VINCENZO BARONE
- Type
- Persona (Classe)
- Label
- VINCENZO BARONE (literal)
- VINCENZO BARONE (literal)
- Persona in rapporto
- Employment relationship with CNR of VINCENZO BARONE (Rapporto con CNR)
- Autore CNR di
- Computation of the lineshape of electronic spectra in solution within polarizable continuum models: Accounting for both vibrational structure and inhomogeneous broadening (Abstract/Poster in atti di convegno) (Prodotto della ricerca)
- Theoretical Study of the Conformational and Optical Properties of a Fluorescent Sensor Grafted on Apolar Polymer Structures (Articolo in rivista) (Prodotto della ricerca)
- Computing the inhomogeneous broadening of electronic transitions in solution: a first-principle quantum mechanical approach (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Fluorescence spectra of organic dyes in solution: a time dependent multilevel approach (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- An Integrated Protocol for the Accurate Calculation of Magnetic Interactions in Organic Magnets (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- The ÀÀ*/nÀ* decay in photoexcited pyrimidine nucleobases. A quantum dynamical study Holistic Computational Spectroscopy: innovative concepts, modern tools, strategic vision and challenges (Abstract/Poster in atti di convegno) (Prodotto della ricerca)
- Molecular Dynamics Simulations of the Self-Assembly of Tetraphenylporphyrin-Based Monolayers and Bilayers at a Silver Interface (Articolo in rivista) (Prodotto della ricerca)
- Organic Functionalization and Optimal Coverage of a Silicon(111) Surface in Solvent: A Computational Study (Articolo in rivista) (Prodotto della ricerca)
- Singlet-triplet energy gap of a diarylnitroxide diradical by an accurate many-body perturbative approach (Articolo in rivista) (Prodotto della ricerca)
- Differences in the lineshapes of absorption and emission electronic spectra in gas phase and in polar solution (Abstract/Poster in atti di convegno) (Prodotto della ricerca)
- Time-independent approaches to simulate electronic spectra lineshapes. From small molecules to mactrosystems, in Computational Strategies for Spectroscopy: from Small Molecules to Nano Systems (Contributo in volume (capitolo o saggio)) (Prodotto della ricerca)
- Absorption and emission spectra of fluorescent silica nanoparticles from TD-DFT/MM/PCM calculations (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Realistic Modeling of Fluorescent Dye-Doped Silica Nanoparticles: A Step Toward the Understanding of their Enhanced Photophysical Properties (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- The interplay between pipi* and npi* lowest excited states in nonradiative decay of photoexcited thymine (Articolo in rivista) (Prodotto della ricerca)
- Efficient time-independent method for the calculation of resonance Raman spectra in sizeable molecules including Duschinsky and Herzberg-Teller effects (Articolo in rivista) (Prodotto della ricerca)
- Interactions of Nucleotide Bases with Decorated Si Surfaces from Molecular Dynamics Simulations (Articolo in rivista) (Prodotto della ricerca)
- Complementary and partially complementary DNA duplexes tethered to a functionalized substrate: a molecular dynamics approach to biosensing (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Coautore
- ELISA PASSAGLIA (Persona)
- FABRIZIO SANTORO (Persona)
- DANIEL FORRER (Unità di personale interno)
- GIACOMO PRAMPOLINI (Persona)
- ALESSANDRO LAMI (Persona)
- SUSANNA MONTI (Persona)
- ALESSANDRO FERRETTI (Persona)
- francesca cicogna (Unità di personale esterno)
- Nome
- VINCENZO (literal)
- Cognome
- BARONE (literal)
- Afferisce a
Incoming links:
- Ha afferente
- Coautore
- SUSANNA MONTI (Persona)
- ELISA PASSAGLIA (Persona)
- FABRIZIO SANTORO (Persona)
- ALESSANDRO FERRETTI (Persona)
- ALESSANDRO LAMI (Persona)
- francesca cicogna (Unità di personale esterno)
- GIACOMO PRAMPOLINI (Persona)
- DANIEL FORRER (Unità di personale interno)
- Http://www.w3.org/2002/07/owl#sameAs
- Rapporto con persona
- Employment relationship with CNR of VINCENZO BARONE (Rapporto con CNR)
- Autore CNR
- Interactions of Nucleotide Bases with Decorated Si Surfaces from Molecular Dynamics Simulations (Articolo in rivista) (Prodotto della ricerca)
- Absorption and emission spectra of fluorescent silica nanoparticles from TD-DFT/MM/PCM calculations (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Realistic Modeling of Fluorescent Dye-Doped Silica Nanoparticles: A Step Toward the Understanding of their Enhanced Photophysical Properties (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- The interplay between pipi* and npi* lowest excited states in nonradiative decay of photoexcited thymine (Articolo in rivista) (Prodotto della ricerca)
- Efficient time-independent method for the calculation of resonance Raman spectra in sizeable molecules including Duschinsky and Herzberg-Teller effects (Articolo in rivista) (Prodotto della ricerca)
- An Integrated Protocol for the Accurate Calculation of Magnetic Interactions in Organic Magnets (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Organic Functionalization and Optimal Coverage of a Silicon(111) Surface in Solvent: A Computational Study (Articolo in rivista) (Prodotto della ricerca)
- Singlet-triplet energy gap of a diarylnitroxide diradical by an accurate many-body perturbative approach (Articolo in rivista) (Prodotto della ricerca)
- Molecular Dynamics Simulations of the Self-Assembly of Tetraphenylporphyrin-Based Monolayers and Bilayers at a Silver Interface (Articolo in rivista) (Prodotto della ricerca)
- Theoretical Study of the Conformational and Optical Properties of a Fluorescent Sensor Grafted on Apolar Polymer Structures (Articolo in rivista) (Prodotto della ricerca)
- Computing the inhomogeneous broadening of electronic transitions in solution: a first-principle quantum mechanical approach (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Fluorescence spectra of organic dyes in solution: a time dependent multilevel approach (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Complementary and partially complementary DNA duplexes tethered to a functionalized substrate: a molecular dynamics approach to biosensing (Articolo in rivista) (http://www.cnr.it/ontology/cnr/individuo/prodotto/TIPO1101)
- Computation of the lineshape of electronic spectra in solution within polarizable continuum models: Accounting for both vibrational structure and inhomogeneous broadening (Abstract/Poster in atti di convegno) (Prodotto della ricerca)
- Differences in the lineshapes of absorption and emission electronic spectra in gas phase and in polar solution (Abstract/Poster in atti di convegno) (Prodotto della ricerca)
- The ÀÀ*/nÀ* decay in photoexcited pyrimidine nucleobases. A quantum dynamical study Holistic Computational Spectroscopy: innovative concepts, modern tools, strategic vision and challenges (Abstract/Poster in atti di convegno) (Prodotto della ricerca)
- Time-independent approaches to simulate electronic spectra lineshapes. From small molecules to mactrosystems, in Computational Strategies for Spectroscopy: from Small Molecules to Nano Systems (Contributo in volume (capitolo o saggio)) (Prodotto della ricerca)