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CEOTTO, MICHELE

CEOTTO, MICHELE  

Dipartimento di Chimica  

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Risultati 1 - 20 di 195 (tempo di esecuzione: 0.0 secondi).
Titolo Data di pubblicazione Autori Tipo File Abstract
A Time Averaged Approach to IR Spectroscopy 2025 C. LanziC. AietaM. CeottoR. Conte Conference Object -
Semiclassical description of nuclear quantum effects in solvated and condensed phase molecular systems 2025 Conte, RiccardoMandelli, GiacomoBotti, GiacomoMoscato, DavideLanzi, CeciliaCazzaniga, MarcoAieta, ChiaraCeotto, Michele Article (author) -
Modified vibrational perturbation theory as applied to the collinear H + H2 and D + H2 reactions 2025 Aieta, ChiaraCeotto, Michele + Article (author) -
Exact factorization method for bound vibrational states: An analytical tool for accurate approximations 2025 Ceotto, Michele Article (author) -
An extended semiclassical initial value representation approach to IR spectroscopy 2025 Lanzi, CeciliaAieta, ChiaraCeotto, MicheleConte, Riccardo Article (author) -
Vibrational Spectroscopy Through Time Averaged Fourier Transform of Autocorrelated Molecular Dynamics Data: Introducing the Free SEMISOFT Web‐Platform 2025 Conte, RiccardoGandolfi, MicheleMoscato, DavideAieta, ChiaraValtolina, StefanoCeotto, Michele Article (author) -
A time averaged semiclassical approach to the computation of nonadiabatic vibronic absorption spectra Available 2025 Davide MoscatoMichele GandolfiMichele Ceotto Article (author) -
Quantum dynamics through a handful of semiclassical trajectories 2025 Aieta, ChiaraCazzaniga, MarcoMoscato, DavideLanzi, CeciliaCeotto, MicheleConte, Riccardo + Article (author) -
A Perspective on the Investigation of Spectroscopy and Kinetics of Complex Molecular Systems with Semiclassical Approaches 2024 Conte, RiccardoAieta, ChiaraCazzaniga, MarcoCeotto, Michele Article (author) -
Is Quantum Above-Barrier Reflection Important for Molecular Barrier Crossing Rates? 2024 Aieta, ChiaraCeotto, Michele + Article (author) -
The fate of the formic acid proton on the anatase TiO2(101) surface 2024 Cazzaniga, MarcoCeotto, Michele + Article (author) -
A Time Averaged Semiclassical Approach to IR Spectroscopy 2024 C. LanziC. AietaM. CeottoR. Conte Conference Object -
Unraveling Water Solvation Effects with Quantum Mechanics/Molecular Mechanics Semiclassical Vibrational Spectroscopy: The Case of Thymidine 2024 Moscato, DavideMandelli, GiacomoConte, RiccardoCeotto, Michele + Article (author) -
A web platform for time averaged Fourier transform of autocorrelated data 2024 Michele GandolfiDavide MoscatoChiara AietaStefano ValtolinaMichele Ceotto + Multimedia Object (author) -
Semiclassical reaction rate constant calculations: investigation of anharmonicity and quantum effects 2024 C. AietaM. Ceotto + Conference Object -
A time averaged semiclassical approach to IR spectroscopy 2024 Lanzi, CeciliaAieta, ChiaraCeotto, MicheleConte, Riccardo Article (author) -
Semiclassical vibrational spectroscopy from small molecules to solvated biomolecules 2023 Conte, RiccardoLanzi, CeciliaBotti, GiacomoMandelli, GiacomoMoscato, DavideAieta, ChiaraCeotto, Michele Conference Object -
Anharmonicity and quantum nuclear effects in theoretical vibrational spectroscopy: A molecular tale of two cities 2023 Conte, RiccardoAieta, ChiaraBotti, GiacomoGandolfi, MicheleLanzi, CeciliaMandelli, GiacomoMoscato, DavideCeotto, Michele + Article (author) -
A semiclassical route to the calculation of IR spectra 2023 Cecilia LanziChiara AietaMichele CeottoRiccardo Conte Conference Object -
Elucidating NO x surface chemistry at the anatase (101) surface in TiO2 nanoparticles 2023 Cazzaniga, MarcoCeotto, Michele + Article (author) -