IRIS
GIANNOZZI, Paolo
 Distribuzione geografica
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Continente #
NA - Nord America 9.552
AS - Asia 2.868
EU - Europa 2.330
SA - Sud America 534
AF - Africa 61
Continente sconosciuto - Info sul continente non disponibili 6
OC - Oceania 3
Totale 15.354
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Nazione #
US - Stati Uniti d'America 9.444
SG - Singapore 1.419
CN - Cina 635
UA - Ucraina 622
BR - Brasile 454
IE - Irlanda 297
HK - Hong Kong 289
DE - Germania 285
IT - Italia 258
FI - Finlandia 214
SE - Svezia 210
VN - Vietnam 210
RU - Federazione Russa 147
TR - Turchia 102
GB - Regno Unito 97
KR - Corea 83
CA - Canada 76
PT - Portogallo 70
AR - Argentina 35
FR - Francia 30
IN - India 28
BD - Bangladesh 16
EC - Ecuador 16
TG - Togo 16
ZA - Sudafrica 16
BE - Belgio 13
IQ - Iraq 12
MX - Messico 12
PL - Polonia 12
SA - Arabia Saudita 12
AT - Austria 11
NL - Olanda 10
ES - Italia 9
JP - Giappone 9
ID - Indonesia 8
RS - Serbia 8
CO - Colombia 7
MA - Marocco 7
IR - Iran 6
JO - Giordania 6
BG - Bulgaria 5
CH - Svizzera 5
CL - Cile 5
EG - Egitto 5
EU - Europa 5
LT - Lituania 5
PK - Pakistan 5
PY - Paraguay 5
RO - Romania 5
TW - Taiwan 5
VE - Venezuela 5
KE - Kenya 4
PE - Perù 4
AE - Emirati Arabi Uniti 3
CZ - Repubblica Ceca 3
DO - Repubblica Dominicana 3
EE - Estonia 3
HN - Honduras 3
JM - Giamaica 3
TN - Tunisia 3
TT - Trinidad e Tobago 3
UZ - Uzbekistan 3
AL - Albania 2
BB - Barbados 2
GR - Grecia 2
KG - Kirghizistan 2
KZ - Kazakistan 2
MO - Macao, regione amministrativa speciale della Cina 2
MW - Malawi 2
UY - Uruguay 2
AO - Angola 1
AU - Australia 1
AZ - Azerbaigian 1
BA - Bosnia-Erzegovina 1
BN - Brunei Darussalam 1
BO - Bolivia 1
BW - Botswana 1
BY - Bielorussia 1
CD - Congo 1
CG - Congo 1
CR - Costa Rica 1
DK - Danimarca 1
DZ - Algeria 1
GT - Guatemala 1
HT - Haiti 1
HU - Ungheria 1
IL - Israele 1
KW - Kuwait 1
LB - Libano 1
LK - Sri Lanka 1
LU - Lussemburgo 1
LV - Lettonia 1
ML - Mali 1
NP - Nepal 1
NZ - Nuova Zelanda 1
OM - Oman 1
PA - Panama 1
PR - Porto Rico 1
PW - Palau 1
SK - Slovacchia (Repubblica Slovacca) 1
Totale 15.347
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Città #
Woodbridge 1.537
Ann Arbor 1.086
Houston 1.036
Fairfield 1.031
Ashburn 662
Singapore 598
Chandler 498
Jacksonville 455
Seattle 424
Wilmington 410
Beijing 356
Cambridge 347
Dublin 297
Hong Kong 286
Dearborn 220
Boardman 161
Princeton 110
Los Angeles 95
Izmir 92
Buffalo 91
Hefei 77
Seoul 75
Udine 72
Dong Ket 64
Ottawa 58
San Diego 56
Ho Chi Minh City 54
Porto 51
Dallas 47
Des Moines 46
Leesburg 34
São Paulo 32
Hanoi 31
Milan 28
Trieste 27
Ogden 24
Norwalk 22
New York 18
Lomé 16
Rio de Janeiro 16
Nanjing 14
Redondo Beach 14
Brussels 13
Frankfurt am Main 13
Guangzhou 13
Phoenix 13
Falls Church 12
Nuremberg 12
Warsaw 12
Johannesburg 11
Kunming 11
Mumbai 11
Brasília 10
Lappeenranta 10
San Francisco 10
The Dalles 10
Brooklyn 9
Salvador 9
Bologna 8
Campinas 8
Chicago 8
Grafing 8
Guimarães 8
Helsinki 8
Póvoa de Varzim 8
Riyadh 8
San Michele al Tagliamento 8
Vienna 8
Belgrade 7
Gatteo 7
London 7
Modena 7
Amman 6
Ankara 6
Belluno 6
Belo Horizonte 6
Changsha 6
Curitiba 6
Denver 6
Falkenstein 6
Indiana 6
Moscow 6
Parma 6
Quito 6
Shanghai 6
Shenyang 6
Tokyo 6
Toronto 6
Amsterdam 5
Baghdad 5
Boston 5
Caserta 5
Chengdu 5
Columbus 5
Fortaleza 5
Goiânia 5
Hangzhou 5
Jinan 5
Montreal 5
Orem 5
Totale 11.111
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Nome #
Investigation of structural, electronic and magnetic properties of breathing metal-organic framework MIL-47(Mn): A first principles approach 509
13-ATOM CLUSTERS - EQUILIBRIUM GEOMETRIES, STRUCTURAL TRANSFORMATIONS, AND TRENDS IN NA, MG, AL, AND SI 215
AB-INITIO LATTICE-DYNAMICS OF DIAMOND 206
ATOMIC AND MOLECULAR-HYDROGEN IN GALLIUM-ARSENIDE - A THEORETICAL-STUDY 195
Ab-initio molecular dynamics study of amorphous CdTeOx alloys: structural properties 188
Carbonyl group generation on single-wall carbon nanotubes with nitric acid: A theoretical description 185
Advanced capabilities for materials modelling with Quantum ESPRESSO 181
1ST PRINCIPLES CALCULATIONS OF HYDROGEN IN BULK GAAS 181
C61H2 IN MOLECULAR AND SOLID-PHASES - DENSITY-FUNCTIONAL APPROACH TO STRUCTURAL AND ELECTRONIC-PROPERTIES 178
Electron densities and related properties from the ab-initio simulation of crystalline solids 172
VIBRATIONAL PROPERTIES OF ISOLATED ALAS MONOLAYERS EMBEDDED IN GAAS - A THEORETICAL-STUDY OF THE EFFECTS OF DISORDER 169
Calculation of Near-Edge X-Ray Absorption Fine Structure at Finite Temperatures: Spectral Signatures of Hydrogen Bond Breaking in Liquid Water 166
THE ORDINARY AND MATRIX CONTINUED FRACTIONS IN THE THEORETICAL-ANALYSIS OF HERMITIAN AND RELAXATION OPERATORS 165
DFT study of graphene doping due to metal contacts 165
Structure constants in the Green's function method: a new analytic evaluation 164
Adsorption of pairs of NOx molecules on single-wall carbon nanotubes and formation of NO+NO3 from NO2, 162
A FIRST-PRINCIPLES DERIVED PARAMETRIZATION FOR THE ADIABATIC BOND CHARGE MODEL 158
EFFECTS OF DISORDER ON THE RAMAN-SPECTRA OF GAAS/ALAS SUPERLATTICES 158
Ab initio theoretical investigation of Phthalocyanine-Semiconductor hybrid systems 158
Raman cross section for the pentagonal-pinch mode in buckminsterfullerene C-60 157
THE CLASSICAL AND GENERALIZED MOMENT PROBLEM IN THE THEORY OF RELAXATION 156
ABSENCE OF METAL-CLUSTERS AND APPEARANCE OF NEW ELECTRON-STATES IN NA6C60 155
Fast hybrid density-functional computations using plane-wave basis sets 155
MULTIPLE-SCATTERING APPROACH TO THE PROPAGATION OF ELECTROMAGNETIC-WAVES IN HETEROGENEOUS MEDIA 154
H PASSIVATION OF SI IMPURITIES IN GAAS 153
Theory of hydrogen complexes in Mn(x)Ga(1-x)As dilute magnetic semiconductors 153
Improved understanding of metal–graphene contacts 153
The low frequency vibrational modes of green fluorescent proteins 152
TOWARDS VERY LARGE-SCALE ELECTRONIC-STRUCTURE CALCULATIONS 152
SILICON-HYDROGEN-ACCEPTOR COMPLEXES IN CRYSTALLINE SILICON 151
Near-edge states induced by hydrogen inclusion in gallium arsenide 150
THEORY OF ELECTRONIC STATES IN LATTICES AND SUPERLATTICES 148
First-principles codes for Computational Crystallography in the Quantum-ESPRESSO package 147
Hybrid Zinc Phthalocyanine/Zinc Oxide System for Photovoltaic devices: a DFT and TD-DFPT Theoretical Investigation 145
Oxygen adsorption on graphite and nanotubes 144
STRUCTURE AND BONDING IN CISPLATIN AND OTHER PT(II) COMPLEXES 144
VIBRATIONAL AND DIELECTRIC-PROPERTIES OF C-60 FROM DENSITY-FUNCTIONAL PERTURBATION-THEORY 144
Si(x)C(1-x)O(2) alloys: A possible route to stabilize carbon-based silica-like solids? 143
Positional disorder in ammonia borane at ambient conditions 142
RELATIONSHIP BETWEEN ELECTRONIC CONDUCTION STATES AND INDIRECT MAGNETIC EXCHANGE 142
Gas adsorption on graphene doped with B, N, Al, S: a theoretical study 142
Hydrogen-induced states near the GaAs band edges 140
ABINITIO CALCULATION OF PHONON DISPERSIONS IN SEMICONDUCTORS 140
First-principle molecular dynamics with ultrasoft pseudopotentials: Parallel implementation and application to extended bioinorganic systems 140
VIBRATIONAL FREQUENCIES OF SI-P-H COMPLEXES IN CRYSTALLINE SILICON - A THEORETICAL-STUDY 140
Defect engineering in III-V ternary alloys: effects of strain and local charge on the formation of substitutional and interstitial native defects 139
Isolation, structure, and electronic calculations of the heterofullerene salt K6C59N 139
GROUND-STATE PROPERTIES OF CESIUM DIMERS FROM ABINITIO PSEUDOPOTENTIAL APPROACHES 138
Quantum Crystallography: Current Developments and Future Perspectives 138
2ND-ORDER RAMAN-SPECTRA OF DIAMOND FROM AB-INITIO PHONON CALCULATIONS 137
Reconstruction of frozen-core all-electron orbitals from pseudo-orbitals 136
THEORETICAL-ANALYSIS OF THE 3-K MAGNETIC-STRUCTURE AND DISTORTION OF URANIUM-DIOXIDE 136
Core-level shift analysis of amorphous CdTeOx materials 135
Effects of strain and local charge on the formation of deep defects in III-V ternary alloys 135
Defect engineering in III-V ternary alloys: Effects of strain and local charge on the formation of native deep defects 134
First-Principles Molecular Dynamics 133
Reproducibility in density functional theory calculations of solids 133
Density-Functional Perturbation Theory 132
Zinc Oxide-Zinc Phthalocyanine Interface for Hybrid Solar Cells 132
STRAIN AND ALLOYING EFFECTS ON THE ELECTRONIC AND VIBRATIONAL PROPERTIES OF INYAL1-YAS ON INP 131
ELASTIC-CONSTANTS OF CRYSTALS FROM LINEAR-RESPONSE THEORY 131
Phonons and related crystal properties from density-functional perturbation theory 129
Structure, kinetics, and passivation of hydrogen-acceptor complexes in gallium arsenide: A theoretical study 128
Density functional theory study of the structure and C-13 chemical shifts of retinylidene iminium salts 128
Photocatalytic and Photovoltaic Properties of TiO2 Nanoparticles Investigated by Ab Initio Simulations 127
EFFECT OF SYMMETRY AND CORRELATION OF CONDUCTION STATES ON THE INDIRECT MAGNETIC EXCHANGE 127
Anomalous electronic behaviour of Na superfullerides: Theory and experiment 127
Quantitative local environment characterization in amorphous oxides 127
Interfacial engineering of P3HT/ZnO hybrid solar cells using phthalocyanines: A joint theoretical and experimental investigation 127
Comment on: "Noncovalent functionalization of carbon nanotubes by aromatic organic molecules" [ Appl. Phys. Lett. 82, 3746 (2003) ] 126
Structural and electronic properties of C60 and C60 derivatives in the solid phases: calculations based on density-functional theory 125
INFRARED REFLECTIVITY BY TRANSVERSE-OPTICAL PHONONS IN (GAAS)M/(ALAS)N ULTRATHIN-LAYER SUPERLATTICES 125
STRUCTURAL AND VIBRATIONAL PROPERTIES OF THE SI-H-AL COMPLEX IN CRYSTALLINE SILICON 124
Reaction Pathways for Oxygen Evolution Promoted by Cobalt Catalyst 122
Vibrational properties of DsRed model chromophores 120
PHONON SOFTENING AND HIGH-PRESSURE LOW-SYMMETRY PHASES OF CESIUM IODIDE 119
LOW-TEMPERATURE STRUCTURES OF C4 AND C10 FROM THE CAR-PARRINELLO METHOD - SINGLET-STATES 119
Quantum ESPRESSO: a modular and open-source software project for quantum simulations of materials 118
Hartree-Fock energy bands in molecular crystals : Solid hydrogen in the cubic phase 118
PRESSURE-INDUCED STRUCTURAL INSTABILITY OF CESIUM-HALIDES FROM ABINITIO PSEUDOPOTENTIAL TECHNIQUES 116
Coordination and Haptotropic Rearrangement of Cr(CO)3 on (n,0) Nanotube Sidewalls: A dynamical Density Functional Study 115
Calculation of Phonon Dispersions on the GRID using Quantum ESPRESSO 115
A study of Zn induced structural aggregation patterns of beta-amyloid peptides by ab-initio simulations and XAS measurements 114
Density-functional perturbation theory for quasi-harmonic calculations 114
Theoretical design of coupled organic-inorganic systems 112
A Performance Study of Quantum ESPRESSO’s PWscf Code on Multi-core and GPU Systems 112
HIGH-PRESSURE LOW-SYMMETRY PHASES OF CESIUM-HALIDES 109
Nitrogen passivation by atomic hydrogen in GaAsyN1-y and InxGa1-xAsyN1-y alloys 108
AMPHOTERIC BEHAVIOR OF H0 IN GAAS 107
Subvolume A2B "Impurities and Defects in Group IV Elements, IV-IV and III-V Compounds, part B: Group IV-IV and III-V Compounds" 106
Structure and passivation effects of mono- and dihydrogen complexes in GaAsyN(1-y) alloys. 102
STRUCTURE AND THERMODYNAMICS OF SIXGE1-X ALLOYS FROM ABINITIO MONTE-CARLO SIMULATIONS 100
MOLECULAR-STRUCTURE AND CHEMICAL BONDING IN K3C60 AND K6C60 100
Theory of the metal-nonmagnetic Mott-Jahn-Teller insulator transition in A(4)C(60) 100
Unit cell restricted Bloch functions basis for first-principle transport models: Theory and application 98
PHONON-SPECTRA OF ULTRATHIN GAAS/ALAS SUPERLATTICES - AN ABINITIO CALCULATION 97
Electron correlation effects on the hydrogen passivation of Mn(x)Ga(1-x)As dilute magnetic semiconductors 97
Engineering of metal-MoS2 contacts to overcome Fermi level pinning 97
Molecular electrostatics and pKa shifts calculations with the Generalized Born model. A tutorial through examples with Bluues2 95
GREEN-FUNCTION APPROACH TO LINEAR RESPONSE IN SOLIDS 94
Totale 14.120
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Categoria #
all - tutte 50.656
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 50.656
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/20211.075 0 0 0 0 0 192 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
2024/20252.149 29 131 70 66 156 125 95 133 191 220 341 592
2025/20262.068 307 358 404 367 557 75 0 0 0 0 0 0
Totale 15.473