Researchers



Results 61-80 of 151
Issue DateTitleAuthor(s)TypeМp-cat.
2018Rotating Iron and Titanium Sandwich ComplexesVlahović, Filip  ; Gruden-Pavlović, Maja  ; Swart, MarcelArticle
21M21
2018Selective Photo-Induced Oxidation with O-2 of a Non-Heme Iron(III) Complex to a Bis(imine-pyridyl)iron(II) ComplexChen, Juan; Unjaroen, Duenpen; Stepanović, Stepan ; van Dam, Annie; Gruden-Pavlović, Maja  ; Browne, Wesley R.Article
21aM21a
2018Experimental and Theoretical Identification of the Origin of Magnetic Anisotropy in Intermediate Spin Iron(III) ComplexesWang, Lianke; Zlatar, Matija  ; Vlahović, Filip  ; Demeshko, Serhiy; Philouze, Christian; Molton, Florian; Gennari, Marcello; Meyer, Franc; Duboc, Carole; Gruden-Pavlović, Maja  Article
21M21
2018A Non-Heme Iron Photocatalyst for Light-Driven Aerobic Oxidation of MethanolChen, Juan; Stepanović, Stepan ; Draksharapu, Apparao; Gruden-Pavlović, Maja  ; Browne, Wesley R.Article
21aM21a
2018Density functional theory calculation of lipophilicity - bridging the gap between experiment and theoryVlahović, Filip  ; Ivanović, Saša  ; Zlatar, Matija  ; Gruden, Maja  Conference Paper
Mp. category will be shown later
2017Benchmarking density functional tight binding models for barrier heights and reaction energetics of organic moleculesGruden, Maja  ; Anđelković, Ljubica  ; Jissy, Akkarapattiakal Kuriappan; Stepanović, Stepan ; Zlatar, Matija  ; Cui, Qiang; Elstner, MarcusArticle
21M21
2017A Glimpse into the Ligand Field Theory from Density Functional PerspectiveZlatar, Matija  ; Gruden, Maja  Conference Paper
Mp. category will be shown later
2017Rational design of single molecule magnetsZlatar, Matija  ; Gruden, Maja  Conference Paper
Mp. category will be shown later
2017Density functional theory calculation of lipophilicity for organophosphate type pesticidesVlahović, Filip  ; Ivanovic, Sasa  ; Zlatar, Matija  ; Gruden-Pavlović, Maja  Article
22M22
2017Rational Design of Single Molecule Magnets - Density Functional PerspectiveZlatar, Matija  ; Gruden, Maja  Conference Paper
Mp. category will be shown later
2017The role of spin states in the catalytic mechanism of the intra- and extradiol cleavage of catechols by O-2Stepanović, Stepan ; Angelone, D.; Gruden-Pavlović, Maja  ; Swart, MarcelArticle
21M21
2017in/out Isomerism of cyclophanes: a theoretical account of 2,6,15-trithia-[3(4,10)][7]metacyclophane and [3(4,10)][7]metacyclophane as well as their halogen substituted analoguesVujovic, Milena; Zlatar, Matija  ; Milčić, Miloš  ; Gruden, Maja  Article
21aM21a
2016Computational study of the spin-state energetics in manganese phthalocyanineAnđelković, Ljubica  ; Zlatar, Matija  ; Swart, Marcel; Gruden, Maja  Conference Paper
Mp. category will be shown later
2016Substituted naphthalenes: Stability, conformational flexibility and description of bonding based on ETS-NOCV methodStanković, Branislav S.  ; Ostojić, Bojana D.  ; Gruden-Pavlović, Maja  ; Popović, Aleksandar R.  ; Đorđević, Dragana S.  Article
22M22
2016Challenges in assignment of orbital populations in a high spin manganese(III) complexFitzpatrick, Anthony J.; Stepanović, Stepan ; Mueller-Bunz, Helge; Gruden-Pavlović, Maja  ; Garcia-Fernandez, Pablo; Morgan, Grace G.Article
21aM21a
2016Gold(I)-Catalyzed Domino Cyclizations of Diynes for the Synthesis of Functionalized Cyclohexenone Derivatives. Total Synthesis of (-)-Gabosine H and (-)-6-epi-Gabosine HVulović, Bojan  ; Kolarski, Dušan; Bihelović, Filip  ; Matović, Radomir  ; Gruden-Pavlović, Maja  ; Saičić, Radomir  Article
21aM21a
2016Praktikum iz opšte hemije : za studente I godine Hemijskog fakultetaGruden-Pavlović, Maja  ; Grgurić-Šipka, Sanja  ; Grubišić, Sonja  ; Niketić, SvetozarText book
Mp. category will be shown later
2016Spinning around in Transition-Metal ChemistrySwart, Marcel; Gruden-Pavlović, Maja  Article
21a+M21a+
2016Decarbonylative Dibromination of 5-Phenylthiophene-2-carbaldehyde with BromineAjdačić, Vladimir  ; Stepanović, Stepan ; Zlatović, Mario  ; Gruden-Pavlović, Maja  ; Opsenica, Igor  Article
21M21
2016Analysis of the Jahn-Teller effect in organic and inorganic systemsAnđelković, Ljubica  ; Zlatar, Matija  ; Gruden, Maja  Conference Paper
Mp. category will be shown later