MEDVES, MARCO
MEDVES, MARCO
Dipartimento di Scienze Chimiche e Farmaceutiche
A Resolution of Identity Technique to Speed up TDDFT with Hybrid Functionals: Implementation and Application to the Magic Cluster Series Au8n+4(SC6H5)4n+8 (n = 3–6)
2023-01-01 D’Antoni, Pierpaolo; Medves, Marco; Toffoli, Daniele; Fortunelli, Alessandro; Stener, Mauro; Visscher, Lucas
An efficient hybrid scheme for time dependent density functional theory
2020-01-01 Medves, M.; Sementa, L.; Toffoli, D.; Fronzoni, G.; Fortunelli, A.; Stener, M.
Chiral Functionalization of an Atomically Precise Noble Metal Cluster: Insights into the Origin of Chirality and Photoluminescence
2020-01-01 Krishnadas, K. R.; Sementa, L.; Medves, M.; Fortunelli, A.; Stener, M.; Furstenberg, A.; Longhi, G.; Burgi, T.
Coupling between Plasmonic and Molecular Excitations: TDDFT Investigation of an Ag-Nanorod/BODIPY-Dye Interaction
2022-01-01 Medves, Marco; Toffoli, Daniele; Stener, Mauro; Sementa, Luca; Fortunelli, Alessandro
Crystal Structure of Au36-xAgx(SPh- tBu)24 Nanoalloy and the Role of Ag Doping in Excited State Coupling
2019-01-01 Sakthivel, N. A.; Stener, M.; Sementa, L.; Medves, M.; Ramakrishna, G.; Fortunelli, A.; Oliver, A. G.; Dass, A.
Optimization of density fitting auxiliary Slater-type basis functions for time-dependent density functional theory
2022-01-01 Medves, Marco; Fronzoni, Giovanna; Stener, Mauro
Plasmonic circular dichroism in chiral gold nanowire dimers
2022-01-01 Toffoli, D.; Medves, M.; Fronzoni, G.; Coccia, E.; Stener, M.; Sementa, L.; Fortunelli, A.
Predictive optical photoabsorption of Ag24Au(DMBT)18-via efficient TDDFT simulations
2021-01-01 Medves, M.; Sementa, L.; Toffoli, D.; Fronzoni, G.; Krishnadas, K. R.; Burgi, T.; Bonacchi, S.; Dainese, T.; Maran, F.; Fortunelli, A.; Stener, M.
Spettroscopia computazionale di cluster metallici: sviluppo metodi ed applicazioni
2022-10-11 Medves, Marco