List of Conference Proceedings
- Pejić. Energy Landscapes, Crystal Structure Prediction and Modeling of Multicomponent Rare Earth Compounds. Energy Landscapes 2024, Lovran, Croatia, (2024).
- Zagorac, C. Buyer, J. Zagorac, H. Grossholz, S. Wolf, T. Škundrić, M. Pejić, D. Jovanović, J. C. Schön, T. Schleid. Study of lanthanum fluoride selenides using a combination of crystal structure prediction and DFT calculations with experimental synthesis and characterization. 2nd International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2023), pp. 47.
- Škundrić, J. C. Schön, A. Zarubica, M. Fonović, M. Pejić, J. Zagorac, D. Zagorac. Energy landscape exploration of the novel CrSi₂N₄ compound. 2nd International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2023), pp. 56.
- Zagorac, J. Zagorac, M. Fonović, T. Škundrić, M. Pejić, D. Jovanović, M. B. Đukić, B. Matović. Structure-property relationship of AlN/BN mixed compounds on DFT level. 2nd International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2023), pp. 70.
- Zagorac, D. Jovanović, D. Zagorac, T. Škundrić, M. Pejić, V. Šrot, B. Matović. Multidisciplinary approach in investigating ZnO/ZnS core/shell nanostructures. 2nd International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2023), pp. 72.
- Pejić, D. Zagorac, J. Zagorac, T. Škundrić, D. Jovanović, B. Matović. Energy landscape exploration of novel rare earth chalcohalides LaXY (X=O,S; Y=I,F). 2nd International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2023), pp. 76.
- Zagorac, J. Zagorac, T. Škundrić, M. Pejić, D. Jovanović, M. Fonović, J. C. Schön. SCANDIUM OXYCHLORIDE (SCOCL): STRUCTURE PREDICTION USING A MULTI-METHODOLOGICAL APPROACH. 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 44.
- Zagorac, J. C. Schön, D. Jovanović, D. Zagorac, T. Škundrić, M. Pejić, M. Prekajski, B. Matović. COMPUTATIONAL DISCOVERY OF NEW FEASIBLE CRYSTAL STRUCTURES IN Ce₃O₃N. 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 70.
- Pejić, D. Zagorac, J. Zagorac, T. Škundrić, B. Matović. STRUCTURAL PROPERTIES OF MULTICOMPONENT SOLID SOLUTIONS WITH PYROCHLORE STRUCTURE ON DFT LEVEL. 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 72–73.
- Škundrić, D. Zagorac, M. Pejić, D. Jovanović, J. Zagorac, B. Matović. AB INITIO INVESTIGATION OF THE NOVEL Cr₂SiN₄ COMPOUND UNDER EXTREME PRESSURE CONDITIONS. 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 91–92.
- Zagorac, J. Zagorac, M. Fonović, T. Škundrić, M. Pejić, D. Jovanović, M. B. Đukić, B. Matović. THEORETICAL STUDY OF AlN/BN MIXED CHEMICAL SYSTEMS AND THEIR MECHANICAL PROPERTIES. 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 92.
- Škundrić, D. Zagorac, M. Pejić, D. Jovanović, J. Zagorac, B. Matović. ENERGY LANDSCAPE EXPLORATION AND CRYSTAL STRUCTURE PREDICTION OF TWO NOVEL COMPOUNDS IN THE Cr-Si-N SYSTEM. 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 93.
- Zagorac, D. Zagorac, V. Šrot, M. Ranđelović, M. Pejić, P. A. van Aken, B. Matović, J. C. Schön. ZnO/ZnS CORE/SHELL NANOSTRUCTURES: EXPERIMENTS COMBINED WITH AB INITIO CALCULATIONS. 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 94.
- Pejić, D. Zagorac, J. C. Schön, J. Zagorac, T. Škundrić, B. Matović. ENERGY LANDSCAPE AND CRYSTAL STRUCTURE INVESTIGATIONS OF LANTHANUM FLUORO SULFIDE LaFS. 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 95–96.
- Jovanović, J. C. Schön, D. Zagorac, A. Zarubica, B. Matović, M. Pejić, T. Škundrić, J. Zagorac. DFT STUDY OF GLUTAMINE (L) MOLECULE INTERACTION WITH THE 001 AND 101 ANATASE SLAB SURFACES IN A VACUUM. 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 97–98.
- Jovanović, D. Zagorac, J. C. Schön, A. Zarubica, B. Matović, M. Pejić, T. Škundrić, J. Zagorac. DFT STUDY OF NEW HYBRID ORGANIC-INORGANIC PEROVSKITES: GUANIDINIUM-BX₃ SUBSTITUTED BY B = (Sn²⁺, Ge²⁺, Ba²⁺, Zn²⁺) AND X = (I⁻, Br⁻). 7th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2023), pp. 99–100.
- Pejić, D. Zagorac, J. Zagorac, T. Škundrić, D. Jovanović, B. Matović. EFFECT OF ALUMINUM ADDITION ON THE STRUCTURE AND ELECTRONIC PROPERTIES OF BORON NITRIDE. 6th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2022), pp. 28.
- Zagorac, J. Zagorac, K. Doll, T. Škundrić, M. Pejić, D. Jovanović, B. Matović. BARIUM SULFIDE UNDER PRESSURE: STRUCTURAL CHANGES, BAND GAP ENGINEERING AND MECHANICAL PROPERTIES. 6th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2022), pp. 30.
- Jovanović, J. C. Schön, D. Zagorac, B. Matović, M. Pejić, T. Škundrić, A. Zarubica, J. Zagorac. ENERGY LANDSCAPE OF A RELAXED AMINO ACID, GLUTAMINE (L), ON TiO₂ SURFACES. 6th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2022), pp. 41.
- Pejić, D. Zagorac, J. Zagorac, T. Škundrić, D. Jovanović, B. Matović. FIRST-PRINCIPLES INVESTIGATION AND STRUCTURE PREDICTION IN HOLMIUM(III) FLUORO-SELENIDE SYSTEM. 6th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2022), pp. 42–43.
- Škundrić, D. Zagorac, J. Zagorac, J. C. Schön, M. Pejić, D. Jovanović, B. Matović. ENERGY LANDSCAPE OF THE NOVEL Cr₂SiN₄ COMPOUND DERIVED USING COMBINATION OF THEORETICAL METHODS. 6th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2022), pp. 78–79.
- Zagorac, I. Cvijović-Alagić, J. Zagorac, S. Butulija, J. Erčić, O. Hanzel, R. Sedlák, M. Lisnichuk, T. Škundrić, M. Pejić, D. Jovanović, P. Tatarko, B. Matović. STRUCTURAL AND MECHANICAL PROPERTIES OF HIGH-ENTROPY ALLOYS (HEAS) – ULTRA-HIGH TEMPERATURE CERAMICS (UHTC) ON DFT LEVEL. 6th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2022), pp. 80–81.
- Škundrić, D. Zagorac, A. Zarubica, J. Zagorac, M. Pejić, D. Jovanović, P. Tatarko, B. Matović. PREDICTION OF STRUCTURE CANDIDATES FOR SiB₆ COMPOUND USING A COMBINATION OF DATA MINING AND THE PCAE METHOD. 6th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2022), pp. 81–82.
- Jovanović, D. Zagorac, B. Matović, M. Pejić, T. Škundrić, A. Zarubica, J. Zagorac. THEORETICAL STUDY ON ANION SUBSTITUTION OF TiO1-xSx (x = 0, 0.25, 0.5, 0.75 AND 1) COMPOUNDS AND THE INFLUENCE OF SULFUR ON CRYSTAL STRUCTURES, PHASE TRANSITIONS AND ELECTRONIC PROPERTIES. 6th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2022), pp. 83.
- Pejić, D. Zagorac, J. Zagorac, T. Škundrić, D. Jovanović, B. Matović. ENERGY LANDSCAPE EXPLORATION OF NOVEL TERNARY RARE-EARTH COMPOUND LaIO. 6th Conference of The Serbian Society for Ceramic Materials, Belgrade, Serbia (2022), pp. 84.
- Pejić, D. Zagorac, J. Zagorac, T. Škundrić, D. Jovanović, C. J. Schőn, B. Matović. Predicting stable modifications of Ce₂ON₂ using a combination of global optimization and data mining. 1st International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2022), pp. 34.
- Zagorac, I. Cvijović-Alagić, J. Zagorac, S. Butulija, J. Erčić, O. Hanzel, R. Sedlák, M. Lisnichuk, T. Škundrić, M. Pejić, D. Jovanović, P. Tatarko, B. Matović. DFT study of structural stability and mechanical properties: High-Entropy Alloys (HEAs) – Ultra-High Temperature Ceramics (UHTC). 1st International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2022), pp. 43.
- Jovanović, D. Zagorac, B. Matović, M. Pejić, T. Škundrić, J. Zagorac. Anion substitution and the structure-property influence of sulfur on mixed TiO₂/TiS₂ compounds. 1st International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2022), pp. 45.
- Zagorac, D. Jovanović, D. Zagorac, T. Škundrić, M. Pejić, B. Matović. Crystal structure and properties of theoretically predicted c-AlB₁₂. 1st International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2022), pp. 48.
- Pejić, D. Zagorac, J. Zagorac, T. Škundrić, D. Jovanović, B. Matović. Energy landscape and crystal structure investigations of holmium (III) fluoro-selenide HoFSe. 1st International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2022), pp. 53.
- Pejić, D. Zagorac, J. Zagorac, T. Škundrić, D. Jovanović, B. Matović. Theoretical study of ground state properties of Na⁺, Cs⁺, Mg²⁺ and Ba²⁺ doped mayenite and its electride forms under extreme conditions. 1st International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2022), pp. 54.
- Škundrić, D. Zagorac, J. C. Schön, J. Zagorac, M. Pejić, D. Jovanović, B. Matović. Crystal structure prediction of novel Cr₂SiN₄ compound under extreme conditions. 1st International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2022), pp. 59.
33. T. Škundrić, D. Zagorac, A. Zarubica, J. Zagorac, M. Pejić, D. Jovanović, P. Tatarko, B. Matović. Mechanical and elastic properties of SiB₆: Theoretical investigations through ab initio calculations. 1st International Conference on Innovative Materials in Extreme Conditions, Belgrade, Serbia (2022), pp. 60.
