Researchers



Results 101-120 of 151
Issue DateTitleAuthor(s)TypeМp-cat.
2014A Practical Computational Approach to Study Molecular Instability Using the Pseudo-Jahn-Teller EffectGarcia-Fernandez, Pablo; Antonio Aramburu, Jose; Moreno, Miguel; Zlatar, Matija  ; Gruden-Pavlović, Maja  Article
21aM21a
2014Synthesis, characterization, DFT calculation and biological activity of square-planar Ni(II) complexes with tridentate PNO ligands and monodentate pseudohalides. Part IIMilenković, Milica R.  ; Pevec, Andrej; Turel, Iztok; Vujčić, Miroslava  ; Milenković, Marina  ; Jovanović, Katarina; Gligorijević, Nevenka  ; Radulović, Siniša  ; Swart, Marcel; Gruden-Pavlović, Maja  ;
Adaila, Kawther; Čobeljić, Božidar  ; Anđelković, Katarina K. ;
Article
21aM21a
2014Synthesis, characterization, DFT calculations, and antimicrobial activity of Pd(II) and Co(III) complexes with the condensation derivative of 2-(diphenylphosphino) benzaldehyde and Girard's T reagentAdaila, Kawther; Milenković, Milica  ; Bacchi, Alessia; Cantoni, Giulia; Swart, Marcel; Gruden-Pavlović, Maja  ; Milenković, Marina  ; Cobeljić, Božidar  ; Todorović, Tamara  ; Anđelković, Katarina Article
21M21
2014Lipophilicity Assessment of Ruthenium(II)-Arene Complexes by the Means of Reversed-Phase Thin-Layer Chromatography and DFT CalculationsShweshein, Khalil Salem A. M.; Andrić, Filip  ; Radoičić, Aleksandra  ; Zlatar, Matija  ; Gruden-Pavlović, Maja  ; Tešić, Živoslav Lj. ; Milojković-Opsenica, Dušanka  Article
21M21
2013Density functional theory study of the multimode Jahn-Teller problem in the fullerene anionRamanantoanina, Harry; Gruden-Pavlović, Maja  ; Zlatar, Matija  ; Daul, ClaudeArticle
21M21
2013Role of Spin State and Ligand Charge in Coordination Patterns in Complexes of 2,6-Diacetylpyridinebis(semioxamazide) with 3d-Block Metal Ions: A Density Functional Theory StudyStepanović, Stepan ; Anđelković, Ljubica  ; Zlatar, Matija  ; Anđelković, Katarina K. ; Gruden-Pavlović, Maja  ; Swart, MarcelArticle
21aM21a
2013Computational study of the spin-state energies and UV-Vis spectra of bis(1,4,7-triazacyclononane) complexes of some first-row transition metal cationsZlatar, Matija  ; Gruden-Pavlović, Maja  ; Gueell, Mireia; Swart, MarcelArticle
21aM21a
2013General treatment of the multimode Jahn-Teller effect: study of fullerene cationsRamanantoanina, Harry; Zlatar, Matija  ; Garcia-Fernandez, Pablo; Daul, Claude; Gruden-Pavlović, Maja  Article
21aM21a
2013A simple monomer-based model-Hamiltonian approach to combine excitonic coupling and Jahn-Teller theoryGarcia-Fernandez, Pablo; Anđelković, Ljubica  ; Zlatar, Matija  ; Gruden-Pavlović, Maja  ; Dreuw, AndreasArticle
21M21
2013Spherical aromaticity of Jahn-Teller active fullerene ionsPerić, Marko  ; Anđelković, Ljubica  ; Zlatar, Matija  ; Nikolić, Aleksandar S. ; Daul, Claude; Gruden-Pavlović, Maja  Article
22M22
2013The choice of the exchange-correlation functional for the determination of the Jahn-Teller parameters by the density functional theoryAnđelković, Ljubica  ; Gruden-Pavlović, Maja  ; Daul, Claude; Zlatar, Matija  Article
21M21
2012Magnetic criteria of aromaticity in a benzene cation and anion: how does the Jahn-Teller effect influence the aromaticity?Anđelković, Ljubica  ; Perić, Marko  ; Zlatar, Matija  ; Grubišić, Sonja  ; Gruden-Pavlović, Maja  Article
21M21
2012Fullerene cation: The influence of the Jahn-Teller effect on the spherical aromaticityPerić, Marko  ; Anđelković, Ljubica  ; Zlatar, Matija  ; Gruden-Pavlović, Maja  Conference Paper
Mp. category will be shown later
2012Long range magnetic couplings mediated through the non-covalent interactions in multi copper metalloenzymesGruden-Pavlović, Maja  ; Perić, Marko  ; Zlatar, Matija  Conference Paper
Mp. category will be shown later
2012Dissociative Electron Attachment Measurements and TDDFT Calculations of the Excitation Energies in Pt(PF3)4: Sinergy Between Experiment and TheoryZlatar, Matija  ; May, Olivier; Gruden-Pavlović, Maja  ; Allan, MichaelConference Paper
Mp. category will be shown later
2012Magnetic couplings mediated through the non-covalent interactionsPerić, Marko  ; Zlatar, Matija  ; Grubišić, Sonja  ; Gruden-Pavlović, Maja  Article
21M21
2012Cobalt(II) and cadmium(II) compounds with adamantane-1-sulfonic acidĐorđević, Milena M.; Jeremić, Dejan  ; Anđelković, Katarina K. ; Gruden-Pavlović, Maja  ; Divjaković, Vladimir; Šumar-Ristović, Maja  ; Brčeski, Ilija  Article
22M22
2012Mechanism of the Magnetic Couplings Mediated Through the Non-covalent InteractionsGruden-Pavlović, Maja  ; Zlatar, Matija  ; Perić, Marko  Conference Paper
Mp. category will be shown later
2012Density Functional Theory Study of the Multimode Jahn-Teller Effect - Ground State Distortion of Benzene CationZlatar, Matija  ; Brog, Jean-Pierre; Tschannen, Alain; Gruden-Pavlović, Maja  ; Daul, ClaudeBook parts
Mp. category will be shown later
2012Mechano-chemical synthesis of stoichiometric nickel and nickel-zinc ferrite powders with Nicolson-Ross analysis of the absorption coefficientsJovalekic, Cedomir  ; Nikolić, Aleksandar S. ; Gruden-Pavlović, Maja  ; Pavlović, Miodrag B.Article
22M22