Foto del docente

Marco Garavelli

Full Professor

Department of Industrial Chemistry "Toso Montanari"

Academic discipline: CHIM/02 Physical Chemistry

Publications

Borrego-Varillas, Rocío; Teles-Ferreira, Danielle C.; Nenov, Artur; Conti, Irene; Ganzer, Lucia; Manzoni, Cristian; Garavelli, Marco*; Maria De Paula, Ana; Cerullo, Giulio, Observation of the Sub-100 Femtosecond Population of a Dark State in a Thiobase Mediating Intersystem Crossing, «JOURNAL OF THE AMERICAN CHEMICAL SOCIETY», 2018, 140, pp. 16087 - 16093 [Scientific article]Open Access

Angelo Giussani; Irene Conti; Artur Nenov; Marco Garavelli, Photoinduced formation mechanism of the thymine–thymine (6–4) adduct in DNA; a QM(CASPT2//CASSCF):MM(AMBER) study, in: Photoinduced Processes in Nucleic Acids and Proteins, Cambridge, Royal Society of Chemistry, 2018, pp. 375 - 387 (FARADAY DISCUSSIONS) [Chapter or essay]

El-Tahawy Mohsen M. T., Nenov Artur, Weingart Oliver, Olivucci Massimo, Garavelli Marco, Relationship between Excited State Lifetime and Isomerization Quantum Yield in Animal Rhodopsins: Beyond the One-Dimensional Landau-Zener Model, «THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS», 2018, 9, pp. 3315 - 3322 [Scientific article]Open Access

Segarra-Marti Javier, Zvereva Elena, Marazzi Marco, Brazard Johanna, Dumont Elise, Assfeld Xavier, Haacke Stefan, Garavelli Marco, Monari Antonio, Leonard Jeremie, Rivalta Ivan, Resolving the Singlet Excited State Manifold of Benzophenone by First-Principles Simulations and Ultrafast Spectroscopy, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2018, 14, pp. 2570 - 2585 [Scientific article]

Provazza, Justin; Segatta, Francesco; Garavelli, Marco; Coker, David F, Semiclassical Path Integral Calculation of Nonlinear Optical Spectroscopy, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2018, 14, pp. 856 - 866 [Scientific article]

Zvereva Elena, Segarra-Marti Javier, Marazzi Marco, Brazard Johanna, Nenov Artur, Weingart Oliver, Leonard Jeremie, Garavelli Marco, Rivalta Ivan, Dumont Elise, Assfeld Xavier, Haacke Stefan, Monari Antonio, The effect of solvent relaxation in the ultrafast time-resolved spectroscopy of solvated benzophenone, «PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES», 2018, 17, pp. 323 - 331 [Scientific article]

Javier Segarra-Martí; Ana J. Pepino; Artur Nenov; Shaul Mukamel; Marco Garavelli; Ivan Rivalta, The highly excited-state manifold of guanine: calibration for nonlinear electronic spectroscopy simulations, «THEORETICAL CHEMISTRY ACCOUNTS», 2018, 137, pp. 47 - 47 [Scientific article]

Gholami Samira, Nenov Artur, Rivalta Ivan, Bocola Marco, Bordbar A. Khalegh, Schwaneberg Ulrich, Davari Mehdi D., Garavelli Marco, Theoretical Model of the Protochlorophyllide Oxidoreductase from a Hierarchy of Protocols, «JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL», 2018, 122, pp. 7668 - 7681 [Scientific article]

Segarra, Nenov, Garavelli, Rivalta, Mukamel Shaul, Towards Accurate Simulation of Two-Dimensional Electronic Spectroscopy, «TOPICS IN CURRENT CHEMISTRY», 2018, 376, pp. 24 - 24 [Scientific article]

Segarra-Marti Javier, Jaiswal Vishal K., Pepino Ana Julieta, Giussani Angelo, Nenov Artur, Mukamel Shaul, Garavelli Marco, Rivalta Ivan, Two-dimensional electronic spectroscopy as a tool for tracking molecular conformations in DNA/RNA aggregates, «FARADAY DISCUSSIONS», 2018, 207, pp. 233 - 250 [Scientific article]

Nenov Artur, Borrego-Varillas Rocio, Oriana Aurelio, Ganzer Lucia, Segatta Francesco, Conti Irene, Segarra-Marti Javier, Omachi Junko, Dapor Maurizio, Taioli Simone, Manzoni Cristian, Mukamel Shaul, Cerullo Giulio, Garavelli Marco, UV-Light-Induced Vibrational Coherences: The Key to Understand Kasha Rule Violation in trans -Azobenzene, «THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS», 2018, 9, pp. 1534 - 1541 [Scientific article]

Ana Julieta Pepino; Javier Segarra-Martí; Artur Nenov; Ivan Rivalta; Roberto Improta; Marco Garavelli, UV-induced long-lived decays in solvated pyrimidine nucleosides resolved at the MS-CASPT2/MM level, «PHYSICAL CHEMISTRY CHEMICAL PHYSICS», 2018, 20, pp. 6877 - 6890 [Scientific article]

Segatta, Gdor Itay, Rehault Julien, Taioli Simone, Friedman Noga, Sheves Mordechai, Rivalta Ivan, Ruhman Sanford, Cerullo Giulio, Garavelli Marco, Ultrafast Carotenoid to Retinal Energy Transfer in Xanthorhodopsin Revealed by the Combination of Transient Absorption and Two-Dimensional Electronic Spectroscopy, «CHEMISTRY-A EUROPEAN JOURNAL», 2018, 24, pp. 12084 - 12092 [Scientific article]Open Access

Segatta, Francesco; Cupellini, Lorenzo; Jurinovich, Sandro; Mukamel, Shaul; Dapor, Maurizio; Taioli, Simone; Garavelli, Marco; Mennucci, Benedetta, A Quantum Chemical Interpretation of Two-Dimensional Electronic Spectroscopy of Light-Harvesting Complexes, «JOURNAL OF THE AMERICAN CHEMICAL SOCIETY», 2017, 139, pp. 7558 - 7567 [Scientific article]

Orlandi, Giorgio; Garavelli, Marco; Zerbetto, Francesco, Analysis of the vibronic structure of the: Trans -stilbene fluorescence and excitation spectra: The S0 and S1 PES along the CeCe and Ce-Cph torsions, «PHYSICAL CHEMISTRY CHEMICAL PHYSICS», 2017, 19, pp. 25095 - 25104 [Scientific article]