Sfoglia per Autore
CPL calculations of [7]helicenes with alleged exceptional emission dissymmetry values
2023-01-01 Guido, Ciro A.; Zinna, Francesco; Pescitelli, Gennaro
Exploring the Spatial Features of Electronic Transitions in Molecular and Biomolecular Systems by Swift Electrons
2021-01-01 Guido, C; Rotunno, E; Zanfrognini, M; Corni, S; Grillo, V
Simple Protocol for Capturing Both Linear-Response and State-Specific Effects in Excited-State Calculations with Continuum Solvation Models
2021-01-01 Guido, C; Chrayteh, A; Scalmani, G; Mennucci, B; Jacquemin, D
An open quantum system theory for polarizable continuum models
2020-01-01 Guido, C. A.; Rosa, M.; Cammi, R.; Corni, S.
Hybrid theoretical models for molecular nanoplasmonics
2020-01-01 Coccia, E.; Fregoni, J.; Guido, C. A.; Marsili, M.; Pipolo, S.; Corni, S.
Investigating ultrafast two-pulse experiments on single DNQDI fluorophores: A stochastic quantum approach
2020-01-01 Dall'Osto, G.; Coccia, E.; Guido, C. A.; Corni, S.
On the description of the environment polarization response to electronic transitions
2019-01-01 Guido, C; Caprasecca, S
First-principle investigation of the double ESIPT process in a thiophene-based dye
2018-01-01 Vérité, P; Guido, C; Jacquemin, D
Density-Dependent Formulation of Dispersion-Repulsion Interactions in Hybrid Multiscale Quantum/Molecular Mechanics (QM/MM) Models
2018-01-01 Curutchet, Carles; Cupellini, Lorenzo; Kongsted, Jacob; Corni, Stefano; Frediani, Luca; Steindal, Arnfinn Hykkerud; Guido, CIRO ACHILLE; Scalmani, Giovanni; Mennucci, Benedetta
Excited State Dipole Moments in Solution: Comparison between State-Specific and Linear-Response TD-DFT Values
2018-01-01 Guido, C; Mennucci, B; Scalmani, G; Jacquemin, D
Coupling to Charge Transfer States is the Key to Modulate the Optical Bands for Efficient Light Harvesting in Purple Bacteria
2018-01-01 Cupellini, L; Caprasecca, S; Guido, C; Muh, F; Renger, T; Mennucci, B
EXAT: EXcitonic analysis tool
2018-01-01 Jurinovich, S; Cupellini, L; Guido, C; Mennucci, B
The Bethe-Salpeter formalism with polarisable continuum embedding: reconciling linear-response and state-specific features
2018-01-01 Duchemin, Ivan; Guido, C; Jacquemin, Denis; Blase, Xavier
Metrics for Molecular Electronic Excitations: A Comparison between Orbital- and Density-Based Descriptors
2017-01-01 Savarese, M; Guido, C; Bremond, E; Ciofini, I; Adamo, C
Excited state gradients for a state-specific continuum solvation approach: The vertical excitation model within a Lagrangian TDDFT formulation
2017-01-01 Guido, C; Scalmani, G; Mennucci, B; Jacquemin, D
An Ab Initio Description of the Excitonic Properties of LH2 and Their Temperature Dependence
2016-01-01 Cupellini, L; Jurinovich, S; Campetella, M; Caprasecca, S; Guido, C; Kelly, Sm; Gardiner, At; Cogdell, R; Mennucci, B
“Computational studies of environmental effects and their interplay with experiment”
2016-01-01 Mennucci, Benedetta; Caprasecca, Stefano; Guido, C
Control of Coherences and Optical Responses of Pigment-Protein Complexes by Plasmonic Nanoantennae
2016-01-01 Caprasecca, S.; Guido, C. A.; Mennucci, B.
Circularly Polarized Luminescence from Axially Chiral BODIPY DYEmers: An Experimental and Computational Study
2016-01-01 Zinna, Francesco; Bruhn, Torsten; Guido, Ciro Achille; Ahrens, Johannes; Bröring, Martin; DI BARI, Lorenzo; Pescitelli, Gennaro
Electronic Excitations in Solution: The Interplay between State Specific Approaches and a Time-Dependent Density Functional Theory Description
2015-01-01 Guido, C. A.; Jacquemin, D.; Adamo, C.; Mennucci, B.
Legenda icone
- file ad accesso aperto
- file disponibili sulla rete interna
- file disponibili agli utenti autorizzati
- file disponibili solo agli amministratori
- file sotto embargo
- nessun file disponibile