IRIS
GIANNOZZI, Paolo
 Distribuzione geografica
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Continente #
NA - Nord America 8.997
EU - Europa 2.188
AS - Asia 1.253
SA - Sud America 178
AF - Africa 32
Continente sconosciuto - Info sul continente non disponibili 5
Totale 12.653
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Nazione #
US - Stati Uniti d'America 8.922
SG - Singapore 696
UA - Ucraina 619
IE - Irlanda 293
DE - Germania 274
CN - Cina 260
IT - Italia 228
FI - Finlandia 209
SE - Svezia 206
BR - Brasile 163
RU - Federazione Russa 139
TR - Turchia 96
GB - Regno Unito 82
KR - Corea 82
CA - Canada 68
VN - Vietnam 66
PT - Portogallo 39
FR - Francia 28
TG - Togo 16
BE - Belgio 13
PL - Polonia 9
AT - Austria 8
HK - Hong Kong 8
NL - Olanda 8
AR - Argentina 7
SA - Arabia Saudita 7
ZA - Sudafrica 7
BG - Bulgaria 5
CH - Svizzera 5
EU - Europa 5
IR - Iran 5
RS - Serbia 5
TW - Taiwan 5
EC - Ecuador 4
ES - Italia 4
JP - Giappone 4
RO - Romania 4
IN - India 3
MA - Marocco 3
MX - Messico 3
PK - Pakistan 3
UZ - Uzbekistan 3
AE - Emirati Arabi Uniti 2
BD - Bangladesh 2
EE - Estonia 2
EG - Egitto 2
GR - Grecia 2
IQ - Iraq 2
KG - Kirghizistan 2
MO - Macao, regione amministrativa speciale della Cina 2
AL - Albania 1
AO - Angola 1
AZ - Azerbaigian 1
BO - Bolivia 1
BW - Botswana 1
CL - Cile 1
CO - Colombia 1
CR - Costa Rica 1
CZ - Repubblica Ceca 1
DK - Danimarca 1
GT - Guatemala 1
HU - Ungheria 1
IL - Israele 1
JM - Giamaica 1
JO - Giordania 1
KE - Kenya 1
LK - Sri Lanka 1
LT - Lituania 1
LV - Lettonia 1
ML - Mali 1
PA - Panama 1
PE - Perù 1
TM - Turkmenistan 1
Totale 12.653
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Città #
Woodbridge 1.537
Ann Arbor 1.086
Houston 1.033
Fairfield 1.031
Ashburn 542
Chandler 498
Jacksonville 453
Seattle 424
Wilmington 410
Singapore 394
Cambridge 347
Dublin 293
Dearborn 220
Boardman 161
Beijing 125
Princeton 110
Izmir 92
Seoul 75
Udine 71
Dong Ket 64
Ottawa 58
San Diego 56
Des Moines 46
Leesburg 34
Porto 28
Ogden 24
Norwalk 22
Trieste 20
Hefei 18
Milan 18
Lomé 16
Nanjing 14
Brussels 13
São Paulo 13
Falls Church 12
Frankfurt am Main 12
Los Angeles 12
Kunming 11
Nuremberg 10
Phoenix 10
Guangzhou 9
Warsaw 9
Grafing 8
Guimarães 8
Lappeenranta 8
San Michele al Tagliamento 8
Bologna 7
Gatteo 7
Belluno 6
Indiana 6
Johannesburg 6
New York 6
Parma 6
Riyadh 6
San Francisco 6
Shenyang 6
Toronto 6
Vienna 6
Belgrade 5
Caserta 5
Changsha 5
Chengdu 5
Helsinki 5
Hong Kong 5
Jinan 5
London 5
Modena 5
Moscow 5
Rio de Janeiro 5
Rome 5
Shanghai 5
Washington 5
Amsterdam 4
Brooklyn 4
Chicago 4
Düsseldorf 4
Hangzhou 4
Hebei 4
Lauterbourg 4
Ningbo 4
Portsmouth 4
Redmond 4
Santa Clara 4
Sofia 4
Tappahannock 4
Zurich 4
Alfena 3
Andover 3
Auburn Hills 3
Brasília 3
Burgos 3
Campinas 3
Dallas 3
Fontanafredda 3
Incheon 3
Marília 3
Minamikasai 3
Quito 3
Redwood City 3
Taipei 3
Totale 9.705
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Nome #
Investigation of structural, electronic and magnetic properties of breathing metal-organic framework MIL-47(Mn): A first principles approach 490
13-ATOM CLUSTERS - EQUILIBRIUM GEOMETRIES, STRUCTURAL TRANSFORMATIONS, AND TRENDS IN NA, MG, AL, AND SI 176
ATOMIC AND MOLECULAR-HYDROGEN IN GALLIUM-ARSENIDE - A THEORETICAL-STUDY 164
AB-INITIO LATTICE-DYNAMICS OF DIAMOND 163
Ab-initio molecular dynamics study of amorphous CdTeOx alloys: structural properties 159
Carbonyl group generation on single-wall carbon nanotubes with nitric acid: A theoretical description 159
Electron densities and related properties from the ab-initio simulation of crystalline solids 152
VIBRATIONAL PROPERTIES OF ISOLATED ALAS MONOLAYERS EMBEDDED IN GAAS - A THEORETICAL-STUDY OF THE EFFECTS OF DISORDER 151
Structure constants in the Green's function method: a new analytic evaluation 151
C61H2 IN MOLECULAR AND SOLID-PHASES - DENSITY-FUNCTIONAL APPROACH TO STRUCTURAL AND ELECTRONIC-PROPERTIES 150
Advanced capabilities for materials modelling with Quantum ESPRESSO 147
1ST PRINCIPLES CALCULATIONS OF HYDROGEN IN BULK GAAS 146
THE ORDINARY AND MATRIX CONTINUED FRACTIONS IN THE THEORETICAL-ANALYSIS OF HERMITIAN AND RELAXATION OPERATORS 144
EFFECTS OF DISORDER ON THE RAMAN-SPECTRA OF GAAS/ALAS SUPERLATTICES 143
MULTIPLE-SCATTERING APPROACH TO THE PROPAGATION OF ELECTROMAGNETIC-WAVES IN HETEROGENEOUS MEDIA 140
The low frequency vibrational modes of green fluorescent proteins 139
Raman cross section for the pentagonal-pinch mode in buckminsterfullerene C-60 139
THE CLASSICAL AND GENERALIZED MOMENT PROBLEM IN THE THEORY OF RELAXATION 138
SILICON-HYDROGEN-ACCEPTOR COMPLEXES IN CRYSTALLINE SILICON 136
Calculation of Near-Edge X-Ray Absorption Fine Structure at Finite Temperatures: Spectral Signatures of Hydrogen Bond Breaking in Liquid Water 136
Near-edge states induced by hydrogen inclusion in gallium arsenide 135
Adsorption of pairs of NOx molecules on single-wall carbon nanotubes and formation of NO+NO3 from NO2, 134
DFT study of graphene doping due to metal contacts 131
Oxygen adsorption on graphite and nanotubes 130
First-principles codes for Computational Crystallography in the Quantum-ESPRESSO package 130
Theory of hydrogen complexes in Mn(x)Ga(1-x)As dilute magnetic semiconductors 130
Ab initio theoretical investigation of Phthalocyanine-Semiconductor hybrid systems 128
VIBRATIONAL AND DIELECTRIC-PROPERTIES OF C-60 FROM DENSITY-FUNCTIONAL PERTURBATION-THEORY 128
Improved understanding of metal–graphene contacts 128
A FIRST-PRINCIPLES DERIVED PARAMETRIZATION FOR THE ADIABATIC BOND CHARGE MODEL 127
H PASSIVATION OF SI IMPURITIES IN GAAS 127
RELATIONSHIP BETWEEN ELECTRONIC CONDUCTION STATES AND INDIRECT MAGNETIC EXCHANGE 126
Fast hybrid density-functional computations using plane-wave basis sets 126
Positional disorder in ammonia borane at ambient conditions 125
STRUCTURE AND BONDING IN CISPLATIN AND OTHER PT(II) COMPLEXES 125
THEORY OF ELECTRONIC STATES IN LATTICES AND SUPERLATTICES 125
Isolation, structure, and electronic calculations of the heterofullerene salt K6C59N 125
VIBRATIONAL FREQUENCIES OF SI-P-H COMPLEXES IN CRYSTALLINE SILICON - A THEORETICAL-STUDY 125
Defect engineering in III-V ternary alloys: effects of strain and local charge on the formation of substitutional and interstitial native defects 124
TOWARDS VERY LARGE-SCALE ELECTRONIC-STRUCTURE CALCULATIONS 124
Gas adsorption on graphene doped with B, N, Al, S: a theoretical study 124
GROUND-STATE PROPERTIES OF CESIUM DIMERS FROM ABINITIO PSEUDOPOTENTIAL APPROACHES 124
Si(x)C(1-x)O(2) alloys: A possible route to stabilize carbon-based silica-like solids? 122
Effects of strain and local charge on the formation of deep defects in III-V ternary alloys 122
ABSENCE OF METAL-CLUSTERS AND APPEARANCE OF NEW ELECTRON-STATES IN NA6C60 121
Hydrogen-induced states near the GaAs band edges 121
ABINITIO CALCULATION OF PHONON DISPERSIONS IN SEMICONDUCTORS 121
THEORETICAL-ANALYSIS OF THE 3-K MAGNETIC-STRUCTURE AND DISTORTION OF URANIUM-DIOXIDE 119
Reproducibility in density functional theory calculations of solids 119
Comment on: "Noncovalent functionalization of carbon nanotubes by aromatic organic molecules" [ Appl. Phys. Lett. 82, 3746 (2003) ] 118
ELASTIC-CONSTANTS OF CRYSTALS FROM LINEAR-RESPONSE THEORY 118
STRAIN AND ALLOYING EFFECTS ON THE ELECTRONIC AND VIBRATIONAL PROPERTIES OF INYAL1-YAS ON INP 117
Defect engineering in III-V ternary alloys: Effects of strain and local charge on the formation of native deep defects 115
EFFECT OF SYMMETRY AND CORRELATION OF CONDUCTION STATES ON THE INDIRECT MAGNETIC EXCHANGE 114
First-principle molecular dynamics with ultrasoft pseudopotentials: Parallel implementation and application to extended bioinorganic systems 114
Structure, kinetics, and passivation of hydrogen-acceptor complexes in gallium arsenide: A theoretical study 113
Phonons and related crystal properties from density-functional perturbation theory 112
Hybrid Zinc Phthalocyanine/Zinc Oxide System for Photovoltaic devices: a DFT and TD-DFPT Theoretical Investigation 112
Photocatalytic and Photovoltaic Properties of TiO2 Nanoparticles Investigated by Ab Initio Simulations 111
Reconstruction of frozen-core all-electron orbitals from pseudo-orbitals 111
Interfacial engineering of P3HT/ZnO hybrid solar cells using phthalocyanines: A joint theoretical and experimental investigation 111
Core-level shift analysis of amorphous CdTeOx materials 110
STRUCTURAL AND VIBRATIONAL PROPERTIES OF THE SI-H-AL COMPLEX IN CRYSTALLINE SILICON 109
First-Principles Molecular Dynamics 109
Quantum Crystallography: Current Developments and Future Perspectives 109
Density functional theory study of the structure and C-13 chemical shifts of retinylidene iminium salts 108
2ND-ORDER RAMAN-SPECTRA OF DIAMOND FROM AB-INITIO PHONON CALCULATIONS 106
Structural and electronic properties of C60 and C60 derivatives in the solid phases: calculations based on density-functional theory 105
Density-Functional Perturbation Theory 105
Hartree-Fock energy bands in molecular crystals : Solid hydrogen in the cubic phase 105
PHONON SOFTENING AND HIGH-PRESSURE LOW-SYMMETRY PHASES OF CESIUM IODIDE 104
Zinc Oxide-Zinc Phthalocyanine Interface for Hybrid Solar Cells 104
Quantum ESPRESSO: a modular and open-source software project for quantum simulations of materials 102
Quantitative local environment characterization in amorphous oxides 102
Reaction Pathways for Oxygen Evolution Promoted by Cobalt Catalyst 102
LOW-TEMPERATURE STRUCTURES OF C4 AND C10 FROM THE CAR-PARRINELLO METHOD - SINGLET-STATES 102
Anomalous electronic behaviour of Na superfullerides: Theory and experiment 101
Theoretical design of coupled organic-inorganic systems 101
INFRARED REFLECTIVITY BY TRANSVERSE-OPTICAL PHONONS IN (GAAS)M/(ALAS)N ULTRATHIN-LAYER SUPERLATTICES 101
Density-functional perturbation theory for quasi-harmonic calculations 99
PRESSURE-INDUCED STRUCTURAL INSTABILITY OF CESIUM-HALIDES FROM ABINITIO PSEUDOPOTENTIAL TECHNIQUES 96
Vibrational properties of DsRed model chromophores 94
HIGH-PRESSURE LOW-SYMMETRY PHASES OF CESIUM-HALIDES 89
Calculation of Phonon Dispersions on the GRID using Quantum ESPRESSO 89
STRUCTURE AND THERMODYNAMICS OF SIXGE1-X ALLOYS FROM ABINITIO MONTE-CARLO SIMULATIONS 88
A study of Zn induced structural aggregation patterns of beta-amyloid peptides by ab-initio simulations and XAS measurements 88
AMPHOTERIC BEHAVIOR OF H0 IN GAAS 86
Structure and passivation effects of mono- and dihydrogen complexes in GaAsyN(1-y) alloys. 84
Electron correlation effects on the hydrogen passivation of Mn(x)Ga(1-x)As dilute magnetic semiconductors 84
MOLECULAR-STRUCTURE AND CHEMICAL BONDING IN K3C60 AND K6C60 83
A Performance Study of Quantum ESPRESSO’s PWscf Code on Multi-core and GPU Systems 83
Theory of the metal-nonmagnetic Mott-Jahn-Teller insulator transition in A(4)C(60) 82
PHONON-SPECTRA OF ULTRATHIN GAAS/ALAS SUPERLATTICES - AN ABINITIO CALCULATION 80
ISOTOPICALLY RESOLVED RAMAN-SPECTRA OF C-60 80
GREEN-FUNCTION APPROACH TO LINEAR RESPONSE IN SOLIDS 79
Nitrogen passivation by atomic hydrogen in GaAsyN1-y and InxGa1-xAsyN1-y alloys 79
Coordination and Haptotropic Rearrangement of Cr(CO)3 on (n,0) Nanotube Sidewalls: A dynamical Density Functional Study 77
Subvolume A2B "Impurities and Defects in Group IV Elements, IV-IV and III-V Compounds, part B: Group IV-IV and III-V Compounds" 74
The interactions of nitrogen dioxide with graphene-stabilized Rh clusters: a DFT study 72
Unit cell restricted Bloch functions basis for first-principle transport models: Theory and application 70
Totale 11.976
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Categoria #
all - tutte 40.416
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 40.416
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/2020246 0 0 0 0 0 0 0 0 0 0 49 197
2020/20211.610 34 187 55 175 84 192 83 156 256 78 171 139
2021/20221.198 58 74 92 80 56 91 85 64 42 179 200 177
2022/20231.313 156 87 36 203 120 319 36 92 162 26 38 38
2023/2024371 51 35 20 23 54 20 23 41 40 22 11 31
2024/20251.513 29 131 70 66 156 125 95 133 191 220 297 0
Totale 12.769