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Magnetic anisotropy in pentagonal bipyramidal complexes of first-row transition metal ions / Magnetna anizotropija u pentagonalno bipiramidalnim kompleksima prve serije prelaznih metala
(Belgrade : Serbian Chemical Society, 2022)
We present a validation study that aims to accurately describe magnetic anisotropy using the density functional theory (DFT) approach. We have examined 26 seven-coordinate high-spin first-row transition metal complexes ...
Poster presentation: "Synthesis and characterization of binuclear azide-bridged hydrazone Cu(II) complex"
(TMMagCat project, 2023)
The condensation product of 7-acetyl-6-azaindole and Girard’s T reagent ((E)-2-(2-(1-(1H-pyrrolo[2,3-c]pyridin-7-yl)ethylidene)hydrazineyl)-N,N,N-trimethyl-2-oxoethan-1-aminium, HL ligand) was used as a ligand in the ...
Lecture: "Open science from the perspective of a researcher" / Predavanje: "Otvorena nauka iz ugla istraživača"
(TMMagCat project, 2023)
U ovoj prezentaciji predstavljeni su osnovni principi "otvorene nauke." Predstavljena je dobra praksa u primeni tih principa i iskustva sa stanovišta istraživača. U okviru prezentacije je predstavljen institucionalni ...
Magnetic anisotropy in pentagonal bipyramidal complexes of first-row transition metal ions
(TMMagCat project, 2022)
Poster presented at: 58th Meeting of the Serbian Chemical Society, Belgrade, Serbia, June 9-10, 2022.
Synthesis and characterization of binuclear azide-bridged hydrazone Cu(II) complex
(Belgrade : Serbian Chemical SocietyBelgrade : Serbian Young Chemists’ Club, 2023)
The condensation product of 7-acetyl-6-azaindole and Girard’s T reagent ((E)-2-(2-(1-
(1H-pyrrolo[2,3-c]pyridin-7-yl)ethylidene)hydrazineyl)-N,N,N-trimethyl-2-oxoethan-1-aminium, HL ligand) was used as a ligand in the ...
Supporting Information for: "Correlating Structure and KA2 Catalytic Activity of Zn(II) Hydrazone Complexes"
(Wiley, 2023)
Two new Zn(II) complexes bearing tridentate hydrazone-based ligands with NNO or NNS donor atoms were synthesised and characterised by elemental analysis, infrared (IR) and nuclear magnetic resonance (NMR) spectroscopies, ...
Rational Design of Single-Ion Magnets – Computational Chemistry Approach
(Serbian Ceramic Society, 2023)
In this talk, the computational study of magnetic anisotropy in a series of transition metal complexes will be presented when changing the metal ion or the ligands in a controlled way. We will discuss the influences of ...
Understanding the fate of electronically excited states by quantum chemical calculations
(Prague, Czech Republic : J. Heyrovský Institute of Physical Chemistry CAS, 2023)
The electronically excited states of transition metal complexes are classified into inter-configurational and intra-configurational metal-centered, ligand-centered, and charge transfer
states. Different (de)localization ...
Relativistic DFT calculation and their effect on the accuracy of results
(Kragujevac, Serbia : Institute for Information Technologies, University of Kragujevac, 2023)
This study explores the significance of density functional theory (DFT) calculations with relativistic effects for two ethylenediaminetetraacetate (edta) type complexes: trans(O5)-[M(eddadp)]- (M = Rh3+, Co3+). Relativistic ...
Predavanje: "Praktični aspekti otvorene nauke – razmišljanja jednog hemičara" / Lecture: "Practical aspects of open science - thoughts of a chemist"
(Zajednica otvorene nauke Srbije / Open Science Community SerbiaTMMagCat project, 2023)
Otvorena nauka je sagledana sa ličnog stanovišta istraživača, administratora institucionalnog repozitorijuma i rukovodioca naučnog projekta. U okviru prezentacije je predstavljen institucionalni repozitorijum IHTM-a. Na ...