Sfoglia per Autore
Thermal Schrödinger Equation: Efficient Tool for Simulation of Many-Body Quantum Dynamics at Finite Temperature
2017-01-01 Gelin, Maxim F.; Borrelli, Raffaele
Steric and electronic effects on the excited state dynamics of squaraine dyes
2016-01-01 Paternò, G. M.; Barbero, N.; Galliano, S.; Barolo, C.; Borrelli, R.; Lanzani, G.; Scotognella, F.
Quantum electron-vibrational dynamics at finite temperature: Thermo field dynamics approach
2016-01-01 Borrelli, Raffaele; Gelin, Maxim F.
First-Principle Calculations of the Band Shapes of Singlet–Triplet Transitions
2016-01-01 Velardo, Amalia; Borrelli, Raffaele; Peluso, Andrea; Capobianco, Amedeo
Quantum dynamics of electronic transitions with Gauss-Hermite wave packets
2016-01-01 Borrelli, Raffaele; Peluso, Andrea
The Generalized Coherent State ansatz: Application to quantum electron-vibrational dynamics
2016-01-01 Borrelli, Raffaele; Gelin, Maxim F.
Dicyanovinyl and cyano-ester benzoindolenine squaraine dyes: The effect of the central functionalization on dye-sensitized solar cell performance
2016-01-01 Galliano, Simone; Novelli, Vittoria; Barbero, Nadia; Smarra, Alessandra; Viscardi, Guido; Borrelli, Raffaele; Sauvage, Frédéric; Barolo, Claudia
Absorption Band Shapes of a Push-Pull Dye Approaching the Cyanine Limit: A Challenging Case for First Principle Calculations
2016-01-01 Capobianco, Amedeo; Borrelli, Raffaele; Landi, Alessandro; Velardo, Amalia; Peluso, Andrea
Quantum dynamics of radiationless electronic transitions including normal modes displacements and duschinsky rotations: A second-order cumulant approach
2015-01-01 Borrelli, Raffaele; Peluso, Andrea
First Principle Analysis of Charge Dissociation and Charge Recombination Processes in Organic Solar Cells
2015-01-01 Velardo, Amalia; Borrelli, Raffaele; Capobianco, Amedeo; La Rocca, Mario Vincenzo; Peluso, Andrea
Vibronic couplings and coherent electron transfer in bridged systems
2015-01-01 Borrelli, Raffaele; Capobianco, Amedeo; Landi, Alessandro; Peluso, Andrea
Theoretical and experimental determination of the absorption and emission spectra of a prototypical indolenine-based squaraine dye
2014-01-01 Raffaele Borrelli; Silvano Ellena; Claudia Barolo
Hole hopping rates in single strand oligonucleotides
2014-01-01 Borrelli, Raffaele; Capobianco, Amedeo; Peluso, Andrea
Panchromatic Symmetrical Squaraines: A step forward in molecular engineering of low cost blue-greenish sensitizers for Dye-Sensitized Solar Cells
2014-01-01 J. Park; N. Barbero; J. Yoon; E. Dell’Orto; S. Galliano; R. Borrelli; J.-H. Yum; D. Di Censo; M. Graetzel; Md. K. Nazeeruddin; C. Barolo; G. Viscardi
Elementary electron transfer reactions: from basic concepts to recent computational advances
2013-01-01 Raffaele Borrelli;Andrea Peluso
Computational investigation of the photoinduced homolytic dissociation of water in the pyridine–water complex
2013-01-01 Xiaojun Liu;Andrzej L. Sobolewski;Raffaele Borrelli;Wolfgang Domcke
Synthesis and Characterization of Symmetric bi-anchored metal-free Sensitizers for Dye-sensitized Solar Cell
2013-01-01 J. Park; C. Barolo; N. Barbero; R. Borrelli; J.-H. Yum; D. Di Censo; C. Magistris; A. Smarra; P. Quagliotto; G. Viscardi
Franck–Condon factors—Computational approaches and recent developments
2013-01-01 Raffaele Borrelli; Amedeo Capobianco; Andrea Peluso
Quantum dynamics of electron-transfer reactions: photoinduced intermolecular electron transfer in a porphyrin–quinone complex
2012-01-01 Raffaele Borrelli; Michael Thoss; Haobin Wang; Wolfgang Domcke
Franck–Condon factors in curvilinear coordinates: the photoelectron spectrum of ammonia
2012-01-01 Amedeo Capobianco; Raffaele Borrelli; Canio Noce; Andrea Peluso
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