Browsing by Project
COST Action "COnvergent Distributed Environment for Computational Spectroscopy (CODECS)'' - CM1002
Showing results 1 to 5 of 5
| Issue Date | Title | Author(s) | Type | Мp-cat. |
| 2012 | A general approach to analyze the multimode JT distortion: Case study on fullerene ions | Zlatar, Matija   ; Daul, Claude; Gruden-Pavlović, Maja | Conference Paper | |
| 2013 | A simple monomer-based model-Hamiltonian approach to combine excitonic coupling and Jahn-Teller theory | Garcia-Fernandez, Pablo; Anđelković, Ljubica ; Zlatar, Matija ; Gruden-Pavlović, Maja ; Dreuw, Andreas | Article | |
| 2013 | An improved AMBER force field for alpha,alpha-dialkylated peptides: intrinsic and solvent-induced conformational preferences of model systems | Grubišić, Sonja ; Brancato, Giuseppe; Barone, Vincenzo | Article | |
| 2012 | Excited state properties of Cr3+ in Cs2NaYC16 and Cs2NaYBr6: A DFT study Of the Jahn-Teller distorsion in the excited state | Ramanantoanina, Harimbola; Zlatar, Matija ; Gruden-Pavlović, Maja ; Daul, Claude | Conference Paper | |
| 2012 | Extension of the AMBER force field to cyclic alpha,alpha dialkylated peptides | Grubišić, Sonja ; Brancato, Giuseppe; Pedone, Alfonso; Barone, Vincenzo | Article | |