Lorenzo Cupellini

69PUBLICATIONS
126CO-AUTHORS
Theoretical quantum chemistryRadiation and matterVision scienceChemical thermodynamics and energeticsFree radical chemistry
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Publications (69)

|Jun 20, 2026
Modeling Xanthophyll Excited States via Cost-Effective Quantum Chemistry methods and Property-Based Diabatization.

|Apr 15, 2026
Making excited state MD faster: Extrapolation of transition densities for TD-DFT calculations.

Michele Nottoli, Damiano Castrignano', Patrizia Mazzeo

|Apr 07, 2026
Vibronic Reorganization Suppresses Salinixanthin-to-Retinal Energy Transfer in the Freshwater Kin4B8 Xanthorhodopsin.

Giacomo Salvadori, Piermarco Saraceno, Chris John

|Mar 31, 2026
An Efficient PCM Scheme for ESA Oscillator Strengths within the Unrelaxed TD-DFT Approximation.

Jakub Širůček, Boris Le Guennic, Denis Jacquemin

|Mar 12, 2026
Atomistic simulations reveal the photoactivation mechanism of a carotenoid-binding photoreceptor.

Amanda Arcidiacono, Mattia Bondanza, Lorenzo Cupellini

|Feb 11, 2026
Multiscale Machine Learning Prediction of Infrared Spectra of Solvated Molecules.

Patrizia Mazzeo, Lorenzo Cupellini, Benedetta Mennucci

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Frequent Collaborators

47 joint publications

Benedetta Mennucci

9 joint publications

Edoardo Cignoni

9 joint publications

Filippo Lipparini

7 joint publications

Michele Nottoli