Researchers



Results 41-60 of 173
Issue DateTitleAuthor(s)TypeМp-cat.
2024DFT study of new hybrid organic-inorganic perovskites: guanidinium-BX3 substituted by B=(Sr2+, Ca2+, Mg2+, Be2+) and X=(Cl-, F-)Jovanović, Dušica; Zagorac, Dejan  ; Schön, Christian J.; Matović, Branko  ; Zarubica, Aleksandra  ; Zagorac, Jelena  Conference Paper
Mp. category will be shown later
2024Mechanical properties and behavior of the Ti–45Nb alloy subjected to extreme conditionsZagorac, Dejan  ; Prasad, Dasari; Škundrić, Tamara  ; Yadav, Kedar; Singh, Surender; Laketić, Slađana  ; Zagorac, Jelena  ; Momčilović, Miloš  ; Cvijović-Alagić, Ivana  Article
21M21
2024Structural properties of full-scope AlN/BN compounds investigated using ab initio calculationsZagorac, Jelena  ; Fonović, Matej; Đukić, Miloš B.  ; Butulija, Svetlana  ; Prikhna, Tatiana; Zagorac, Dejan  Conference Paper
Mp. category will be shown later
2024Theoretical modifications of CrSi2N4 at extreme conditionsŠkundrić, Tamara  ; Zagorac, Dejan  ; Pejić, Milan  ; Jovanović, Dušica; Zagorac, Jelena  ; Fonović, Matej; Matović, Branko  Article
53M53
2024Structure-property relationship of AlN/BN mixed compounds on DFT levelZagorac, Dejan  ; Zagorac, Jelena  ; Fonović, Matej; Škundrić, Tamara  ; Pejić, Milan  ; Jovanović, Dušica; Đukić, Miloš B.  ; Matović, Branko  Conference Paper
Mp. category will be shown later
2024Structures, Phase Stability, Amorphization, and Decomposition of V6O13 at High Pressures and Temperatures: Synthesis of Rutile-Related V0.92O2Grzechnik, Andrzej; Hakala, Viliam; Kurig, Sophia; Walte, Nicolas; Tsujino, Noriyoshi; Kakizawa, Sho; Higo, Yuji; Zagorac, Dejan  ; Zagorac, Jelena  ; Dronskowski, Richard;
Schön, Christian; Friese, Karen;
Article
21M21
2024Study of lanthanum fluoride selenides using a combination of crystal structure prediction and DFT calculations with experimental synthesis and characterizationZagorac, Dejan  ; Buyer, Constantin; Zagorac, Jelena  ; Grossholz, Hagen; Wolf, Sarah; Škundrić, Tamara  ; Pejić, Milan  ; Jovanović, Dušica; Schön, Christian J.; Schleid, ThomasConference Paper
Mp. category will be shown later
2024Novel modifications of Ti4Nb alloy: a multi-methodological approachZagorac, Dejan  ; Zagorac, Jelena  ; Škundrić, Tamara  ; Pejić, Milan  ; Yadav, Kedar; Jovanović, Dušica; Cvijović-Alagić, Ivana  ; Prasad, Dasari L.V. K.Article
53M53
2024Hafnium Carbide: Prediction of Crystalline Structures and Investigation of Mechanical PropertiesZagorac, Jelena  ; Schön, Johann Christian; Matović, Branko  ; Butulija, Svetlana  ; Zagorac, Dejan  Article
21M21
2023Theoretical study of new hybrid organic-inorganic perovskites: Guanidinium-BX3 substituted by B=(Sn2+, Ge2+, Ba2+, Zn2+) and X=(I−, Br−)Jovanović, Dušica; Zagorac, Dejan  ; Schön, Christian; Zagorac, Jelena  Conference Paper
Mp. category will be shown later
2023Synthesis, Characterization, and Electronic Properties of ZnO/ZnS Core/Shell Nanostructures Investigated Using a Multidisciplinary ApproachZagorac, Jelena  ; Zagorac, Dejan  ; Šrot, Vesna; Ranđelović, Marjan  ; Pejić, Milan  ; van Aken, Peter A.; Matović, Branko  ; Schön, Christian J.Article
21M21
2023Computational discovery of new feasible crystal structures in Ce3O3NZagorac, Jelena  ; Schön, Christian; Jovanović, Dušica; Zagorac, Dejan  ; Škundrić, Tamara  ; Pejić, Milan  ; Prekajski, Marija D.  ; Matović, Branko  Conference Paper
Mp. category will be shown later
2023Energy Landscape of Relaxation and Interaction of an Amino Acid, Glutamine (L), on Pristine and Au/Ag/Cu-Doped TiO2 SurfacesJovanović, Dušica; Schön, Johann Christian; Zagorac, Dejan  ; Zarubica, Aleksandra  ; Matović, Branko  ; Zagorac, Jelena  Article
21M21
2023Characterization of High-Entropy A2B2O7 Pyrochlore Obtained via Combustion Synthesis and Post-CalcinationMatović, Branko  ; Maletaškić, Jelena  ; Maksimović, Vesna  ; Dimitrijević, Silvana  ; Todorović, Branislav; Zagorac, Jelena  ; Zeng, Yu-Ping; Cvijović-Alagić, Ivana  Conference Paper
Mp. category will be shown later
2023DFT Study of Crystalline TiO2 Phase Transitions Applicable in Extreme EnvironmentsJovanović, Dušica; Zagorac, Dejan  ; Zarubica, Aleksandra  ; Fonović, Matej; Zagorac, Jelena B.  Article
54M54
2023Energy landscape and crystal structure investigations of lanthanum fluoro sulfide LaFSPejić, Milan  ; Zagorac, Dejan  ; Schön, Christian; Zagorac, Jelena  ; Škundrić, Tamara  ; Matović, Branko  Conference Paper
Mp. category will be shown later
2023Structural properties o multicomponent solid solutions with pyrochlore structure on DFT levelPejić, Milan  ; Zagorac, Dejan  ; Zagorac, Jelena  ; Škundrić, Tamara  ; Matović, Branko  Conference Paper
Mp. category will be shown later
2023Scandium oxychloride (SCOCL): structure prediction using a multi-methodological approachZagorac, Dejan  ; Zagorac, Jelena  ; Škundrić, Tamara  ; Pejić, Milan  ; Jovanović, Dušica; Fonović, Matej; Schön, ChristianConference Paper
Mp. category will be shown later
2023Theoretical study of AlN/BN mixed chemical systems and their mechanical propertiesZagorac, Dejan  ; Zagorac, Jelena  ; Fonović, Matej; Škundrić, Tamara  ; Pejić, Milan  ; Jovanović, Dušica; Đukić, M.; Matović, Branko  Conference Paper
Mp. category will be shown later
2023Multicomponent solid solution with pyrochlore structureMatović, Branko  ; Maletaškić, Jelena  ; Maksimović, Vesna  ; Dimitrijević, Stevan P.  ; Todorović, Bratislav  ; Pejić, Milan  ; Zagorac, Dejan  ; Zagorac, Jelena  ; Zeng, Yu-Ping; Cvijović-Alagić, Ivana  Article
21M21