PERSICO, MAURIZIO Statistiche
PERSICO, MAURIZIO
DIPARTIMENTO DI CHIMICA E CHIMICA INDUSTRIALE
The Newton-X platform for mixed quantum–classical dynamics
2026-01-01 Barbatti, Mario; Mattos, Rafael S.; Demoulin, Baptiste; Bispo, Matheus De O.; Bondanza, Mattia; Brady, Marcus; Crespo-Otero, Rachel; De Miranda, Ely G. F.; Dral, Pavlo O.; Granucci, Giovanni; Hehn, Anna; Hernández, Federico J.; Iuzzolino, Gabriele; Kar, Ritama; Kossoski, Fábris; Lischka, Hans; Mennucci, Benedetta; Mukherjee, Saikat; Mukhopadhyay, Anik; Perrella, Fulvio; Persico, Maurizio; Pinheiro, Max; Pittner, Jiri; Plasser, Felix; Rega, Nadia; Sangiogo-Gil, Eduarda; Thorat, Tejas; Toldo, Josene M.; Tomaz, Anderson A.; Varella, Márcio T. Do N.; Vasquez, Luis
A Density Functional Theory and Semiempirical Framework for Trajectory Surface Hopping on Extended Systems
2025-01-01 Vogt, Jan-Robert; Schulz, Michael; Souza Mattos, Rafael; Barbatti, Mario; Persico, Maurizio; Granucci, Giovanni; Hutter, Jürg; Hehn, Anna
The time-resolved photoelectron spectrum of trans-azobenzene and its relationship with the photoisomerization mechanism: A surface hopping simulation with determination of Dyson orbitals
2025-01-01 Macis, Davide; Granucci, Giovanni; Persico, Maurizio
An algorithm for very high pressure molecular dynamics simulations
2024-01-01 Tesi, M.; Cammi, R.; Granucci, G.; Persico, M.
Investigating the Photodynamics of trans-Azobenzene with Coupled Trajectories
2024-01-01 Pieroni, Carlotta; Sangiogo Gil, Eduarda; Ibele, Lea M.; Persico, Maurizio; Granucci, Giovanni; Agostini, Federica
Computational design of covalently bound dimers for singlet fission
2023-01-01 Accomasso, D.; Ben Amor, N.; Persico, M.; Granucci, G.
Dual photoisomerization mechanism of azobenzene embedded in a lipid membrane
2023-01-01 Osella, Silvio; Granucci, Giovanni; Persico, Maurizio; Knippenberg, Stefan
Effect of Initial Conditions Sampling on Surface Hopping Simulations in the Ultrashort and Picosecond Time Range. Azomethane Photodissociation as a Case Study
2023-01-01 Pieroni, Carlotta; Becuzzi, Filippo; Creatini, Luigi; Granucci, Giovanni; Persico, Maurizio
The Quantum Decoherence Problem in Nonadiabatic Trajectory Methods
2023-01-01 Persico, Maurizio; Granucci, Giovanni; Accomasso, Davide
Computational design of singlet fission biradicaloid chromophores
2022-01-01 Accomasso, Davide; Persico, Maurizio; Granucci, Giovanni
Frenkel exciton photodynamics of self-assembled monolayers of azobiphenyls
2022-01-01 Sangiogo Gil, Eduarda; Persico, Maurizio; Granucci, Giovanni
Newton-X Platform: New Software Developments for Surface Hopping and Nuclear Ensembles
2022-01-01 Barbatti, Mario; Bondanza, Mattia; Crespo-Otero, Rachel; Demoulin, Baptiste; Dral, Pavlo O; Granucci, Giovanni; Kossoski, Fábris; Lischka, Hans; Mennucci, Benedetta; Mukherjee, Saikat; Pederzoli, Marek; Persico, Maurizio; Pinheiro, Max; Pittner, Jiří; Plasser, Felix; Sangiogo Gil, Eduarda; Stojanovic, Ljiljana
Sampling initial positions and momenta for nuclear trajectories from quantum mechanical distributions
2021-01-01 Yao, Yuxuan; Hase, William L.; Granucci, Giovanni; Persico, Maurizio
Singlet fission in covalent dimers of methylene-locked 1,3-diphenyl-isobenzofuran: semiclassical simulations of nonadiabatic dynamics
2021-01-01 Accomasso, Davide; Granucci, Giovanni; Persico, Maurizio
Surface Hopping Dynamics with the Frenkel Exciton Model in a Semiempirical Framework
2021-01-01 Sangiogo Gil, E.; Granucci, G.; Persico, M.
Delocalization effects in singlet fission: Comparing models with two and three interacting molecules
2020-01-01 Accomasso, D.; Granucci, G.; Wibowo, M.; Persico, M.
Photochemistry in the strong coupling regime: A trajectory surface hopping scheme
2020-01-01 Fregoni, J.; Corni, S.; Persico, M.; Granucci, G.
Strong Coupling with Light Enhances the Photoisomerization Quantum Yield of Azobenzene
2020-01-01 Fregoni, J.; Granucci, G.; Persico, M.; Corni, S.
Diabatization by localization in the framework of configuration interaction based on floating occupation molecular orbitals (FOMO-CI).
2019-01-01 Accomasso, Davide; Granucci, Giovanni; Persico, Maurizio
Nonadiabatic dynamics simulations of singlet fission in 2,5-bis(fluorene-9-ylidene)-2,5-dihydrothiophene crystals
2019-01-01 Wibowo, Meilani; Persico, Maurizio; Granucci, Giovanni
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| The Newton-X platform for mixed quantum–classical dynamics | 1-gen-2026 | Barbatti, Mario; Mattos, Rafael S.; Demoulin, Baptiste; Bispo, Matheus De O.; Bondanza, Mattia; Brady, Marcus; Crespo-Otero, Rachel; De Miranda, Ely G. F.; Dral, Pavlo O.; Granucci, Giovanni; Hehn, Anna; Hernández, Federico J.; Iuzzolino, Gabriele; Kar, Ritama; Kossoski, Fábris; Lischka, Hans; Mennucci, Benedetta; Mukherjee, Saikat; Mukhopadhyay, Anik; Perrella, Fulvio; Persico, Maurizio; Pinheiro, Max; Pittner, Jiri; Plasser, Felix; Rega, Nadia; Sangiogo-Gil, Eduarda; Thorat, Tejas; Toldo, Josene M.; Tomaz, Anderson A.; Varella, Márcio T. Do N.; Vasquez, Luis | |
| A Density Functional Theory and Semiempirical Framework for Trajectory Surface Hopping on Extended Systems | 1-gen-2025 | Vogt, Jan-Robert; Schulz, Michael; Souza Mattos, Rafael; Barbatti, Mario; Persico, Maurizio; Granucci, Giovanni; Hutter, Jürg; Hehn, Anna | |
| The time-resolved photoelectron spectrum of trans-azobenzene and its relationship with the photoisomerization mechanism: A surface hopping simulation with determination of Dyson orbitals | 1-gen-2025 | Macis, Davide; Granucci, Giovanni; Persico, Maurizio | |
| An algorithm for very high pressure molecular dynamics simulations | 1-gen-2024 | Tesi, M.; Cammi, R.; Granucci, G.; Persico, M. | |
| Investigating the Photodynamics of trans-Azobenzene with Coupled Trajectories | 1-gen-2024 | Pieroni, Carlotta; Sangiogo Gil, Eduarda; Ibele, Lea M.; Persico, Maurizio; Granucci, Giovanni; Agostini, Federica | |
| Computational design of covalently bound dimers for singlet fission | 1-gen-2023 | Accomasso, D.; Ben Amor, N.; Persico, M.; Granucci, G. | |
| Dual photoisomerization mechanism of azobenzene embedded in a lipid membrane | 1-gen-2023 | Osella, Silvio; Granucci, Giovanni; Persico, Maurizio; Knippenberg, Stefan | |
| Effect of Initial Conditions Sampling on Surface Hopping Simulations in the Ultrashort and Picosecond Time Range. Azomethane Photodissociation as a Case Study | 1-gen-2023 | Pieroni, Carlotta; Becuzzi, Filippo; Creatini, Luigi; Granucci, Giovanni; Persico, Maurizio | |
| The Quantum Decoherence Problem in Nonadiabatic Trajectory Methods | 1-gen-2023 | Persico, Maurizio; Granucci, Giovanni; Accomasso, Davide | |
| Computational design of singlet fission biradicaloid chromophores | 1-gen-2022 | Accomasso, Davide; Persico, Maurizio; Granucci, Giovanni | |
| Frenkel exciton photodynamics of self-assembled monolayers of azobiphenyls | 1-gen-2022 | Sangiogo Gil, Eduarda; Persico, Maurizio; Granucci, Giovanni | |
| Newton-X Platform: New Software Developments for Surface Hopping and Nuclear Ensembles | 1-gen-2022 | Barbatti, Mario; Bondanza, Mattia; Crespo-Otero, Rachel; Demoulin, Baptiste; Dral, Pavlo O; Granucci, Giovanni; Kossoski, Fábris; Lischka, Hans; Mennucci, Benedetta; Mukherjee, Saikat; Pederzoli, Marek; Persico, Maurizio; Pinheiro, Max; Pittner, Jiří; Plasser, Felix; Sangiogo Gil, Eduarda; Stojanovic, Ljiljana | |
| Sampling initial positions and momenta for nuclear trajectories from quantum mechanical distributions | 1-gen-2021 | Yao, Yuxuan; Hase, William L.; Granucci, Giovanni; Persico, Maurizio | |
| Singlet fission in covalent dimers of methylene-locked 1,3-diphenyl-isobenzofuran: semiclassical simulations of nonadiabatic dynamics | 1-gen-2021 | Accomasso, Davide; Granucci, Giovanni; Persico, Maurizio | |
| Surface Hopping Dynamics with the Frenkel Exciton Model in a Semiempirical Framework | 1-gen-2021 | Sangiogo Gil, E.; Granucci, G.; Persico, M. | |
| Delocalization effects in singlet fission: Comparing models with two and three interacting molecules | 1-gen-2020 | Accomasso, D.; Granucci, G.; Wibowo, M.; Persico, M. | |
| Photochemistry in the strong coupling regime: A trajectory surface hopping scheme | 1-gen-2020 | Fregoni, J.; Corni, S.; Persico, M.; Granucci, G. | |
| Strong Coupling with Light Enhances the Photoisomerization Quantum Yield of Azobenzene | 1-gen-2020 | Fregoni, J.; Granucci, G.; Persico, M.; Corni, S. | |
| Diabatization by localization in the framework of configuration interaction based on floating occupation molecular orbitals (FOMO-CI). | 1-gen-2019 | Accomasso, Davide; Granucci, Giovanni; Persico, Maurizio | |
| Nonadiabatic dynamics simulations of singlet fission in 2,5-bis(fluorene-9-ylidene)-2,5-dihydrothiophene crystals | 1-gen-2019 | Wibowo, Meilani; Persico, Maurizio; Granucci, Giovanni |