http://www.cnr.it/ontology/cnr/individuo/unitaDiPersonaleInterno/MATRICOLA14513
JULIEN BLOINO
- Type
- Label
- JULIEN BLOINO (literal)
- JULIEN BLOINO (literal)
- Persona in rapporto
- Autore CNR di
- Robust and user-friendly models beyond the harmonic level of theory for vibrational spectroscopy (Comunicazione a convegno) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1303)
- An integrated experimental and quantum-chemical investigation on the vibrational spectra of chlorofluoromethane (Articolo in rivista) (Prodotto della ricerca)
- Accurate structure, thermodynamic and spectroscopic parameters from CC and CC/DFT schemes: the challenge of the conformational equilibrium in glycine (Articolo in rivista) (Prodotto della ricerca)
- Fully anharmonic IR and Raman spectra of medium-size molecular systems: accuracy and interpretation (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Development of a Virtual Spectrometer for Chiroptical Spectroscopies: The Case of Nicotine (Articolo in rivista) (Prodotto della ricerca)
- Synthesis and Optical Properties of Imidazole-Based Fluorophores having High Quantum Yields (Articolo in rivista) (Prodotto della ricerca)
- Role of Host-Guest Interactions in Tuning the Optical Properties of Coumarin Derivatives Incorporated in MCM-41: A TD-DFT Investigation (Articolo in rivista) (Prodotto della ricerca)
- Circular Dichroism and Optical Rotation of Lactamide and 2-Aminopropanol in Aqueous Solution (Articolo in rivista) (Prodotto della ricerca)
- Accurate molecular structures and infrared spectra of trans-2,3-dideuterooxirane, methyloxirane, and trans-2,3-dimethyloxirane (Articolo in rivista) (Prodotto della ricerca)
- Accurate structure, thermodynamics, and spectroscopy of medium-sized radicals by hybrid coupled cluster/density functional theory approaches: The case of phenyl radical (Articolo in rivista) (Prodotto della ricerca)
- A Multifrequency Virtual Spectrometer for Complex Bio-Organic Systems: Vibronic and Environmental Effects on the UV/Vis Spectrum of Chlorophyll a (Articolo in rivista) (Prodotto della ricerca)
- Anharmonicity effects in the vibrational CD spectra of propylene oxide (Articolo in rivista) (Prodotto della ricerca)
- ACCURATE SPECTROSCOPIC CHARACTERIZATION OF OXIRANE: A VALUABLE ROUTE TO ITS IDENTIFICATION IN TITAN'S ATMOSPHERE AND THE ASSIGNMENT OF UNIDENTIFIED INFRARED BANDS (Articolo in rivista) (Prodotto della ricerca)
- Toward anharmonic computations of vibrational spectra for large molecular systems (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- 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 (Articolo in rivista) (Prodotto della ricerca)
- Fully ab initio IR spectra for complex molecular systems from perturbative vibrational approaches: Glycine as a test case (Articolo in rivista) (Prodotto della ricerca)
- 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 (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Environmental and dynamical effects on the optical properties of molecular systems by time-independent and time-dependent approaches: Coumarin derivatives as test cases (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Integrated computational approaches for spectroscopic studies of molecular systems in the gas phase and in solution: pyrimidine as a test case (Articolo in rivista) (Prodotto della ricerca)
- General Time Dependent Approach to Vibronic Spectroscopy Including Franck-Condon, Herzberg-Teller, and Duschinsky Effects (Articolo in rivista) (Prodotto della ricerca)
- Stereoelectronic, Vibrational, and Environmental Contributions to Polarizabilities of Large Molecular Systems: A Feasible Anharmonic Protocol (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Characterization of the Elusive Conformers of Glycine from State-of-the-Art Structural, Thermodynamic, and Spectroscopic Computations: Theory Complements Experiment (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Towards an accurate description of anharmonic infrared spectra in solution within the polarizable continuum model: Reaction field, cavity field and nonequilibrium effects (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- A general time-dependent route to Resonance-Raman spectroscopy including Franck-Condon, Herzberg-Teller and Duschinsky effects (Articolo in rivista) (Prodotto della ricerca)
- Implementation and validation of a multi-purpose virtual spectrometer for large systems in complex environments (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Toward Ab Initio Anharmonic Vibrational Circular Dichroism Spectra in the Condensed Phase (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Glycine conformers: a never-ending story? (Articolo in rivista) (Prodotto della ricerca)
- General Perturbative Approach for Spectroscopy, Thermodynamics, and Kinetics: Methodological Background and Benchmark Studies (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Accurate yet feasible computations of resonance Raman spectra for metal complexes in solution: [Ru(bpy)3]2+ as a case study (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Toward an Accurate Modeling of Optical Rotation for Solvated Systems: Anharmonic Vibrational Contributions Coupled to the Polarizable Continuum Model (Articolo in rivista) (Prodotto della ricerca)
- Coautore
- Nome
- Cognome
- Afferisce a
Incoming links:
- Ha afferente
- Coautore
- Rapporto con persona
- Autore CNR
- Implementation and validation of a multi-purpose virtual spectrometer for large systems in complex environments (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Toward Ab Initio Anharmonic Vibrational Circular Dichroism Spectra in the Condensed Phase (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- General Perturbative Approach for Spectroscopy, Thermodynamics, and Kinetics: Methodological Background and Benchmark Studies (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Integrated computational approaches for spectroscopic studies of molecular systems in the gas phase and in solution: pyrimidine as a test case (Articolo in rivista) (Prodotto della ricerca)
- Toward an Accurate Modeling of Optical Rotation for Solvated Systems: Anharmonic Vibrational Contributions Coupled to the Polarizable Continuum Model (Articolo in rivista) (Prodotto della ricerca)
- Robust and user-friendly models beyond the harmonic level of theory for vibrational spectroscopy (Comunicazione a convegno) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1303)
- Toward anharmonic computations of vibrational spectra for large molecular systems (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- 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 (Articolo in rivista) (Prodotto della ricerca)
- Fully ab initio IR spectra for complex molecular systems from perturbative vibrational approaches: Glycine as a test case (Articolo in rivista) (Prodotto della ricerca)
- Accurate yet feasible computations of resonance Raman spectra for metal complexes in solution: [Ru(bpy)3]2+ as a case study (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- A general time-dependent route to Resonance-Raman spectroscopy including Franck-Condon, Herzberg-Teller and Duschinsky effects (Articolo in rivista) (Prodotto della ricerca)
- An integrated experimental and quantum-chemical investigation on the vibrational spectra of chlorofluoromethane (Articolo in rivista) (Prodotto della ricerca)
- Accurate structure, thermodynamic and spectroscopic parameters from CC and CC/DFT schemes: the challenge of the conformational equilibrium in glycine (Articolo in rivista) (Prodotto della ricerca)
- Anharmonicity effects in the vibrational CD spectra of propylene oxide (Articolo in rivista) (Prodotto della ricerca)
- A Multifrequency Virtual Spectrometer for Complex Bio-Organic Systems: Vibronic and Environmental Effects on the UV/Vis Spectrum of Chlorophyll a (Articolo in rivista) (Prodotto della ricerca)
- Accurate molecular structures and infrared spectra of trans-2,3-dideuterooxirane, methyloxirane, and trans-2,3-dimethyloxirane (Articolo in rivista) (Prodotto della ricerca)
- ACCURATE SPECTROSCOPIC CHARACTERIZATION OF OXIRANE: A VALUABLE ROUTE TO ITS IDENTIFICATION IN TITAN'S ATMOSPHERE AND THE ASSIGNMENT OF UNIDENTIFIED INFRARED BANDS (Articolo in rivista) (Prodotto della ricerca)
- 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 (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Environmental and dynamical effects on the optical properties of molecular systems by time-independent and time-dependent approaches: Coumarin derivatives as test cases (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Stereoelectronic, Vibrational, and Environmental Contributions to Polarizabilities of Large Molecular Systems: A Feasible Anharmonic Protocol (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Towards an accurate description of anharmonic infrared spectra in solution within the polarizable continuum model: Reaction field, cavity field and nonequilibrium effects (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Development of a Virtual Spectrometer for Chiroptical Spectroscopies: The Case of Nicotine (Articolo in rivista) (Prodotto della ricerca)
- Circular Dichroism and Optical Rotation of Lactamide and 2-Aminopropanol in Aqueous Solution (Articolo in rivista) (Prodotto della ricerca)
- Accurate structure, thermodynamics, and spectroscopy of medium-sized radicals by hybrid coupled cluster/density functional theory approaches: The case of phenyl radical (Articolo in rivista) (Prodotto della ricerca)
- Glycine conformers: a never-ending story? (Articolo in rivista) (Prodotto della ricerca)
- Fully anharmonic IR and Raman spectra of medium-size molecular systems: accuracy and interpretation (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Synthesis and Optical Properties of Imidazole-Based Fluorophores having High Quantum Yields (Articolo in rivista) (Prodotto della ricerca)
- Role of Host-Guest Interactions in Tuning the Optical Properties of Coumarin Derivatives Incorporated in MCM-41: A TD-DFT Investigation (Articolo in rivista) (Prodotto della ricerca)
- General Time Dependent Approach to Vibronic Spectroscopy Including Franck-Condon, Herzberg-Teller, and Duschinsky Effects (Articolo in rivista) (Prodotto della ricerca)
- Characterization of the Elusive Conformers of Glycine from State-of-the-Art Structural, Thermodynamic, and Spectroscopic Computations: Theory Complements Experiment (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
