IRIS
GIANNOZZI, Paolo
 Distribuzione geografica
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Continente #
NA - Nord America 8.934
EU - Europa 2.001
AS - Asia 762
AF - Africa 21
Continente sconosciuto - Info sul continente non disponibili 5
SA - Sud America 4
Totale 11.727
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Nazione #
US - Stati Uniti d'America 8.868
UA - Ucraina 617
SG - Singapore 309
IE - Irlanda 292
CN - Cina 255
DE - Germania 253
FI - Finlandia 209
SE - Svezia 205
IT - Italia 183
TR - Turchia 94
RU - Federazione Russa 81
GB - Regno Unito 75
CA - Canada 65
VN - Vietnam 65
FR - Francia 18
PT - Portogallo 17
TG - Togo 16
BE - Belgio 13
PL - Polonia 7
CH - Svizzera 5
EU - Europa 5
HK - Hong Kong 5
IR - Iran 5
KR - Corea 5
SA - Arabia Saudita 5
TW - Taiwan 5
BG - Bulgaria 4
ES - Italia 4
NL - Olanda 4
RS - Serbia 4
JP - Giappone 3
RO - Romania 3
ZA - Sudafrica 3
AE - Emirati Arabi Uniti 2
AT - Austria 2
BR - Brasile 2
EE - Estonia 2
IN - India 2
KG - Kirghizistan 2
MO - Macao, regione amministrativa speciale della Cina 2
PK - Pakistan 2
AL - Albania 1
AR - Argentina 1
CL - Cile 1
CR - Costa Rica 1
EG - Egitto 1
GR - Grecia 1
LT - Lituania 1
MA - Marocco 1
TM - Turkmenistan 1
Totale 11.727
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Città #
Woodbridge 1.537
Ann Arbor 1.086
Houston 1.033
Fairfield 1.031
Ashburn 534
Chandler 498
Jacksonville 453
Seattle 424
Wilmington 410
Cambridge 347
Dublin 292
Singapore 260
Dearborn 220
Boardman 161
Beijing 124
Princeton 110
Izmir 91
Udine 65
Dong Ket 64
Ottawa 58
San Diego 56
Des Moines 46
Leesburg 34
Ogden 24
Norwalk 22
Hefei 18
Milan 17
Lomé 16
Nanjing 14
Porto 14
Trieste 14
Brussels 13
Falls Church 12
Kunming 11
Guangzhou 9
Grafing 8
Lappeenranta 8
Phoenix 8
Gatteo 7
Warsaw 7
Indiana 6
New York 6
Parma 6
Shenyang 6
Toronto 6
Caserta 5
Changsha 5
Chengdu 5
Frankfurt am Main 5
Helsinki 5
Jinan 5
Los Angeles 5
Modena 5
Moscow 5
Riyadh 5
San Francisco 5
Shanghai 5
Washington 5
Belgrade 4
Hangzhou 4
Hebei 4
Ningbo 4
Redmond 4
Sofia 4
Tappahannock 4
Zurich 4
Alfena 3
Andover 3
Auburn Hills 3
Burgos 3
Chicago 3
Fontanafredda 3
Incheon 3
Johannesburg 3
London 3
Minamikasai 3
Redwood City 3
Santa Clara 3
Taipei 3
Verona 3
Bishkek 2
Codroipo 2
Dallas 2
Dubna 2
Fuzhou 2
Hong Kong 2
Kowloon City 2
Maltepe 2
Martignacco 2
Nanchang 2
Rome 2
Tallinn 2
Torino 2
Vienna 2
Wuhan 2
Amsterdam 1
Ankara 1
Ashgabat 1
Atlanta 1
Baotou 1
Totale 9.360
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Nome #
Investigation of structural, electronic and magnetic properties of breathing metal-organic framework MIL-47(Mn): A first principles approach 481
13-ATOM CLUSTERS - EQUILIBRIUM GEOMETRIES, STRUCTURAL TRANSFORMATIONS, AND TRENDS IN NA, MG, AL, AND SI 165
ATOMIC AND MOLECULAR-HYDROGEN IN GALLIUM-ARSENIDE - A THEORETICAL-STUDY 155
AB-INITIO LATTICE-DYNAMICS OF DIAMOND 155
Ab-initio molecular dynamics study of amorphous CdTeOx alloys: structural properties 152
Carbonyl group generation on single-wall carbon nanotubes with nitric acid: A theoretical description 151
Electron densities and related properties from the ab-initio simulation of crystalline solids 148
Structure constants in the Green's function method: a new analytic evaluation 145
VIBRATIONAL PROPERTIES OF ISOLATED ALAS MONOLAYERS EMBEDDED IN GAAS - A THEORETICAL-STUDY OF THE EFFECTS OF DISORDER 143
C61H2 IN MOLECULAR AND SOLID-PHASES - DENSITY-FUNCTIONAL APPROACH TO STRUCTURAL AND ELECTRONIC-PROPERTIES 141
Advanced capabilities for materials modelling with Quantum ESPRESSO 138
1ST PRINCIPLES CALCULATIONS OF HYDROGEN IN BULK GAAS 138
Raman cross section for the pentagonal-pinch mode in buckminsterfullerene C-60 136
EFFECTS OF DISORDER ON THE RAMAN-SPECTRA OF GAAS/ALAS SUPERLATTICES 135
The low frequency vibrational modes of green fluorescent proteins 133
Near-edge states induced by hydrogen inclusion in gallium arsenide 131
SILICON-HYDROGEN-ACCEPTOR COMPLEXES IN CRYSTALLINE SILICON 131
THE CLASSICAL AND GENERALIZED MOMENT PROBLEM IN THE THEORY OF RELAXATION 130
MULTIPLE-SCATTERING APPROACH TO THE PROPAGATION OF ELECTROMAGNETIC-WAVES IN HETEROGENEOUS MEDIA 130
Adsorption of pairs of NOx molecules on single-wall carbon nanotubes and formation of NO+NO3 from NO2, 130
Calculation of Near-Edge X-Ray Absorption Fine Structure at Finite Temperatures: Spectral Signatures of Hydrogen Bond Breaking in Liquid Water 127
First-principles codes for Computational Crystallography in the Quantum-ESPRESSO package 126
Oxygen adsorption on graphite and nanotubes 125
THE ORDINARY AND MATRIX CONTINUED FRACTIONS IN THE THEORETICAL-ANALYSIS OF HERMITIAN AND RELAXATION OPERATORS 125
H PASSIVATION OF SI IMPURITIES IN GAAS 123
VIBRATIONAL AND DIELECTRIC-PROPERTIES OF C-60 FROM DENSITY-FUNCTIONAL PERTURBATION-THEORY 123
Defect engineering in III-V ternary alloys: effects of strain and local charge on the formation of substitutional and interstitial native defects 121
TOWARDS VERY LARGE-SCALE ELECTRONIC-STRUCTURE CALCULATIONS 121
DFT study of graphene doping due to metal contacts 121
VIBRATIONAL FREQUENCIES OF SI-P-H COMPLEXES IN CRYSTALLINE SILICON - A THEORETICAL-STUDY 121
A FIRST-PRINCIPLES DERIVED PARAMETRIZATION FOR THE ADIABATIC BOND CHARGE MODEL 120
RELATIONSHIP BETWEEN ELECTRONIC CONDUCTION STATES AND INDIRECT MAGNETIC EXCHANGE 120
THEORY OF ELECTRONIC STATES IN LATTICES AND SUPERLATTICES 120
Isolation, structure, and electronic calculations of the heterofullerene salt K6C59N 120
Positional disorder in ammonia borane at ambient conditions 119
Gas adsorption on graphene doped with B, N, Al, S: a theoretical study 119
GROUND-STATE PROPERTIES OF CESIUM DIMERS FROM ABINITIO PSEUDOPOTENTIAL APPROACHES 119
Effects of strain and local charge on the formation of deep defects in III-V ternary alloys 118
Improved understanding of metal–graphene contacts 118
Hydrogen-induced states near the GaAs band edges 117
STRUCTURE AND BONDING IN CISPLATIN AND OTHER PT(II) COMPLEXES 117
Si(x)C(1-x)O(2) alloys: A possible route to stabilize carbon-based silica-like solids? 117
Ab initio theoretical investigation of Phthalocyanine-Semiconductor hybrid systems 117
Reproducibility in density functional theory calculations of solids 117
ABSENCE OF METAL-CLUSTERS AND APPEARANCE OF NEW ELECTRON-STATES IN NA6C60 115
ELASTIC-CONSTANTS OF CRYSTALS FROM LINEAR-RESPONSE THEORY 114
THEORETICAL-ANALYSIS OF THE 3-K MAGNETIC-STRUCTURE AND DISTORTION OF URANIUM-DIOXIDE 113
ABINITIO CALCULATION OF PHONON DISPERSIONS IN SEMICONDUCTORS 113
STRAIN AND ALLOYING EFFECTS ON THE ELECTRONIC AND VIBRATIONAL PROPERTIES OF INYAL1-YAS ON INP 112
Theory of hydrogen complexes in Mn(x)Ga(1-x)As dilute magnetic semiconductors 112
Comment on: "Noncovalent functionalization of carbon nanotubes by aromatic organic molecules" [ Appl. Phys. Lett. 82, 3746 (2003) ] 110
Defect engineering in III-V ternary alloys: Effects of strain and local charge on the formation of native deep defects 109
Structure, kinetics, and passivation of hydrogen-acceptor complexes in gallium arsenide: A theoretical study 108
Interfacial engineering of P3HT/ZnO hybrid solar cells using phthalocyanines: A joint theoretical and experimental investigation 108
EFFECT OF SYMMETRY AND CORRELATION OF CONDUCTION STATES ON THE INDIRECT MAGNETIC EXCHANGE 107
Reconstruction of frozen-core all-electron orbitals from pseudo-orbitals 107
Photocatalytic and Photovoltaic Properties of TiO2 Nanoparticles Investigated by Ab Initio Simulations 106
Phonons and related crystal properties from density-functional perturbation theory 106
Hybrid Zinc Phthalocyanine/Zinc Oxide System for Photovoltaic devices: a DFT and TD-DFPT Theoretical Investigation 106
First-principle molecular dynamics with ultrasoft pseudopotentials: Parallel implementation and application to extended bioinorganic systems 105
Core-level shift analysis of amorphous CdTeOx materials 105
Density functional theory study of the structure and C-13 chemical shifts of retinylidene iminium salts 105
Hartree-Fock energy bands in molecular crystals : Solid hydrogen in the cubic phase 104
STRUCTURAL AND VIBRATIONAL PROPERTIES OF THE SI-H-AL COMPLEX IN CRYSTALLINE SILICON 103
First-Principles Molecular Dynamics 103
Density-Functional Perturbation Theory 100
Structural and electronic properties of C60 and C60 derivatives in the solid phases: calculations based on density-functional theory 99
Theoretical design of coupled organic-inorganic systems 99
Quantitative local environment characterization in amorphous oxides 99
Fast hybrid density-functional computations using plane-wave basis sets 99
2ND-ORDER RAMAN-SPECTRA OF DIAMOND FROM AB-INITIO PHONON CALCULATIONS 98
PHONON SOFTENING AND HIGH-PRESSURE LOW-SYMMETRY PHASES OF CESIUM IODIDE 98
Reaction Pathways for Oxygen Evolution Promoted by Cobalt Catalyst 97
LOW-TEMPERATURE STRUCTURES OF C4 AND C10 FROM THE CAR-PARRINELLO METHOD - SINGLET-STATES 97
Quantum ESPRESSO: a modular and open-source software project for quantum simulations of materials 96
Zinc Oxide-Zinc Phthalocyanine Interface for Hybrid Solar Cells 96
Anomalous electronic behaviour of Na superfullerides: Theory and experiment 95
INFRARED REFLECTIVITY BY TRANSVERSE-OPTICAL PHONONS IN (GAAS)M/(ALAS)N ULTRATHIN-LAYER SUPERLATTICES 95
Density-functional perturbation theory for quasi-harmonic calculations 91
PRESSURE-INDUCED STRUCTURAL INSTABILITY OF CESIUM-HALIDES FROM ABINITIO PSEUDOPOTENTIAL TECHNIQUES 89
Vibrational properties of DsRed model chromophores 89
Quantum Crystallography: Current Developments and Future Perspectives 89
A study of Zn induced structural aggregation patterns of beta-amyloid peptides by ab-initio simulations and XAS measurements 84
HIGH-PRESSURE LOW-SYMMETRY PHASES OF CESIUM-HALIDES 82
STRUCTURE AND THERMODYNAMICS OF SIXGE1-X ALLOYS FROM ABINITIO MONTE-CARLO SIMULATIONS 81
Calculation of Phonon Dispersions on the GRID using Quantum ESPRESSO 80
Electron correlation effects on the hydrogen passivation of Mn(x)Ga(1-x)As dilute magnetic semiconductors 79
AMPHOTERIC BEHAVIOR OF H0 IN GAAS 78
A Performance Study of Quantum ESPRESSO’s PWscf Code on Multi-core and GPU Systems 78
Theory of the metal-nonmagnetic Mott-Jahn-Teller insulator transition in A(4)C(60) 77
Structure and passivation effects of mono- and dihydrogen complexes in GaAsyN(1-y) alloys. 76
PHONON-SPECTRA OF ULTRATHIN GAAS/ALAS SUPERLATTICES - AN ABINITIO CALCULATION 75
ISOTOPICALLY RESOLVED RAMAN-SPECTRA OF C-60 75
GREEN-FUNCTION APPROACH TO LINEAR RESPONSE IN SOLIDS 73
MOLECULAR-STRUCTURE AND CHEMICAL BONDING IN K3C60 AND K6C60 73
Coordination and Haptotropic Rearrangement of Cr(CO)3 on (n,0) Nanotube Sidewalls: A dynamical Density Functional Study 71
The interactions of nitrogen dioxide with graphene-stabilized Rh clusters: a DFT study 68
Subvolume A2B "Impurities and Defects in Group IV Elements, IV-IV and III-V Compounds, part B: Group IV-IV and III-V Compounds" 67
Nitrogen passivation by atomic hydrogen in GaAsyN1-y and InxGa1-xAsyN1-y alloys 58
Coverage-dependent adsorption of CH3S and (CH3S)(2) on Au(111): A density functional theory study 57
Totale 11.288
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Categoria #
all - tutte 34.963
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 34.963
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/20201.763 0 0 0 0 0 433 287 333 237 227 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
2024/2025575 29 131 70 66 156 123 0 0 0 0 0 0
Totale 11.831