Претрага




Резултати

Control of a photoswitching chelator by metal ions: DFT, NBO, and QTAIM analysis   [2015]

Dimić, Dušan  ; Petković, Milena  

Density functional theory study of the multimode Jahn-Teller problem in the fullerene anion   [2013]

Ramanantoanina, Harry; Gruden-Pavlović, Maja  ; Zlatar, Matija  ; Daul, Claude

Geometric approach to vertex‐degree‐based topological indices–Elliptic Sombor index, theory and application   [2024]

Gutman, Ivan  ; Furtula, Boris  ; Oz, Mert Sinan

The choice of the exchange-correlation functional for the determination of the Jahn-Teller parameters by the density functional theory   [2013]

Anđelković, Ljubica  ; Gruden-Pavlović, Maja  ; Daul, Claude; Zlatar, Matija  

Influence of metal ion on chelate-aryl stacking interactions   [2018]

Malenov, Dušan P.  ; Hall, Michael B.; Zarić, Snežana D.  

Steiner degree distance indices: Chemical applicability and bounds   [2020]

Redžepović, Izudin  ; Mao, Yaping; Wang, Zhao; Furtula, Boris  

Theoretical scrutinization of nine benzoic acid dimers: Stability and energy decomposition analysis   [2019]

Petrović, Ivana; Milovanović, Branislav  ; Etinski, Mihajlo  ; Petković, Milena  

Density functional approximations for consistent spin and oxidation states of oxoiron complexes   [2020]

Vlahović, Filip  ; Gruden-Pavlović, Maja  ; Stepanović, Stepan ; Swart, Marcel

Theoretical study of metal ligand aromatic cation-pi interactions of [Co(NH3)(6)](3+) with benzene   [2002]

Zmiric, A; Milčić, Miloš K.  ; Zarić, Snežana D.  

Partition of topological indices of benzenoid hydrocarbons into ring contributions   [2023]

Redžepović, Izudin  ; Slađana Ðorđević  ; Simon Brezovnik; Niko Tratnik; Petra Žigert Pleteršek; Boris, Furtula  ; Slavko Radenković  

Филтери

По типу