5
PK - Pakistan 5
SA - Arabia Saudita 5
SV - El Salvador 5
UA - Ucraina 5
VE - Venezuela 5
JM - Giamaica 4
KE - Kenya 4
SE - Svezia 4
AE - Emirati Arabi Uniti 3
AT - Austria 3
CL - Cile 3
DZ - Algeria 3
EE - Estonia 3
KG - Kirghizistan 3
LT - Lituania 3
NI - Nicaragua 3
PE - Perù 3
PY - Paraguay 3
RU - Federazione Russa 3
TN - Tunisia 3
TT - Trinidad e Tobago 3
BS - Bahamas 2
BY - Bielorussia 2
GF - Guiana Francese 2
MA - Marocco 2
PS - Palestinian Territory 2
RO - Romania 2
TZ - Tanzania 2
AF - Afghanistan, Repubblica islamica di 1
AL - Albania 1
AM - Armenia 1
AZ - Azerbaigian 1
BE - Belgio 1
BG - Bulgaria 1
BZ - Belize 1
CI - Costa d'Avorio 1
CR - Costa Rica 1
CY - Cipro 1
CZ - Repubblica Ceca 1
DO - Repubblica Dominicana 1
EG - Egitto 1
ET - Etiopia 1
GP - Guadalupe 1
GR - Grecia 1
GY - Guiana 1
HU - Ungheria 1
IE - Irlanda 1
JO - Giordania 1
KN - Saint Kitts e Nevis 1
KZ - Kazakistan 1
LA - Repubblica Popolare Democratica del Laos 1
LK - Sri Lanka 1
NG - Nigeria 1
OM - Oman 1
PA - Panama 1
PG - Papua Nuova Guinea 1
PR - Porto Rico 1
QA - Qatar 1
RS - Serbia 1
SC - Seychelles 1
SO - Somalia 1
SY - Repubblica araba siriana 1
UY - Uruguay 1
Totale 3.333
Città #
Singapore 358
Santa Clara 347
San Jose 242
Hong Kong 130
Hefei 122
Beijing 92
Ashburn 89
Lauterbourg 64
Ho Chi Minh City 59
Seoul 47
Dallas 35
Hanoi 35
Trieste 29
New York 24
Los Angeles 23
São Paulo 18
Council Bluffs 17
Chicago 12
Frankfurt am Main 11
Helsinki 11
Tokyo 11
Milan 10
Brooklyn 9
Haiphong 9
Orem 8
Guayaquil 7
Lappeenranta 7
Quito 7
Rome 7
Atlanta 6
Baghdad 6
Belo Horizonte 6
Buffalo 6
Houston 6
Minamishinagawa 6
Phoenix 6
Ribeirão Preto 6
Wroclaw 6
Bangkok 5
Bengaluru 5
Chennai 5
Dhaka 5
Düsseldorf 5
London 5
Manchester 5
Miami 5
Modena 5
Montreal 5
Philadelphia 5
Rio de Janeiro 5
San Salvador 5
Tashkent 5
Bexley 4
Bologna 4
Boston 4
Calgary 4
Jakarta 4
Las Vegas 4
Manaus 4
Milwaukee 4
Mumbai 4
Nairobi 4
Vancouver 4
Warsaw 4
Zurich 4
Amsterdam 3
Bishkek 3
Blumenau 3
Cajamar 3
Can Tho 3
Charlotte 3
Curitiba 3
Da Nang 3
Huế 3
Joinville 3
Kuala Lumpur 3
Madrid 3
Managua 3
Medellín 3
Medina 3
Newark 3
Nuremberg 3
Porto Alegre 3
Pretoria 3
Quận Bảy 3
Salvador 3
San Pedro Sula 3
St Louis 3
Stockholm 3
São Gonçalo 3
Tegucigalpa 3
Thái Nguyên 3
Toronto 3
Troy 3
Vienna 3
Washington 3
Annapolis 2
Asunción 2
Athens 2
Bari 2
Totale 2.117
Nome #
Hubbard-corrected density functional perturbation theory with ultrasoft pseudopotentials 103
The Ni3Al(111) surface structure: experiment and theory 89
D1.5 Third release of MAX software: Final report on restructuring, exascale readiness and inter-code libraries 85
Growth and Redox Properties of Boron on Al(111): Competing Affinities in the Case of Honeycomb AlB2 80
Quantum ESPRESSO toward the exascale 73
Efficient calculation of exact exchange and RPA correlation energies in the adiabatic-connection fluctuation-dissipation theory 72
D2.3 Third release of MAX software: Report on the release of documentation of the performance optimised parts 72
D1.4 Second release of MAX software: Report on first common APIs, data structures and domain-specific libraries 71
Finding Reaction Pathways and Transition States: r-ARTn and d-ARTn as an Efficient and Versatile Alternative to String Approaches 70
D8.2 First report on Training and Education 67
Collective dipole effects in ionic transport under electric fields 67
v-P2O5 micro-clustering in P-doped silica studied by a first-principles Raman investigation 64
Direct methane-to-methanol conversion: Insight from first-principles calculations 61
QUANTUM ESPRESSO: A modular and open-source software project for quantum simulations of materials 61
Hubbard-Corrected DFT Energy Functionals: The LDA + U Description of Correlated Systems 59
Taming multiple valency with density functionals: A case study of defective ceria 59
The CECAM electronic structure library and the modular software development paradigm 59
A systematic approach to generating accurate neural network potentials: the case of carbon 58
Advanced capabilities for materials modelling with Quantum ESPRESSO 58
Reproducibility in density functional theory calculations of solids 57
Defect creation and Diffusion under electric fields from first-principles: The prototypical case of silicon dioxide 55
First-principles characterization of Mg low-index surfaces: Structure, reconstructions, and surface core-level shifts 55
Photoactivated processes in optical fibers: generation and conversion mechanisms of twofold coordinated Si and Ge atoms 53
Growing borophene on metal substrates: A theoretical study of the role of oxygen on Al(111) 52
Beyond the random phase approximation with a local exchange vertex 49
Nonlocal van der Waals density functional made simple and efficient 48
Nano-scale corrugations in graphene: A density functional theory study of structure, electronic properties and hydrogenation 48
D2.2 Second release of MAX software: Report on performance achieved 48
Nature of the Volume Isotope Effect in Ice 46
Ag-Cu catalysts for ethylene epoxidation: Selectivity and activity descriptors 44
Toward an accurate and efficient theory of physisorption. I. Development of an augmented density-functional theory model 44
First-principles codes for Computational Crystallography in the Quantum-ESPRESSO package 43
A parallel orbital-updating based plane-wave basis method for electronic structure calculations 43
High-precision calculation of Hartree-Fock energy of crystals 43
Complete C-13 NMR Chemical Shifts Assignment for Cholesterol Crystals by Combined CPMAS Spectral Editing and ab Initio GIPAW Calculations with Dispersion Forces 41
Incorporating long-range electrostatics in neural network potentials via variational charge equilibration from shortsighted ingredients 41
Vibrational properties of MnO and NiO from DFT plus U-based density functional perturbation theory 40
Phonons in nonlocal van derWaals density functional theory 40
Molecular bonding with the RPAx: From weak dispersion forces to strong correlation 40
Stability of Intermediate States for Ethylene Epoxidation on Ag-Cu Alloy Catalyst: A First-Principles Investigation 40
Highly under-coordinated atoms at Rh surfaces: interplay of strain and coordination effects on core level shift 39
Tailored plasmon polariton landscape in graphene/boron nitride patterned heterostructures 39
Hydrogen and coordination bonding supramolecular structures of trimesic acid on Cu(110) 38
Isobaric first-principles molecular dynamics of liquid water with nonlocal van der Waals interactions 38
Successful a priori modeling of CO adsorption on pt(111) using periodic hybrid density functional theory 37
Surface Core Level Shift: High Sensitive Probe to Oxygen-Induced Reconstruction of Rh(100) 37
Ab initio self-consistent total-energy calculations within the EXX/RPA formalism 37
What determines the catalyst's selectivity in the ethylene epoxidation reaction 35
Analysis of methane-to-methanol conversion on clean and defective Rh surfaces 35
Templated growth of metal-organic coordination chains at surfaces 34
Correlation energy within exact-exchange adiabatic connection fluctuation-dissipation theory: Systematic development and simple approximations 34
Enhanced Chemical Reactivity of Under-Coordinated Atoms at Pt-Rh Bimetallic Surfaces: A Spectroscopic Characterization 34
Geometric and electronic structure of the N/Rh(100) system by core-level photoelectron spectroscopy: Experiment and theory 34
Core level shifts of undercoordinated Pt atoms 33
Experimental and theoretical surface core level shift study of the S-Rh(100) local environment 33
Structural and elastic properties of strained Mg1-xSrxSe revealed 33
The (1x1)-> hexagonal structural transition on Pt(100) studied by high-energy resolution core level photoemission 33
Subsurface oxygen stabilization by a third species: Carbonates on Ag(210) 33
Interplay between bonding and magnetism in the binding of NO to Rh clusters 33
Electronic and atomistic structures of clean and reduced ceria surfaces 32
Structural models of activated gamma-alumina surfaces revisited: Thermodynamics, NMR and IR spectroscopies from ab initio calculations 32
Structural evolution of amino acid crystals under stress from a non-empirical density functional 32
Reply to Comment on 'Taming multiple valency with density functionals: A case study of defective ceria' 32
Experimental and theoretical surface core level shift study of the S-Rh(100) local environment 32
Molecular bonding with the RPAx: From weak dispersion forces to strong correlation (vol 93, 195108, 2016) 30
CO/Pt(111): GGA density functional study of site preference for adsorption 30
Order-disorder phase boundary between ice VII and VIII obtained by first principles 30
Ab initio Al-27 NMR chemical shifts and quadrupolar parameters for Al2O3 phases and their precursors 29
Activated adsorption of ethylene on atomic-oxygen-covered Ag(100) and Ag(210): Formation of an oxametallacycle 28
Spin transition in magnesiowustite in earth's lower mantle 28
The (1x1)-> hexagonal structural transition on Pt(100) studied by high-energy resolution core level photoemission 27
Tuning the Morphology of Gold Clusters by Substrate Doping 27
Templated Growth of Metal-Organic Coordination Chains at Surfaces 26
Totale 3.382
Categoria #
all - tutte 11.965
article - articoli 10.867
book - libri 0
conference - conferenze 0
curatela - curatele 0
other - altro 0
patent - brevetti 0
selected - selezionate 0
volume - volumi 0
Totale 22.832


Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2023/202415 0 0 0 0 0 0 0 0 0 0 13 2
2024/20251.221 12 4 67 35 304 77 38 31 71 39 265 278
2025/20261.712 89 147 162 204 280 70 316 64 77 116 71 116
2026/2027434 76 103 255 0 0 0 0 0 0 0 0 0
Totale 3.382