Foto del docente

Marco Garavelli

Professore ordinario

Dipartimento di Chimica Industriale "Toso Montanari"

Settore scientifico disciplinare: CHIM/02 CHIMICA FISICA

Pubblicazioni

Carone A.; Mariani P.; Desert A.; Romanelli M.; Marcheselli J.; Garavelli M.; Corni S.; Rivalta I.; Parola S., Insight on Chirality Encoding from Small Thiolated Molecule to Plasmonic Au@Ag and Au@Au Nanoparticles, «ACS NANO», 2021, 16, pp. 1089 - 1101 [articolo]

Segatta F.; Nenov A.; Nascimento D.R.; Govind N.; Mukamel S.; Garavelli M., iSPECTRON: A simulation interface for linear and nonlinear spectra with ab-initio quantum chemistry software, «JOURNAL OF COMPUTATIONAL CHEMISTRY», 2021, 42, pp. 644 - 659 [articolo]

Gu B.; Nenov A.; Segatta F.; Garavelli M.; Mukamel S., Manipulating Core Excitations in Molecules by X-Ray Cavities, «PHYSICAL REVIEW LETTERS», 2021, 126, Article number: 053201, pp. 053201 - 053201 [articolo]

Segatta F.; Rogers D.M.; Dyer N.T.; Guest E.E.; Li Z.; Do H.; Nenov A.; Garavelli M.; Hirst J.D., Near-ultraviolet circular dichroism and two-dimensional spectroscopy of polypeptides, «MOLECULES», 2021, 26, Article number: 396, pp. 396 - 396 [articolo]

Song H.; Nam Y.; Keefer D.; Garavelli M.; Mukamel S.; Tretiak S., Nonadiabatic Molecular Dynamics Study of the Relaxation Pathways of Photoexcited Cyclooctatetraene, «THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS», 2021, 12, pp. 5716 - 5722 [articolo]

Meena S.K.; Lerouge F.; Baldeck P.; Andraud C.; Garavelli M.; Parola S.; Sulpizi M.; Rivalta I., On the origin of controlled anisotropic growth of monodisperse gold nanobipyramids, «NANOSCALE», 2021, 13, pp. 15292 - 15300 [articolo]

Aleotti F.; Aranda D.; Yaghoubi Jouybari M.; Garavelli M.; Nenov A.; Santoro F., Parameterization of a linear vibronic coupling model with multiconfigurational electronic structure methods to study the quantum dynamics of photoexcited pyrene, «THE JOURNAL OF CHEMICAL PHYSICS», 2021, 154, Article number: 104106, pp. 104106 - 104106 [articolo]

Conti I.; Bonfanti M.; Nenov A.; Rivalta I.; Garavelli M., Photo-Active Biological Molecular Materials: From Photoinduced Dynamics to Transient Electronic Spectroscopies, in: Challenges and Advances in Computational Chemistry and Physics, Basingstoke, Regno Unito, Springer Science and Business Media B.V., 2021, pp. 77 - 142 [capitolo di libro]

Gu B.; Keefer D.; Aleotti F.; Nenov A.; Garavelli M.; Mukamel S., Photoisomerization transition state manipulation by entangled two-photon absorption, «PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA», 2021, 118, Article number: e2116868118, pp. e2116868118 - e2116868118 [articolo]

Cesari C.; Berti B.; Calcagno F.; Femoni C.; Garavelli M.; Iapalucci M.C.; Rivalta I.; Zacchini S., Polymerization isomerism in co-m (M = cu, ag, au) carbonyl clusters: Synthesis, structures and computational investigation, «MOLECULES», 2021, 26, Article number: 1529, pp. 1 - 18 [articolo]Open Access

Avagliano D.; Bonfanti M.; Garavelli M.; Gonzalez L., QM/MM Nonadiabatic Dynamics: The SHARC/COBRAMM Approach, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2021, 17, pp. 4639 - 4647 [articolo]

Keshk R.M.; Garavelli M.; El-Tahawy M.M.T., Synthesis, physicochemical and vibrational spectral properties of 2–pyridone and 2–aminopyridine derivatives: An experimental and theoretical study, «JOURNAL OF MOLECULAR STRUCTURE», 2021, 1225, Article number: 129136, pp. 129136 - 129136 [articolo]

Gualandi A.; Nenov A.; Marchini M.; Rodeghiero G.; Conti I.; Paltanin E.; Balletti M.; Ceroni P.; Garavelli M.; Cozzi P.G., Tailored Coumarin Dyes for Photoredox Catalysis: Calculation, Synthesis, and Electronic Properties, «CHEMCATCHEM», 2021, 13, pp. 981 - 989 [articolo]

Kabacinski P.; Jaiswal V.K.; Borrego-Varillas R.; Nogueira De Faria B.E.; Gentile M.G.; Conti I.; De Silvestri S.; Garavelli M.; De Paula A.M.; Cerullo G., Tracking Conical Intersection Dynamics of Tryptophan with Sub-20-fs UV Pulses, in: 2021 Conference on Lasers and Electro-Optics Europe and European Quantum Electronics Conference, CLEO/Europe-EQEC 2021, Institute of Electrical and Electronics Engineers Inc., 2021, pp. 1 - 1 (atti di: 2021 Conference on Lasers and Electro-Optics Europe and European Quantum Electronics Conference, CLEO/Europe-EQEC 2021, deu, 2021) [Contributo in Atti di convegno]

Kabacinski P.; Jaiswal V.K.; Borrego-Varillas R.; Nogueira de Faria B.E.; Gentile M.G.; Conti I.; de Silvestri S.; Garavelli M.; de Paula A.M.; Cerullo G., Tracking conical intersection dynamics of tryptophan with sub-20-fs UV pulses, in: Optics InfoBase Conference Papers, The Optical Society, 2021, pp. 1 - 2 (atti di: 2021 European Conference on Lasers and Electro-Optics, CLEO/Europe 2021, deu, 2021) [Contributo in Atti di convegno]