BLOINO, JULIEN ROLAND MICHEL
 Distribuzione geografica
Continente #
NA - Nord America 3.808
EU - Europa 3.474
AS - Asia 684
Continente sconosciuto - Info sul continente non disponibili 10
SA - Sud America 10
AF - Africa 4
OC - Oceania 1
Totale 7.991
Nazione #
US - Stati Uniti d'America 3.795
IT - Italia 1.166
IE - Irlanda 716
SE - Svezia 575
CN - Cina 337
UA - Ucraina 273
DE - Germania 253
TR - Turchia 168
GB - Regno Unito 129
VN - Vietnam 103
CH - Svizzera 74
FI - Finlandia 69
AT - Austria 63
BE - Belgio 40
RU - Federazione Russa 34
FR - Francia 24
JP - Giappone 20
PK - Pakistan 14
CA - Canada 11
EU - Europa 10
IR - Iran 10
CZ - Repubblica Ceca 8
ES - Italia 8
NL - Olanda 8
IN - India 7
BR - Brasile 5
NO - Norvegia 5
PL - Polonia 5
PT - Portogallo 5
RO - Romania 5
SG - Singapore 5
CL - Cile 4
KR - Corea 4
TW - Taiwan 3
AD - Andorra 2
DK - Danimarca 2
HK - Hong Kong 2
HU - Ungheria 2
NG - Nigeria 2
SA - Arabia Saudita 2
AL - Albania 1
AZ - Azerbaigian 1
BG - Bulgaria 1
CY - Cipro 1
EE - Estonia 1
EG - Egitto 1
ID - Indonesia 1
IL - Israele 1
IM - Isola di Man 1
JO - Giordania 1
KE - Kenya 1
LI - Liechtenstein 1
LK - Sri Lanka 1
LV - Lettonia 1
MD - Moldavia 1
ME - Montenegro 1
MX - Messico 1
MY - Malesia 1
NZ - Nuova Zelanda 1
PA - Panama 1
PE - Perù 1
PH - Filippine 1
UZ - Uzbekistan 1
Totale 7.991
Città #
Chandler 735
Dublin 716
Pisa 626
Jacksonville 548
Ashburn 271
Wilmington 210
New York 196
Ann Arbor 188
Izmir 162
Boston 144
Scuola 140
Millbury 135
Boardman 108
Dong Ket 103
Bremen 91
Lawrence 83
San Mateo 80
Milan 69
Mestre 63
Vienna 63
Bern 61
Ogden 61
Woodbridge 56
Washington 51
Voghera 46
Brussels 38
Beijing 37
Düsseldorf 36
Seattle 36
Guangzhou 35
San Paolo di Civitate 35
Princeton 31
Wuhan 23
Helsinki 21
Dearborn 20
Shanghai 19
Falls Church 17
Las Vegas 15
Tokyo 15
Berlin 14
Fairfield 13
Redmond 13
Saint Petersburg 13
Chicago 11
Hefei 11
Stuttgart 11
Jiaxing 10
Kunming 10
Nanjing 9
Padova 9
Jinan 8
Lahore 8
Merced 8
Rome 8
San Giuliano Terme 7
Wuxi 7
Bologna 6
Brescia 6
Edinburgh 6
Houston 6
Irkutsk 6
London 6
Norwalk 6
Busto Arsizio 5
Hangzhou 5
Kocaeli 5
Meldola 5
Paris 5
San Diego 5
Toronto 5
Yiwu 5
Zurich 5
Andover 4
Bucharest 4
Cambridge 4
Chengdu 4
Coimbra 4
Dallas 4
Florence 4
Islamabad 4
Madrid 4
Montreal 4
Naples 4
Prague 4
Redwood City 4
San Francisco 4
Shenzhen 4
Stockholm 4
São Paulo 4
Trento 4
Tromsø 4
Auburn Hills 3
Clearwater 3
Ferrara 3
Hanover 3
Hebei 3
Hsinchu 3
Jinhua 3
Los Angeles 3
Marburg 3
Totale 5.744
Nome #
Accurate Vibrational-Rotational Parameters and Infrared Intensities of 1-Bromo-1-fluoroethene: A Joint Experimental Analysis and Ab Initio Study 187
Rotational and Infrared Spectroscopy of Ethanimine: A Route toward Its Astrophysical and Planetary Detection 141
General formulation of vibronic spectroscopy in internal coordinates 138
A general time-dependent route to Resonance-Raman spectroscopy including Franck-Condon, Herzberg-Teller and Duschinsky effects 134
An integrated experimental and quantum-chemical investigation on the vibrational spectra of chlorofluoromethane 130
Environmental and dynamical effects on the optical properties of molecular systems by time-independent and time-dependent approaches: Coumarin derivatives as test cases 128
Stereoelectronic, Vibrational, and Environmental Contributions to Polarizabilities of Large Molecular Systems: A Feasible Anharmonic Protocol 126
Accurate molecular structures and infrared spectra of trans-2,3-dideuterooxirane, methyloxirane, and trans-2,3-dimethyloxirane 124
Development of a Virtual Spectrometer for Chiroptical Spectroscopies: The Case of Nicotine 123
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 121
General Time Dependent Approach to Vibronic Spectroscopy Including Franck–Condon, Herzberg–Teller, and Duschinsky Effects 117
Synthesis and Optical Properties of Imidazole-Based Fluorophores having High Quantum Yields 115
Accurate ground and excited state studies for molecular systems of biological interest. 111
New developments of a multifrequency virtual spectrometer: stereo-electronic, dynamical, and environmental effects on chiroptical spectra 111
General perturbative approach for spectroscopy, thermodynamics and kinetics: methodological background and benchmark studies 110
Interplay of stereo-electronic, vibronic and environmental effects in tuning the chiroptical properties of an Ir(III) cyclometalated N-heterocyclic carbene 109
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 107
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 106
ORG/CTC-KN-01 Bridging the Gap between Theory and Experiment: Modeling Chiroptical Properties and Spectroscopies 105
Harmonic and anharmonic vibrational frequency calculations with the double-hybrid B2PLYP method. Analytic second derivatives and benchmark studies 103
A fully automated implementation of VPT2 infrared intensities 101
Validation of the DFT/N07D computational model on the magnetic, vibrational and electronic properties of vinyl radical 99
A Modern-Fortran Program for Chemical Kinetics on Top of Anharmonic Vibrational Calculations 98
Effective method to compute Franck-Condon integrals for optical spectra of large molecules in solution 96
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 96
Simulation of theoretical IR spectra for complex molecular systems from vibrational perturbative approaches: glycine as a test case 95
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) 94
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 92
Toward ab-initio Anharmonic Vibrational Circular Dichroism Spectra in Condensed Phase 92
Ferrocenes with simple chiral substituents: An in-depth theoretical and experimental VCD and ECD study 91
Absorption and Emission UV-Vis spectra of the TRITC fluorophore molecule in solution: a quantum mechanical study 90
Anharmonic Effects on Vibrational Spectra Intensities: Infrared, Raman, Vibrational Circular Dichroism, and Raman Optical Activity 89
Multipolar symmetric squaraines with large two-photon absorption cross-sections in the NIR region 88
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)] 88
Implementation and validation of a multi-purpose virtual spectrophotometer for large systems in complex environments 88
Integrated computational approach to vibrationally resolved electronic spectra: anisole as a test case 86
Effective Inclusion of Mechanical and Electrical Anharmonicity in Excited Electronic States: VPT2-TDDFT Route 86
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) 86
General approach to compute vibrationally resolved one-photon electronic spectra 84
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 84
General Perturb-Then-Diagonalize Model for the Vibrational Frequencies and Intensities of Molecules Belonging to Abelian and Non-Abelian Symmetry Groups 84
The Italian National Project of Astrobiology - Life in Space - Origin, Presence, Persistence of Life in Space, from Molecules to Extremophiles 84
Chapter 8. Time-independent Approaches to Simulate Electronic Spectra Lineshapes: From Small Molecules to Macrosystems 83
ACCURATE SPECTROSCOPIC CHARACTERIZATION OF OXIRANE: A VALUABLE ROUTE TO ITS IDENTIFICATION IN TITAN'S ATMOSPHERE AND THE ASSIGNMENT OF UNIDENTIFIED INFRARED BANDS 83
Integrated computational approaches for spectroscopic studies of molecular systems in the gas phase and in solution: Pyrimidine as a test case 83
Aiming at an accurate prediction of vibrational and electronic spectra for medium-to-large molecules: An overview 83
Fully Integrated Approach to Compute Vibrationally Resolved Optical Spectra: From Small Molecules to Macrosystems 82
Towards and Accurate Description of Anharmonic Infrared Spectra in Solution within the Polarizable Continuum Model: Reaction Field, Cavity Field and Nonequilibrium Effects 82
Accurate Simulation of Resonance-Raman Spectra of Flexible Molecules: An Internal Coordinates Approach 82
Theoretical multilevel approach for studying the photophysical properties of organic dyes in solution 81
Tuning of NMR and EPR parameters by vibrational averaging and environmental effects: an integrated computational approach 81
First principle simulation of vibrationally resolved A2 B1←X2 A1 electronic transition of phenyl radical 80
Benchmarking TD-DFT against vibrationally resolved absorption spectra at room temperature: 7-aminocoumarins as test cases 80
A VPT2 route to near-infrared spectroscopy: The role of mechanical and electrical anharmonicity 79
Unraveling the internal conversion process within the Q-bands of a chlorophyll-like-system through surface-hopping molecular dynamics simulations 79
Toward an Accurate Modeling of Optical Rotation for Solvated Systems: Anharmonic Vibrational Contributions Coupled to the Polarizable Continuum Model 78
High Resolution Electronic Spectroscopy of the Anisole Dimer in a Molecular Beam: Equilibrium Structure of a Complex Stabilized by the Stacking Interaction 77
Computational simulation of vibrationally resolved spectra for spin-forbidden transitions 77
Toward anharmonic computations of vibrational spectra for large molecular systems 76
Reliable vibrational wavenumbers for C=O and N-H stretchings of isolated and hydrogen-bonded nucleic acid bases 76
Vibronic Effects on Rates of Excitation Energy Transfer and Their Temperature Dependence 75
Prediction of Molecular Properties for Systems of Biological Interests 75
Accurate Quantum Chemical Spectroscopic Characterization of Glycolic Acid: A Route Toward its Astrophysical Detection 75
Erratum: "Effective method to compute Franck-Condon integrals for optical spectra of large molecules in solution" [J. Chem. Phys. 126, 084509 (2007)] 74
Fluorescence spectra of organic dyes in solution: a time dependent multilevel approach 74
Accurate structure, thermodynamics, and spectroscopy of medium-sized radicals by hybrid coupled cluster/density functional theory approaches: The case of phenyl radical 74
Reliable Structural, Thermodynamic, and Spectroscopic Properties of Organic Molecules Adsorbed on Silicon Surfaces from Computational Modeling: the Case of Glycine@Si(100) 73
Noncovalent Interactions in the Gas Phase: The Anisole–Phenol Complex 73
Vibrational circular dichroism under the quantum magnifying glass: from the electronic flow to the spectroscopic observable 72
Computational challenges in Astrochemistry 72
Modulation of π character upon complexation captured by molecular rotation spectra 72
Temperature Dependence of Radiative and Nonradiative Rates from Time-Dependent Correlation Function Methods 72
Toward the design of alkynylimidazole fluorophores: computational and experimental characterization of spectroscopic features in solution and in poly(methyl methacrylate) 71
Fully anharmonic IR and Raman spectra of medium-size molecular systems: Accuracy and interpretation 71
Anharmonicity Effects in the Vibrational CD Spectra of Propylene Oxide 70
Simulation of Vibronic Spectra of Flexible Systems: Hybrid DVR-Harmonic Approaches 70
Accurate rest frequencies for propargylamine in the ground and low-lying vibrational states 70
Theoretical Investigation of the Circularly Polarized Luminescence of a Chiral Boron Dipyrromethene (BODIPY) Dye 69
State-of-the-art computation of the rotational and IR spectra of the methyl-cyclopropyl cation: Hints on its detection in space 68
Time-Dependent Formulation of Resonance Raman Optical Activity Spectroscopy 67
Accurate yet feasible computations of resonance Raman spectra for metal complexes in solution: [Ru(bpy)3]2+ as a case study 67
A Multifrequency Virtual Spectrometer for Complex Bio-Organic Systems: Vibronic and Environmental Effects on the UV/Vis Spectrum of Chlorophyll a 66
Vibronic coupling investigation to compute phosphorescence spectra of Pt(II) complexes 65
Circular dichroism and optical rotation of lactamide and 2-aminopropanol in aqueous solution 60
Role of specific solute-solvent interactions on the photophysical properties of distyryl substituted BODIPY derivatives 59
CC/DFT Route toward Accurate Structures and Spectroscopic Features for Observed and Elusive Conformers of Flexible Molecules: Pyruvic Acid as a Case Study 57
Ultraviolet resonance Raman spectroscopy of anthracene: Experiment and theory 55
Accuracy and Interpretability: The Devil and the Holy Grail. New Routes across Old Boundaries in Computational Spectroscopy 53
On the simulation of vibrationally resolved electronic spectra of medium-size molecules: The case of styryl substituted BODIPYs 49
Accounting for Molecular Flexibility in Photoionization: Case of tert-Butyl Hydroperoxide 48
Unusual binary aggregates of perylene bisimide revealed by their electronic transitions in helium nanodroplets and DFT calculations 42
The vibrational CD spectra of propylene oxide in liquid xenon: a proof-of-principle CryoVCD study that challenges theory 41
Spectroscopic Characterization of Key Aromatic and Heterocyclic Molecules: A Route toward the Origin of Life 37
null 28
An Effective and Automated Processing of Resonances in Vibrational Perturbation Theory Applied to Spectroscopy 26
Matrix-isolation and cryosolution-VCD spectra of α-pinene as benchmark for anharmonic vibrational spectra calculations 25
null 23
Anharmonic vibrational Raman optical activity of methyloxirane : theory and experiment pushed to the limits 20
Scissor-like Face to Face π-πStacking : A Surprising Preference Induced by the Isocyano Group in the Self-Assembled Dimer of Phenyl Isocyanide 19
Perturb-Then-Diagonalize Vibrational Engine Exploiting Curvilinear Internal Coordinates 15
Totale 8.171
Categoria #
all - tutte 38.448
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 38.448


Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/2020565 52 66 2 10 70 17 123 25 70 16 107 7
2020/20211.120 93 31 137 20 93 47 82 94 49 237 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
2024/2025131 131 0 0 0 0 0 0 0 0 0 0 0
Totale 8.216