BLOINO, JULIEN ROLAND MICHEL
 Distribuzione geografica
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Continente #
NA - Nord America 8.578
EU - Europa 6.116
AS - Asia 5.445
SA - Sud America 831
AF - Africa 146
Continente sconosciuto - Info sul continente non disponibili 11
OC - Oceania 6
Totale 21.133
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Nazione #
US - Stati Uniti d'America 8.410
RU - Federazione Russa 1.726
SG - Singapore 1.571
IT - Italia 1.465
CN - Cina 1.366
IE - Irlanda 718
KR - Corea 618
BR - Brasile 617
SE - Svezia 596
VN - Vietnam 484
HK - Hong Kong 405
DE - Germania 361
UA - Ucraina 294
TR - Turchia 287
GB - Regno Unito 248
FR - Francia 201
IN - India 154
FI - Finlandia 101
CA - Canada 95
CH - Svizzera 77
AT - Austria 76
BD - Bangladesh 67
JP - Giappone 67
IQ - Iraq 66
ID - Indonesia 64
AR - Argentina 63
PK - Pakistan 60
PL - Polonia 47
BE - Belgio 44
ZA - Sudafrica 44
MX - Messico 42
NL - Olanda 40
ES - Italia 38
PH - Filippine 35
CO - Colombia 34
VE - Venezuela 30
SA - Arabia Saudita 27
CL - Cile 25
EC - Ecuador 23
JO - Giordania 23
MY - Malesia 22
KE - Kenya 19
MA - Marocco 17
PE - Perù 16
TN - Tunisia 16
UZ - Uzbekistan 16
IR - Iran 15
PY - Paraguay 13
AE - Emirati Arabi Uniti 12
CZ - Repubblica Ceca 11
DZ - Algeria 10
EU - Europa 10
EG - Egitto 9
ET - Etiopia 9
IL - Israele 9
JM - Giamaica 9
OM - Oman 9
AZ - Azerbaigian 8
RO - Romania 8
BY - Bielorussia 7
KZ - Kazakistan 7
LT - Lituania 7
NP - Nepal 7
AL - Albania 6
PT - Portogallo 6
DK - Danimarca 5
LV - Lettonia 5
NO - Norvegia 5
PA - Panama 5
PS - Palestinian Territory 5
TW - Taiwan 5
AU - Australia 4
BH - Bahrain 4
BO - Bolivia 4
CI - Costa d'Avorio 4
CR - Costa Rica 4
GE - Georgia 4
HU - Ungheria 4
KG - Kirghizistan 4
SY - Repubblica araba siriana 4
NG - Nigeria 3
NI - Nicaragua 3
SN - Senegal 3
TH - Thailandia 3
UY - Uruguay 3
AD - Andorra 2
BA - Bosnia-Erzegovina 2
BG - Bulgaria 2
CY - Cipro 2
DO - Repubblica Dominicana 2
HN - Honduras 2
KH - Cambogia 2
LB - Libano 2
LK - Sri Lanka 2
LU - Lussemburgo 2
ME - Montenegro 2
NE - Niger 2
NZ - Nuova Zelanda 2
QA - Qatar 2
RE - Reunion 2
Totale 21.098
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Città #
Ashburn 1.272
Dallas 895
Singapore 835
Chandler 735
Dublin 717
San Jose 702
Pisa 666
Seoul 611
Jacksonville 549
Moscow 532
Boardman 428
Hong Kong 370
New York 273
Beijing 228
Hefei 224
Wilmington 216
Los Angeles 214
The Dalles 192
Ann Arbor 188
Izmir 164
Boston 158
Milan 149
Scuola 140
Millbury 135
Ho Chi Minh City 113
Kent 106
Dong Ket 103
Hanoi 95
Lauterbourg 94
Istanbul 92
Bremen 91
Council Bluffs 89
Lawrence 83
Chicago 80
San Mateo 80
Santa Clara 79
Vienna 71
Mestre 63
Bern 61
Ogden 61
Orem 61
São Paulo 59
Tokyo 56
Woodbridge 56
Washington 53
Munich 49
Guangzhou 47
Voghera 46
Brussels 42
Montreal 42
Columbus 41
Seattle 40
North Bergen 39
Helsinki 38
Warsaw 38
Chennai 37
Jakarta 37
Düsseldorf 36
San Paolo di Civitate 35
London 33
Buffalo 31
Princeton 31
Shanghai 29
Amsterdam 27
Baghdad 26
Johannesburg 26
Lahore 26
Frankfurt am Main 25
Stockholm 25
Denver 24
Wuhan 24
Toronto 23
Poplar 22
Rio de Janeiro 22
Salt Lake City 22
Brooklyn 20
Dearborn 20
Vimodrone 20
Amman 19
Cesano Boscone 19
Houston 18
Da Nang 17
Falls Church 17
Berlin 16
Las Vegas 16
Manchester 16
Nairobi 16
Orsay 16
Rome 16
Hangzhou 15
Livorno 15
Medellín 15
Mumbai 15
Phoenix 15
Tashkent 15
Haiphong 14
Kuala Lumpur 14
Belo Horizonte 13
Brasília 13
Elk Grove Village 13
Totale 13.625
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Nome #
Accurate Vibrational-Rotational Parameters and Infrared Intensities of 1-Bromo-1-fluoroethene: A Joint Experimental Analysis and Ab Initio Study 386
Accurate molecular structures and infrared spectra of trans-2,3-dideuterooxirane, methyloxirane, and trans-2,3-dimethyloxirane 303
An integrated experimental and quantum-chemical investigation on the vibrational spectra of chlorofluoromethane 301
A fully automated implementation of VPT2 infrared intensities 291
Accurate Quantum Chemical Spectroscopic Characterization of Glycolic Acid: A Route Toward its Astrophysical Detection 290
Accuracy and Reliability in the Simulation of Vibrational Spectra: A Comprehensive Benchmark of Energies and Intensities Issuing From Generalized Vibrational Perturbation Theory to Second Order (GVPT2) 286
Development of a Virtual Spectrometer for Chiroptical Spectroscopies: The Case of Nicotine 284
General formulation of vibronic spectroscopy in internal coordinates 281
A general time-dependent route to Resonance-Raman spectroscopy including Franck-Condon, Herzberg-Teller and Duschinsky effects 281
Rotational and Infrared Spectroscopy of Ethanimine: A Route toward Its Astrophysical and Planetary Detection 278
Accurate rest frequencies for propargylamine in the ground and low-lying vibrational states 271
New developments of a multifrequency virtual spectrometer: stereo-electronic, dynamical, and environmental effects on chiroptical spectra 266
Modulation of π character upon complexation captured by molecular rotation spectra 266
A Modern-Fortran Program for Chemical Kinetics on Top of Anharmonic Vibrational Calculations 265
Stereoelectronic, Vibrational, and Environmental Contributions to Polarizabilities of Large Molecular Systems: A Feasible Anharmonic Protocol 260
Interplay of stereo-electronic, vibronic and environmental effects in tuning the chiroptical properties of an Ir(III) cyclometalated N-heterocyclic carbene 260
Accurate Simulation of Resonance-Raman Spectra of Flexible Molecules: An Internal Coordinates Approach 259
General Perturb-Then-Diagonalize Model for the Vibrational Frequencies and Intensities of Molecules Belonging to Abelian and Non-Abelian Symmetry Groups 258
Accuracy and Interpretability: The Devil and the Holy Grail. New Routes across Old Boundaries in Computational Spectroscopy 247
Accurate ground and excited state studies for molecular systems of biological interest. 244
Environmental and dynamical effects on the optical properties of molecular systems by time-independent and time-dependent approaches: Coumarin derivatives as test cases 243
Effective Inclusion of Mechanical and Electrical Anharmonicity in Excited Electronic States: VPT2-TDDFT Route 243
A Robust and Effective Time-Independent Route to the Calculation of Resonance Raman Spectra of Large Molecules in Condensed Phases with the Inclusion of Duschinsky, Herzberg–Teller, Anharmonic, and Environmental Effects 240
Ferrocenes with simple chiral substituents: An in-depth theoretical and experimental VCD and ECD study 240
Computational simulation of vibrationally resolved spectra for spin-forbidden transitions 237
Accurate structure, thermodynamics, and spectroscopy of medium-sized radicals by hybrid coupled cluster/density functional theory approaches: The case of phenyl radical 232
Erratum: The Italian national project of astrobiology-life in space-origin, presence, persistence of life in space, from molecules to extremophiles (Astrobiology (2020) 20:5 (580-582) DOI: 10.1089/ast.2020.2247) 232
General Time Dependent Approach to Vibronic Spectroscopy Including Franck–Condon, Herzberg–Teller, and Duschinsky Effects 225
Towards and Accurate Description of Anharmonic Infrared Spectra in Solution within the Polarizable Continuum Model: Reaction Field, Cavity Field and Nonequilibrium Effects 224
Toward the design of alkynylimidazole fluorophores: computational and experimental characterization of spectroscopic features in solution and in poly(methyl methacrylate) 224
The Italian National Project of Astrobiology - Life in Space - Origin, Presence, Persistence of Life in Space, from Molecules to Extremophiles 223
Toward Fully Unsupervised Anharmonic Computations Complementing Experiment for Robust and Reliable Assignment and Interpretation of IR and VCD Spectra from Mid-IR to NIR: The Case of 2,3-Butanediol and trans-1,2-Cyclohexanediol 221
A second-order perturbation theory route to vibrational averages and transition properties of molecules: general formulation and application to infrared and vibrational circular dichroism spectroscopies 220
Computational challenges in Astrochemistry 218
Temperature Dependence of Radiative and Nonradiative Rates from Time-Dependent Correlation Function Methods 217
CC/DFT Route toward Accurate Structures and Spectroscopic Features for Observed and Elusive Conformers of Flexible Molecules: Pyruvic Acid as a Case Study 216
A VPT2 route to near-infrared spectroscopy: The role of mechanical and electrical anharmonicity 214
Theoretical Investigation of the Circularly Polarized Luminescence of a Chiral Boron Dipyrromethene (BODIPY) Dye 212
Unraveling the internal conversion process within the Q-bands of a chlorophyll-like-system through surface-hopping molecular dynamics simulations 210
Toward an Accurate Modeling of Optical Rotation for Solvated Systems: Anharmonic Vibrational Contributions Coupled to the Polarizable Continuum Model 209
Absorption and Emission UV-Vis spectra of the TRITC fluorophore molecule in solution: a quantum mechanical study 208
Fully anharmonic IR and Raman spectra of medium-size molecular systems: Accuracy and interpretation 208
Generalized vibrational perturbation theory for rotovibrational energies of linear, symmetric and asymmetric tops: Theory, approximations, and automated approaches to deal with medium-to-large molecular systems 203
Accurate yet feasible computations of resonance Raman spectra for metal complexes in solution: [Ru(bpy)3]2+ as a case study 203
Benchmarking TD-DFT against vibrationally resolved absorption spectra at room temperature: 7-aminocoumarins as test cases 202
Implementation and validation of a multi-purpose virtual spectrophotometer for large systems in complex environments 201
Accounting for Molecular Flexibility in Photoionization: Case of tert-Butyl Hydroperoxide 201
General perturbative approach for spectroscopy, thermodynamics and kinetics: methodological background and benchmark studies 199
A Multifrequency Virtual Spectrometer for Complex Bio-Organic Systems: Vibronic and Environmental Effects on the UV/Vis Spectrum of Chlorophyll a 199
An Effective and Automated Processing of Resonances in Vibrational Perturbation Theory Applied to Spectroscopy 197
Vibronic coupling investigation to compute phosphorescence spectra of Pt(II) complexes 197
Reliable vibrational wavenumbers for C=O and N-H stretchings of isolated and hydrogen-bonded nucleic acid bases 195
Environmental and complexation effects on the structures and spectroscopic signatures of organic pigments relevant to cultural heritage: the case of alizarin and alizarin–Mg(ii)/Al(iii) complexes 195
Mid-IR and CH stretching vibrational circular dichroism spectroscopy to distinguish various sources of chirality: The case of quinophaneoxazoline based ruthenium(II) complexes 194
ORG/CTC-KN-01 Bridging the Gap between Theory and Experiment: Modeling Chiroptical Properties and Spectroscopies 194
On the simulation of vibrationally resolved electronic spectra of medium-size molecules: The case of styryl substituted BODIPYs 191
Circular dichroism and optical rotation of lactamide and 2-aminopropanol in aqueous solution 191
Synthesis and Optical Properties of Imidazole-Based Fluorophores having High Quantum Yields 190
Harmonic and anharmonic vibrational frequency calculations with the double-hybrid B2PLYP method. Analytic second derivatives and benchmark studies 188
Integrated computational approaches for spectroscopic studies of molecular systems in the gas phase and in solution: Pyrimidine as a test case 186
Time-Dependent Formulation of Resonance Raman Optical Activity Spectroscopy 184
ACCURATE SPECTROSCOPIC CHARACTERIZATION OF OXIRANE: A VALUABLE ROUTE TO ITS IDENTIFICATION IN TITAN'S ATMOSPHERE AND THE ASSIGNMENT OF UNIDENTIFIED INFRARED BANDS 183
Vibrational circular dichroism under the quantum magnifying glass: from the electronic flow to the spectroscopic observable 181
Tuning of NMR and EPR parameters by vibrational averaging and environmental effects: an integrated computational approach 180
Anharmonic Effects on Vibrational Spectra Intensities: Infrared, Raman, Vibrational Circular Dichroism, and Raman Optical Activity 177
Scaling-up VPT2: a feasible route to include anharmonic correction on large molecules 176
Perturb-Then-Diagonalize Vibrational Engine Exploiting Curvilinear Internal Coordinates 175
Aiming at an accurate prediction of vibrational and electronic spectra for medium-to-large molecules: An overview 175
Validation of the DFT/N07D computational model on the magnetic, vibrational and electronic properties of vinyl radical 173
Simulation of Vibronic Spectra of Flexible Systems: Hybrid DVR-Harmonic Approaches 173
Simulation of theoretical IR spectra for complex molecular systems from vibrational perturbative approaches: glycine as a test case 171
Role of specific solute-solvent interactions on the photophysical properties of distyryl substituted BODIPY derivatives 171
Toward ab-initio Anharmonic Vibrational Circular Dichroism Spectra in Condensed Phase 170
Effective method for the computation of optical spectra of large molecules at finite temperature including the Duschinsky and Herzberg–Teller effect: The Qx band of porphyrin as a case study 168
First principle simulation of vibrationally resolved A2 B1←X2 A1 electronic transition of phenyl radical 167
Multipolar symmetric squaraines with large two-photon absorption cross-sections in the NIR region 166
Vibronic Effects on Rates of Excitation Energy Transfer and Their Temperature Dependence 166
Anharmonic Aspects in Vibrational Circular Dichroism Spectra from 900 to 9000 cm−1 for Methyloxirane and Methylthiirane Published as part of The Journal of Physical Chemistry virtual special issue "Vincenzo Barone Festschrift" 164
Anharmonic vibrational Raman optical activity of methyloxirane : theory and experiment pushed to the limits 162
Effective method to compute Franck-Condon integrals for optical spectra of large molecules in solution 161
Integrated computational approach to vibrationally resolved electronic spectra: anisole as a test case 161
Spectroscopic Characterization of Key Aromatic and Heterocyclic Molecules: A Route toward the Origin of Life 161
Noncovalent Interactions in the Gas Phase: The Anisole–Phenol Complex 159
Chapter 8. Time-independent Approaches to Simulate Electronic Spectra Lineshapes: From Small Molecules to Macrosystems 156
Prediction of Molecular Properties for Systems of Biological Interests 156
Reliable Structural, Thermodynamic, and Spectroscopic Properties of Organic Molecules Adsorbed on Silicon Surfaces from Computational Modeling: the Case of Glycine@Si(100) 154
General approach to compute vibrationally resolved one-photon electronic spectra 154
Combination of Resonance and Non-Resonance Chiral Raman Scattering in a Cobalt(III) Complex 152
High Resolution Electronic Spectroscopy of the Anisole Dimer in a Molecular Beam: Equilibrium Structure of a Complex Stabilized by the Stacking Interaction 152
Erratum: “Towards an accurate description of anharmonic infrared spectra in solution within the polarizable continuum model: Reaction field, cavity field and nonequilibrium effects” [J. Chem. Phys. 135, 104505 (2011)] 152
State-of-the-art computation of the rotational and IR spectra of the methyl-cyclopropyl cation: Hints on its detection in space 152
Theoretical multilevel approach for studying the photophysical properties of organic dyes in solution 151
Matrix-isolation and cryosolution-VCD spectra of α-pinene as benchmark for anharmonic vibrational spectra calculations 150
Harmonic and anharmonic vibrational computations for biomolecular building blocks: Benchmarking DFT and basis sets by theoretical and experimental IR spectrum of glycine conformers 149
Fully Integrated Approach to Compute Vibrationally Resolved Optical Spectra: From Small Molecules to Macrosystems 149
Anharmonicity Effects in the Vibrational CD Spectra of Propylene Oxide 149
Erratum: "Effective method to compute Franck-Condon integrals for optical spectra of large molecules in solution" [J. Chem. Phys. 126, 084509 (2007)] 147
Toward anharmonic computations of vibrational spectra for large molecular systems 146
Ultraviolet resonance Raman spectroscopy of anthracene: Experiment and theory 145
Pushing measurements and interpretation of VCD spectra in the IR, NIR and visible ranges to the detectability and computational complexity limits 144
Totale 20.501
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Categoria #
all - tutte 96.875
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 96.875
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/2021474 0 0 0 0 0 0 0 0 0 237 47 190
2021/2022878 41 5 19 46 71 33 19 95 57 94 35 363
2022/20233.415 234 305 196 276 198 347 2 732 969 25 77 54
2023/20241.218 129 39 114 21 73 382 47 50 108 83 17 155
2024/20253.875 173 81 150 249 503 114 119 215 870 259 538 604
2025/20269.438 822 718 1.269 1.016 715 429 1.672 631 1.465 701 0 0
Totale 21.398