CIVALLERI, Bartolomeo
 Distribuzione geografica
Continente #
EU - Europa 4.588
NA - Nord America 4.245
AS - Asia 3.829
AF - Africa 252
OC - Oceania 191
SA - Sud America 135
Continente sconosciuto - Info sul continente non disponibili 9
Totale 13.249
Nazione #
US - Stati Uniti d'America 4.044
CN - Cina 1.712
DE - Germania 1.135
IT - Italia 689
GB - Regno Unito 558
RU - Federazione Russa 397
JP - Giappone 369
CZ - Repubblica Ceca 332
IN - India 331
FR - Francia 324
KR - Corea 303
IR - Iran 206
PL - Polonia 192
AU - Australia 175
VN - Vietnam 170
ES - Italia 145
CA - Canada 137
TW - Taiwan 121
NL - Olanda 109
BE - Belgio 102
TR - Turchia 101
HK - Hong Kong 97
IE - Irlanda 87
ID - Indonesia 80
BR - Brasile 79
ZA - Sudafrica 79
DZ - Algeria 67
SG - Singapore 67
UA - Ucraina 60
MX - Messico 57
TH - Thailandia 53
NO - Norvegia 44
RO - Romania 44
SE - Svezia 43
FI - Finlandia 42
PK - Pakistan 41
CH - Svizzera 40
AT - Austria 31
SA - Arabia Saudita 30
DK - Danimarca 29
MY - Malesia 28
PT - Portogallo 27
IL - Israele 26
EG - Egitto 23
GR - Grecia 23
LT - Lituania 22
LV - Lettonia 22
NG - Nigeria 20
AE - Emirati Arabi Uniti 18
ET - Etiopia 18
IQ - Iraq 18
LU - Lussemburgo 17
MA - Marocco 16
AR - Argentina 15
BY - Bielorussia 15
CL - Cile 15
NZ - Nuova Zelanda 15
BG - Bulgaria 14
CO - Colombia 10
HR - Croazia 10
HU - Ungheria 10
BD - Bangladesh 9
PH - Filippine 9
RS - Serbia 9
TN - Tunisia 8
EU - Europa 7
KE - Kenya 7
QA - Qatar 7
VE - Venezuela 7
BW - Botswana 6
JO - Giordania 6
LK - Sri Lanka 6
CU - Cuba 5
SI - Slovenia 5
SK - Slovacchia (Repubblica Slovacca) 5
EC - Ecuador 4
PE - Perù 4
GE - Georgia 3
IS - Islanda 3
KH - Cambogia 3
KZ - Kazakistan 3
MO - Macao, regione amministrativa speciale della Cina 3
NP - Nepal 3
OM - Oman 3
A1 - Anonimo 2
CM - Camerun 2
EE - Estonia 2
SD - Sudan 2
AM - Armenia 1
GH - Ghana 1
HN - Honduras 1
LB - Libano 1
MK - Macedonia 1
PR - Porto Rico 1
RE - Reunion 1
SB - Salomone, isole 1
SN - Senegal 1
SY - Repubblica araba siriana 1
TZ - Tanzania 1
UY - Uruguay 1
Totale 13.249
Città #
Houston 420
Hangzhou 372
Beijing 363
Ann Arbor 268
Fairfield 261
Ashburn 239
Torino 205
Buffalo 154
Seattle 148
Santa Cruz 146
Woodbridge 138
Cambridge 130
Wilmington 120
Wuhan 98
Taipei 96
London 89
Changsha 86
Dong Ket 85
Dublin 79
Guangzhou 75
Tokyo 74
Nanjing 69
Shanghai 69
Nürnberg 68
Milan 67
University Park 57
Chicago 56
Hanoi 54
Mountain View 53
Jakarta 51
Los Angeles 48
San Diego 47
Singapore 45
Paris 42
Turin 42
Warsaw 41
Ottawa 38
Pretoria 37
Council Bluffs 35
Sydney 34
Parsippany 32
Xian 32
Evanston 31
Melbourne 31
Seoul 31
Bengaluru 30
Central District 30
Madrid 30
Central 28
Moscow 28
Chengdu 27
Las Vegas 27
Phoenix 27
Dearborn 26
Helsinki 26
Hyderabad 26
Manchester 26
Barcelona 25
Berlin 25
Boardman 25
Dresden 25
Dallas 24
Leawood 24
New York 24
Tehran 24
Tianjin 24
Toronto 24
Atlanta 23
Minneapolis 23
Shenyang 23
Oslo 22
Zhengzhou 22
Ankara 21
Oxford 21
Hanover 20
Jinan 20
Munich 20
Wroclaw 20
Boulder 19
Chongqing 19
Hefei 19
Nottingham 19
Bonn 18
Istanbul 18
Lake Forest 18
Pisa 18
Leuven 17
Mexico 17
Muizenberg 17
Nanning 17
Polska 17
Redmond 17
Southend 17
Birmingham 16
College Station 16
Nanchang 16
San Jose 16
Waltham 16
Changchun 15
Duncan 15
Totale 5.943
Nome #
Disclosing the complex structure of UiO-66 Metal Organic Framework: a synergic combination of experiment and theory, file e27ce42a-14bd-2581-e053-d805fe0acbaa 1.536
H2 storage in isostructural UiO-67 and UiO-66 MOFs, file e27ce426-d41c-2581-e053-d805fe0acbaa 1.482
Quantum-mechanical condensed matter simulations with CRYSTAL, file e27ce42d-b629-2581-e053-d805fe0acbaa 960
CRYSTAL17, file e27ce42e-941a-2581-e053-d805fe0acbaa 567
Structure and stability of aluminium trihydroxidesbayerite and gibbsite: a quantum mechanical ab initiostudy with the CRYSTAL06 code., file e27ce426-b79a-2581-e053-d805fe0acbaa 509
Identifying the Role of Terahertz Vibrations in Metal-Organic Frameworks: From Gate-Opening Phenomenon to Shear-Driven Structural Destabilization, file e27ce427-0ff0-2581-e053-d805fe0acbaa 480
Fundamental Aspects of H2S Adsorption on CPO-27-Ni, file e27ce426-ff4b-2581-e053-d805fe0acbaa 383
Carbon Dioxide Adsorption in Amine-Functionalized Mixed-Ligand Metal-Organic Frameworks of UiO-66 Topology, file e27ce427-01cd-2581-e053-d805fe0acbaa 383
Design and Characterization of MOFs (Metal-Organic Frameworks) for Innovative Applications, file e27ce42c-6ad6-2581-e053-d805fe0acbaa 355
Detecting Molecular Rotational Dynamics Complementing the Low-Frequency Terahertz Vibrations in a Zirconium-Based Metal-Organic Framework, file e27ce42c-04e7-2581-e053-d805fe0acbaa 341
Identifying the Role of Terahertz Vibrations in Metal-Organic Frameworks: From Gate-Opening Phenomenon to Shear-Driven Structural Destabilization, file e27ce427-0154-2581-e053-d805fe0acbaa 313
CRYSTAL14: A Program for the Ab initio Investigation of Crystalline Solids, file e27ce427-067f-2581-e053-d805fe0acbaa 311
Geometrical Correction for the Inter- and Intramolecular Basis Set Superposition Error in Periodic Density Functional Theory Calculations, file e27ce426-f29b-2581-e053-d805fe0acbaa 307
Communication: A combined periodic density functional and incremental wave-function-based approach for the dispersion-accounting time-resolved dynamics of 4He nanodroplets on surfaces: 4He/graphene, file e27ce427-0153-2581-e053-d805fe0acbaa 250
Range-separated double-hybrid density-functional theory applied to periodic systems, file e27ce428-8a64-2581-e053-d805fe0acbaa 247
Theoretical and Experimental Characterization of Pyrazolato-Based Ni(II) Metal Organic Frameworks, file e27ce426-ed14-2581-e053-d805fe0acbaa 240
Hydrogen storage of Mg–Zn mixed metal borohydrides, file e27ce428-fbf5-2581-e053-d805fe0acbaa 218
Extending and assessing composite electronic structure methods to the solid state, file e27ce42e-dac8-2581-e053-d805fe0acbaa 201
Double-hybrid density-functional theory applied to molecular crystals, file e27ce427-0f65-2581-e053-d805fe0acbaa 196
Cost-Effective Quantum Mechanical Approach for Predicting Thermodynamic and Mechanical Stability of Pure-Silica Zeolites, file e27ce42d-e7b6-2581-e053-d805fe0acbaa 196
Thermodynamic modelling of Mg(BH4)2, file e27ce429-1d44-2581-e053-d805fe0acbaa 189
Exceptionally Low Shear Modulus in a Prototypical Imidazole-Based Metal-Organic Framework, file e27ce426-d5f1-2581-e053-d805fe0acbaa 176
Comment on "Accurate Hartree-Fock energy of extended systems using large Gaussian basis sets", file e27ce426-c009-2581-e053-d805fe0acbaa 175
Exceptionally Low Shear Modulus in a Prototypical Imidazole-Based Metal-Organic Framework, file e27ce426-d5f0-2581-e053-d805fe0acbaa 171
Benchmarking dispersion and geometrical counterpoise corrections for cost-effective large-scale DFT calculations of water adsorption on graphene, file e27ce427-0f63-2581-e053-d805fe0acbaa 157
Structural and Optical Properties of Struvite. Elucidating Structure of Infrared Spectrum in High Frequency Range, file e27ce430-e9af-2581-e053-d805fe0acbaa 156
Ab initio calculation of the crystalline structure and IR spectrum of polymers: Nylon 6 polymorphs, file e27ce426-eefb-2581-e053-d805fe0acbaa 137
Quantum mechanical predictions to elucidate the anisotropic elastic properties of zeolitic imidazolate frameworks: ZIF-4 vs. ZIF-zni, file e27ce427-0691-2581-e053-d805fe0acbaa 137
Understanding and Controlling the Dielectric Response of Metal–Organic Frameworks, file e27ce42d-db48-2581-e053-d805fe0acbaa 135
On the Use of Benchmarks for Multiple Properties, file e27ce42b-34bd-2581-e053-d805fe0acbaa 130
International Winter School Molecules@Surfaces - Book of Abstracts, file e27ce428-7528-2581-e053-d805fe0acbaa 127
Oxalyl Dihydrazide Polymorphism: a Periodic Dispersion-Corrected DFT and MP2 Investigation., file e27ce426-f425-2581-e053-d805fe0acbaa 124
Simulation of nanosizing effects in the decomposition of Ca(BH4)2 through atomistic thin film models, file e27ce431-2848-2581-e053-d805fe0acbaa 117
Effect of Benzoic Acid as a Modulator in the Structure of UiO-66: An Experimental and Computational Study, file e27ce42b-ba9f-2581-e053-d805fe0acbaa 103
Normal Vibrational Analysis of the Syndiotactic Polystyrene s(2/1)2 Helix, file e27ce426-bf99-2581-e053-d805fe0acbaa 95
Ab initio study of van der Waals and hydrogen-bonded molecular crystals with a periodic local-MP2 method, file e27ce426-c84b-2581-e053-d805fe0acbaa 95
Interfacing CRYSTAL/AMBER to optimize QM/MM Lennard–Jones parameters for water and to study solvation of TiO2 nanoparticles, file e27ce42d-d414-2581-e053-d805fe0acbaa 93
Application of Metal-Organic Frameworks and Covalent Organic Frameworks as (Photo)Active Material in Hybrid Photovoltaic Technologies, file e27ce430-7ba1-2581-e053-d805fe0acbaa 90
Electron-density and electrostatic-potential features of orthorhombic chlorine trifluoride, file e27ce426-c847-2581-e053-d805fe0acbaa 81
IR spectroscopy of crystalline polymers from ab initio calculations: Nylon 6,6, file e27ce42a-7eb8-2581-e053-d805fe0acbaa 80
Frontiers in Modeling Metal–Organic Frameworks, file e27ce431-1b16-2581-e053-d805fe0acbaa 80
Detecting Molecular Rotational Dynamics Complementing the Low-Frequency Terahertz Vibrations in a Zirconium-Based Metal-Organic Framework, file e27ce42c-2c75-2581-e053-d805fe0acbaa 78
Thermal properties of molecular crystals through dispersion-corrected quasi-harmonic ab initio calculations: The case of urea, file e27ce428-ba35-2581-e053-d805fe0acbaa 76
Periodic local-MP2 method applied to molecular crystals: Study of solid NH3 and CO2 using extended basis sets, file e27ce426-c00d-2581-e053-d805fe0acbaa 73
Structure-activity relationships of simple molecules adsorbed on CPO-27-Ni Metal-Organic Framework: in situ experiments vs. theory, file e27ce426-dbec-2581-e053-d805fe0acbaa 73
Role of dispersive interactions in the CO adsorption on MgO(001): periodic B3LYP calculations augmented with an empirical dispersion term, file e27ce426-c8cd-2581-e053-d805fe0acbaa 68
Assessment of different quantum mechanical methods for the prediction of structure and cohesive energy of molecular crystals, file e27ce429-ca1d-2581-e053-d805fe0acbaa 65
CRYSPLOT: A new tool to visualize physical and chemical properties of molecules, polymers, surfaces, and crystalline solids, file e27ce434-f1a7-2581-e053-d805fe0acbaa 65
Assessment of Density Functional Approximations for Highly Correlated Oxides: The Case of CeO2 and Ce2O3, file e27ce434-32b3-2581-e053-d805fe0acbaa 63
High-pressure thermo-elastic properties of beryl (Al4Be6Si12O36) from ab initio calculations, and observations about the source of thermal expansion, file e27ce428-fbc5-2581-e053-d805fe0acbaa 61
Probing Dielectric Properties of Metal-Organic Frameworks: MIL-53(Al) as a Model System for Theoretical Predictions and Experimental Measurements via Synchrotron Far- and Mid-Infrared Spectroscopy, file e27ce42c-0686-2581-e053-d805fe0acbaa 48
Metal–Organic Frameworks and Hybrid Materials: From Fundamentals to Applications, file e27ce429-b623-2581-e053-d805fe0acbaa 47
The calculation of the static first and second susceptibilities of crystalline urea: A comparison of Hartree–Fock and density functional theory results obtained with the periodic coupled perturbed Hartree–Fock/Kohn–Sham scheme, file e27ce426-c005-2581-e053-d805fe0acbaa 44
Investigation on the Decomposition Enthalpy of Novel Mixed Mg(1–x)Znx(BH4)2Borohydrides by Means of Periodic DFT Calculations, file e27ce429-134d-2581-e053-d805fe0acbaa 44
Elucidating the Interaction of CO2 in the Giant Metal-Organic Framework MIL-100 through Large-Scale Periodic Ab Initio Modeling, file e27ce42e-dac6-2581-e053-d805fe0acbaa 40
17O-EPR determination of the structure and dynamics of copper single-metal sites in zeolites, file e27ce432-9afe-2581-e053-d805fe0acbaa 39
Elucidating the Drug Release from Metal-Organic Framework Nanocomposites via in Situ Synchrotron Microspectroscopy and Theoretical Modeling, file e27ce431-1b19-2581-e053-d805fe0acbaa 38
Comment on "Accurate Hartree-Fock energy of extended systems using large Gaussian basis sets", file e27ce426-c00a-2581-e053-d805fe0acbaa 37
Gaussian Basis Sets for Crystalline Solids: All-Purpose Basis Set Libraries vs System-Specific Optimizations, file 6a0ef67c-2ab8-49bf-8817-2f5045b70f2a 35
Anisotropic displacement parameters for molecular crystals from periodic Hartree–Fock and density functional theory calculations, file e27ce429-1768-2581-e053-d805fe0acbaa 35
CRYSTAL23, file b1f394f8-9415-4e0d-b8e5-929ba067356d 31
International Winter School Molecules@Surfaces - Book of Abstracts, file e27ce428-7132-2581-e053-d805fe0acbaa 29
Impact of Pressure and Temperature on the Broadband Dielectric Response of the HKUST-1 Metal-Organic Framework, file e27ce431-1614-2581-e053-d805fe0acbaa 29
Communication: A combined periodic density functional and incremental wave-function-based approach for the dispersion-accounting time-resolved dynamics of 4He nanodroplets on surfaces: 4He/graphene, file e27ce427-0ff1-2581-e053-d805fe0acbaa 28
Discovering connections between terahertz vibrations and elasticity underpinning the collective dynamics of the HKUST-1 metal-organic framework, file e27ce431-8ffe-2581-e053-d805fe0acbaa 28
Cost-effective composite methods for large-scale solid-state calculations, file e27ce431-51cd-2581-e053-d805fe0acbaa 27
Mechanisms for Pressure-Induced Isostructural Phase Transitions in EuO, file e27ce432-71e1-2581-e053-d805fe0acbaa 26
Stability vs. reactivity: understanding the adsorption properties of Ni3(BTP)2 by experimental and computational methods, file e27ce429-b44d-2581-e053-d805fe0acbaa 25
Understanding and Controlling the Dielectric Response of Metal–Organic Frameworks, file e27ce434-f996-2581-e053-d805fe0acbaa 23
Elucidating the Interaction of CO2 in the Giant Metal-Organic Framework MIL-100 through Large-Scale Periodic Ab Initio Modeling, file e27ce435-0cff-2581-e053-d805fe0acbaa 23
Thermal properties of molecular crystals through dispersion-corrected quasi-harmonic ab initio calculations: The case of urea, file e27ce433-1772-2581-e053-d805fe0acbaa 19
Stability vs. reactivity: understanding the adsorption properties of Ni3(BTP)2 by experimental and computational methods, file e27ce429-b44e-2581-e053-d805fe0acbaa 16
Isoreticular zirconium-based metal-organic frameworks: Discovering mechanical trends and elastic anomalies controlling chemical structure stability, file e27ce431-5b19-2581-e053-d805fe0acbaa 15
Metal-organic frameworks properties from hybrid density functional approximations, file dc63d5a1-5b5e-48a3-b593-ba8a6d9547b7 14
Cost-effective composite methods for large-scale solid-state calculations, file e27ce434-e6b1-2581-e053-d805fe0acbaa 14
Prediction uncertainty of density functional approximations for properties of crystals with cubic symmetry, file e27ce428-98c2-2581-e053-d805fe0acbaa 13
Geometrical Correction for the Inter- and Intramolecular Basis Set Superposition Error in Periodic Density Functional Theory Calculations, file e27ce426-f29a-2581-e053-d805fe0acbaa 12
Investigation on the Decomposition Enthalpy of Novel Mixed Mg(1–x)Znx(BH4)2Borohydrides by Means of Periodic DFT Calculations, file e27ce427-fcd5-2581-e053-d805fe0acbaa 12
Quasi-Harmonic Lattice Dynamics of a Prototypical Metal–Organic Framework, file e27ce430-4b90-2581-e053-d805fe0acbaa 11
Prediction uncertainty of density functional approximations for properties of crystals with cubic symmetry, file e27ce429-13ac-2581-e053-d805fe0acbaa 10
Disclosing the complex structure of UiO-66 Metal Organic Framework: a synergic combination of experiment and theory, file e27ce42a-14bc-2581-e053-d805fe0acbaa 9
Ab initio calculation of nonlinear optical properties for chiral carbon nanotubes. Second harmonic generation and dc-Pockels effect, file e27ce42c-b252-2581-e053-d805fe0acbaa 9
The Structure of Monomeric Hydroxo-CuII Species in Cu-CHA. A Quantitative Assessment, file d0094a9f-d345-456c-a336-09fb90be7130 8
Gaussian Basis Sets for Crystalline Solids: All-Purpose Basis Set Libraries vs System-Specific Optimizations, file e27ce431-0f64-2581-e053-d805fe0acbaa 8
The unique Raman fingerprint of boron nitride substitution patterns in graphene, file e27ce42b-1c76-2581-e053-d805fe0acbaa 7
Probing Dielectric Properties of Metal-Organic Frameworks: MIL-53(Al) as a Model System for Theoretical Predictions and Experimental Measurements via Synchrotron Far- and Mid-Infrared Spectroscopy, file e27ce433-ce0f-2581-e053-d805fe0acbaa 6
Tunable Fluorescein-Encapsulated Zeolitic Imidazolate Framework-8 Nanoparticles for Solid-State Lighting, file e27ce434-9ee9-2581-e053-d805fe0acbaa 6
Synthesis, Crystal Structure, and Photocatalytic Properties of Two Isoreticular Ce(IV)-MOFs with an Infinite Rod-Shaped Inorganic Building Unit, file eb5df885-f1fa-41fa-a2b0-63bc22ece93f 5
A Multimodal Study on the Unique Sensing Behavior of a Guest@Metal-Organic Framework Material for the Detection of Volatile Acetone, file b56bc9c8-1697-4423-8956-a62dbec075a0 4
Disclosing the complex structure of UiO-66 Metal Organic Framework: a synergic combination of experiment and theory, file e27ce426-c313-2581-e053-d805fe0acbaa 4
Theoretical and experimental study on Mg(BH4) 2-Zn(BH4)2 mixed borohydrides, file e27ce427-d9ac-2581-e053-d805fe0acbaa 4
Theoretical and experimental study on Mg(BH4) 2-Zn(BH4)2 mixed borohydrides, file e27ce429-1d41-2581-e053-d805fe0acbaa 4
Probing Dielectric Properties of Metal-Organic Frameworks: MIL-53(Al) as a Model System for Theoretical Predictions and Experimental Measurements via Synchrotron Far- and Mid-Infrared Spectroscopy, file e27ce42c-36d6-2581-e053-d805fe0acbaa 4
Extending and assessing composite electronic structure methods to the solid state, file e27ce434-de0a-2581-e053-d805fe0acbaa 4
Fundamental Aspects of H2S Adsorption on CPO-27-Ni, file e27ce426-ff4c-2581-e053-d805fe0acbaa 3
Assessment of different quantum mechanical methods for the prediction of structure and cohesive energy of molecular crystals, file e27ce429-cb6b-2581-e053-d805fe0acbaa 3
CRYSPLOT: A new tool to visualize physical and chemical properties of molecules, polymers, surfaces, and crystalline solids, file e27ce42e-d931-2581-e053-d805fe0acbaa 3
A Fresh Look at a Well-Known Solid: Structure, Vibrational Spectra, and Formation Energy of NaNH2, file 0dd36b81-250c-4582-8f69-70c9d4d0f811 2
Unlocking Diabetic Acetone Vapor Detection by A Portable Metal-Organic Framework-Based Turn-On Optical Sensor Device, file 61430318-3153-4c3c-bbf2-109633fb2ae8 2
Geometrical Correction for the Inter- and Intramolecular Basis Set Superposition Error in Periodic Density Functional Theory Calculations, file e27ce426-ffe4-2581-e053-d805fe0acbaa 2
Totale 13.654
Categoria #
all - tutte 19.435
article - articoli 0
book - libri 0
conference - conferenze 1
curatela - curatele 0
other - altro 0
patent - brevetti 0
selected - selezionate 0
volume - volumi 0
Totale 19.436


Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2018/2019576 0 0 0 0 0 0 0 0 0 162 207 207
2019/20201.903 230 188 127 187 160 166 133 146 157 158 108 143
2020/20211.881 134 153 114 111 135 129 194 163 171 153 206 218
2021/20222.726 206 147 181 448 380 181 216 192 193 132 280 170
2022/20232.535 132 147 297 264 233 245 324 258 250 228 134 23
2023/2024335 25 21 42 30 34 33 57 49 19 25 0 0
Totale 13.687