Researchers



Results 21-40 of 66
Issue DateTitleAuthor(s)TypeМp-cat.
2024Multidisciplinary approach in investigating ZnO/ZnS core/shell nanostructuresZagorac, Jelena  ; Jovanović, Dušica; Zagorac, Dejan  ; Škundrić, Tamara  ; Pejić, Milan  ; Šrot, Vesna; Matović, Branko  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
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
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
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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
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
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2024Structure Prediction and Mechanical Properties of Tantalum Carbide (TaC) on ab initio LevelZagorac, Dejan  ; Zagorac, Jelena B.  ; Škundrić, Tamara  ; Pejić, Milan  ; Jovanović, Dušica; Schön, Christian J.Article
22M22
2023Energy landscape and crystal structure investigations of lanthanum fluoro sulfide LaFSPejić, Milan  ; Zagorac, Dejan  ; Schön, Christian; Zagorac, Jelena  ; Škundrić, Tamara  ; Matović, Branko  Conference Paper
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2023Exploring the energy landscape and crystal structures of CrSi2N4Škundrić, Tamara  ; Schön, Christian; Zarubica, Aleksandra  ; Fonović, Matej; Zagorac, Dejan  Article
22M22
2023Scandium oxychloride (SCOCL): structure prediction using a multi-methodological approachZagorac, Dejan  ; Zagorac, Jelena  ; Škundrić, Tamara  ; Pejić, Milan  ; Jovanović, Dušica; Fonović, Matej; Schön, ChristianConference Paper
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2023Structural properties o multicomponent solid solutions with pyrochlore structure on DFT levelPejić, Milan  ; Zagorac, Dejan  ; Zagorac, Jelena  ; Škundrić, Tamara  ; Matović, Branko  Conference Paper
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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
2023Data-Mining Ab Initio Study of Gypsum and CaCO3 Modifications at Standard and Extreme ConditionsŠkundrić, Tamara  ; Matović, Branko  ; Zarubica, Aleksandra  ; Chudoba, Dorota; Zagorac, Dejan  Article
54M54
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
2023Ab initio investigation of the novel Cr2SiN4 compound under extreme pressure conditionsŠkundrić, Tamara  ; Zagorac, Dejan  ; Pejić, Milan  ; Jovanović, Dušica; Zagorac, Jelena  ; Matović, Branko  Conference Paper
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2023Energy landscape exploration and crystal structure prediction of two novel compounds in the Cr-Si-N systemŠkundrić, Tamara  ; Zagorac, Dejan  ; Pejić, Milan  ; Jovanović, Dušica; Zagorac, Jelena  ; Matović, Branko  Conference Paper
Mp. category will be shown later
2023DFT study of glutamine (L) molecule interaction with the 001 and 101 anatase slab surfaces in a vacuumJovanović, Dušica; Schön, Christian J.; Zagorac, Dejan  ; Zarubica, Aleksandra; Matović, Branko  ; Pejić, Milan  ; Škundrić, Tamara  ; Zagorac, Jelena B.  Conference Paper
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2022Crystal structure prediction of novel Cr2SiN4 compound under extreme conditionsŠkundrić, Tamara  ; Zagorac, Dejan  ; Schön, Johann Christian; Zagorac, Jelena  ; Pejić, Milan  ; Jovanović, Dušica; Matović, Branko  Conference Paper
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2022Anion substitution and the structure-property influence of sulfur on mixed TiO2/TiS2 compoundsJovanović, Dušica; Zagorac, Dejan  ; Matović, Branko  ; Pejić, Milan  ; Škundrić, Tamara  ; Zagorac, Jelena  Conference Paper
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2022Effect of aluminum addition on the structure and electronic properties of boron nitrideZagorac, Jelena  ; Jovanović, Dušica; Zagorac, Dejan  ; Škundrić, Tamara  ; Pejić, Milan  ; Matović, Branko  Conference Paper
Mp. category will be shown later