Sfoglia per Autore  BAIARDI, ALBERTO

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Mostrati risultati da 1 a 18 di 18
Titolo Data di pubblicazione Autori Tipo File
General Time Dependent Approach to Vibronic Spectroscopy Including Franck–Condon, Herzberg–Teller, and Duschinsky Effects 2013 BAIARDI, ALBERTOJulien BloinoBARONE, Vincenzo 1.1 Articolo in rivista
A general time-dependent route to Resonance-Raman spectroscopy including Franck-Condon, Herzberg-Teller and Duschinsky effects 2014 Baiardi A.Bloino J.Barone V. 1.1 Articolo in rivista
New developments of a multifrequency virtual spectrometer: stereo-electronic, dynamical, and environmental effects on chiroptical spectra 2014 Barone, VincenzoBaiardi, AlbertoBloino, Julien 1.1 Articolo in rivista
Accurate yet feasible computations of resonance Raman spectra for metal complexes in solution: [Ru(bpy)3]2+ as a case study 2014 Baiardi A.Latouche C.Bloino J.Barone V. 1.1 Articolo in rivista
Vibrationally resolved NEXAFS at C and N K-edges of pyridine, 2-fluoropyridine and 2,6-difluoropyridine: A combined experimental and theoretical assessment 2015 Baiardi, AlbertoMendolicchio, MarcoBarone, VincenzoSTENER, Mauro + 1.1 Articolo in rivista
Implementation of a graphical user interface for the virtual multifrequency spectrometer: The VMS-Draw tool 2015 LICARI, DANIELEBAIARDI, ALBERTOBICZYSKO, MALGORZATA AGNIESZKAEGIDI, FRANCOLATOUCHE, CAMILLEBARONE, Vincenzo 1.1 Articolo in rivista
General formulation of vibronic spectroscopy in internal coordinates 2016 BAIARDI, ALBERTOBLOINO, JULIENBARONE, Vincenzo 1.1 Articolo in rivista
Temperature Dependence of Radiative and Nonradiative Rates from Time-Dependent Correlation Function Methods 2016 BAIARDI, ALBERTOBLOINO, JULIENBARONE, Vincenzo + 1.1 Articolo in rivista
Vibrational Density Matrix Renormalization Group 2017 Baiardi, AlbertoBarone, Vincenzo + 1.1 Articolo in rivista
Effective Inclusion of Mechanical and Electrical Anharmonicity in Excited Electronic States: VPT2-TDDFT Route 2017 Egidi, FrancoBaiardi, AlbertoBloino, JulienScalmani, GiovanniBarone, Vincenzo + 1.1 Articolo in rivista
Spectroscopic Characterization of Key Aromatic and Heterocyclic Molecules: A Route toward the Origin of Life 2017 Puzzarini, CristinaBaiardi, AlbertoBloino, JulienBarone, Vincenzo + 1.1 Articolo in rivista
Simulation of Vibronic Spectra of Flexible Systems: Hybrid DVR-Harmonic Approaches 2017 Baiardi, AlbertoBloino, JulienBarone, Vincenzo 1.1 Articolo in rivista
Understanding the interplay between the solvent and nuclear rearrangements in the negative solvatochromism of a push-pull flexible quinolinium cation 2017 Cannelli, OlivieroGiovannini, TommasoBaiardi, AlbertoCappelli, Chiara + 1.1 Articolo in rivista
Assessment of Electron Propagator Methods for the Simulation of Vibrationally Resolved Valence and Core Photoionization Spectra 2017 Baiardi, A.Paoloni, L.Barone, V. + 1.1 Articolo in rivista
Time-Dependent Formulation of Resonance Raman Optical Activity Spectroscopy 2018 Baiardi, AlbertoBloino, JulienBarone, Vincenzo 1.1 Articolo in rivista
Computational simulation of vibrationally resolved spectra for spin-forbidden transitions 2018 Egidi, FrancoFusè, MarcoBaiardi, AlbertoBloino, JulienBarone, Vincenzo + 1.1 Articolo in rivista
Development of computational methods for the simulation of vibrational and electronic spectra of medium-to-large sized molecular systems 2018 Baiardi, Alberto Doctoral Thesis
Theory meets experiment for unravelling the C1s X-ray photoelectron spectra of pyridine, 2-fluoropyridine, and 2,6-difluoropyridine 2019 Mendolicchio M.Baiardi A.Stener M.Barone V. + 1.1 Articolo in rivista
Mostrati risultati da 1 a 18 di 18
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