Diabatization by Localization in the Framework of Configuration Interaction Based on Floating Occupation Molecular Orbitals (FOMO− CI) D Accomasso, M Persico, G Granucci ChemPhotoChem 3 (9), 933-944, 2019 | 21 | 2019 |
Delocalization effects in singlet fission: Comparing models with two and three interacting molecules D Accomasso, G Granucci, M Wibowo, M Persico The Journal of Chemical Physics 152 (24), 2020 | 16 | 2020 |
Ultrafast Excited-State Dynamics of Carotenoids and the Role of the SX State D Accomasso, S Arslancan, L Cupellini, G Granucci, B Mennucci The Journal of Physical Chemistry Letters 13 (29), 6762-6769, 2022 | 15 | 2022 |
How orange carotenoid protein controls the excited state dynamics of canthaxanthin A Arcidiacono, D Accomasso, L Cupellini, B Mennucci Chemical Science 14 (40), 11158-11169, 2023 | 9 | 2023 |
Computational design of singlet fission biradicaloid chromophores D Accomasso, M Persico, G Granucci Journal of Photochemistry and Photobiology A: Chemistry 427, 113807, 2022 | 7 | 2022 |
Singlet fission in covalent dimers of methylene-locked 1, 3-diphenyl-isobenzofuran: semiclassical simulations of nonadiabatic dynamics D Accomasso, G Granucci, M Persico Journal of Materials Chemistry A 9 (38), 21897-21909, 2021 | 6 | 2021 |
The nature of carotenoid S* state and its role in the nonphotochemical quenching of plants D Accomasso, G Londi, L Cupellini, B Mennucci Nature Communications 15 (1), 847, 2024 | 4 | 2024 |
Testing new chromophores for singlet fission: A computational protocol applied to 2, 3-diamino-1, 4-benzoquinone D Accomasso, G Granucci, RWA Havenith, M Persico Chemical Physics 515, 635-642, 2018 | 4 | 2018 |
2D-Block Geminals: a non 1-orthogonal and non 0-seniority model with reduced computational complexity P Cassam-Chenaï, T Perez, D Accomasso The Journal of Chemical Physics 158 (7), 2023 | 3 | 2023 |
Deciphering photoreceptors through atomistic modeling from light absorption to conformational response G Salvadori, P Mazzeo, D Accomasso, L Cupellini, B Mennucci Journal of Molecular Biology, 168358, 2023 | 2 | 2023 |
The Quantum Decoherence Problem in Nonadiabatic Trajectory Methods M Persico, G Granucci, Accomasso, Davide Reference Module in Chemistry, Molecular Sciences and Chemical Engineering, 2022 | 2 | 2022 |
Ultrafast excited-state dynamics of Luteins in the major light-harvesting complex LHCII L Pedraza-González, D Accomasso, L Cupellini, G Granucci, B Mennucci Photochemical & Photobiological Sciences 23 (2), 303-314, 2024 | 1 | 2024 |
Excited-state dynamics of carotenoids in photoresponsive and light-harvesting proteins D Accomasso | | 2024 |
Excited-state dynamics of carotenoids in photoresponsive and light-harvesting proteins O CeNT, D Accomasso | | 2024 |
Ultrafast Excited-State Dynamics of Luteins in the major light-harvesting complex LHCII LMP González, D Accomasso, L Cupellini, G Granucci, B Mennucci | | 2023 |
Computational design of covalently bound dimers for singlet fission D Accomasso, NB Amor, M Persico, G Granucci Journal of Photochemistry and Photobiology A: Chemistry 443, 114836, 2023 | | 2023 |
Singlet fission in molecular crystals and covalent dimers: from chromophore design to nonadiabatic dynamics simulation D Accomasso Atti e memorie dell'Accademia toscana di scienze e lettere La Colombaria …, 2022 | | 2022 |
Computational study of 2, 3-diamino-1, 4-benzoquinone as a proposed chromophore for singlet fission D ACCOMASSO | | 2017 |
Singlet fission dynamics in molecular crystals and covalent dimers D Accomasso, G Granucci, M Persico Book of Abstracts, 61, 0 | | |