@ARTICLE{
author={Zagorac Jelena B,Zagorac Dejan B,Skundric Tamara M,Pejic Milan,Matovic Branko Z,Schoen Johann Christian},
year={2025},
title={Theoretical insight into structural and mechanical features of Hf0.5Ta0.5C},
journal={PROCESSING AND APPLICATION OF CERAMICS},
volume={19},
number={2},
pages={201-213},
document_type={Article},
} 

@ARTICLE{
author={Fischer Dieter,Bloos Dominik,Krajewska Aleksandra,McNally Graham M,Zagorac Dejan B,Schoen Johann Christian},
year={2025},
title={Raman Characterization of Dioxygen Species as Defects in Single-Crystal ZnO Including Their Pressure Dependence},
journal={CRYSTALS},
volume={15},
number={6},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Fischer Dieter,Zagorac Dejan B,Kuester Kathrin,Schoen Johann Christian},
year={2024},
title={Synthesis of Two Structurally Different MgO Films Containing Dioxygen Species: Dioxygen Embedded at Grain Boundaries, and as Components of a Superfilled Rock Salt Structure},
journal={COATINGS},
volume={14},
number={12},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Dejan B,Zagorac Jelena B,Skundric Tamara M,Pejic Milan,Jovanovic Dusica,Schoen Johann Christian},
year={2024},
title={Structure Prediction and Mechanical Properties of Tantalum Carbide (TaC) on ab initio Level},
journal={ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE},
volume={},
number={},
pages={-},
document_type={Article; Early Access},
} 

@ARTICLE{
author={Zagorac Jelena B,Schoen Johann Christian,Matovic Branko Z,Butulija Svetlana V,Zagorac Dejan B},
year={2024},
title={Hafnium Carbide: Prediction of Crystalline Structures and Investigation of Mechanical Properties},
journal={CRYSTALS},
volume={14},
number={4},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Dejan B,Buyer Constantin,Zagorac Jelena B,Skundric Tamara M,Schoen Johann Christian,Schleid Thomas},
year={2024},
title={Band-Gap Engineering and Unusual Behavior of Electronic Properties during Anion Substitution of Sulfur in LaFSe},
journal={CRYSTAL GROWTH & DESIGN},
volume={24},
number={4},
pages={1648-1657},
document_type={Article},
} 

@ARTICLE{
author={Jovanovic Dusica,Schoen Johann Christian,Zagorac Dejan B,Zarubica Aleksandra R,Matovic Branko Z,Zagorac Jelena B},
year={2023},
title={Energy Landscape of Relaxation and Interaction of an Amino Acid, Glutamine (L), on Pristine and Au/Ag/Cu-Doped TiO<sub>2</sub> Surfaces},
journal={NANOMATERIALS},
volume={13},
number={19},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Skundric Tamara M,Schoen Johann Christian,Zarubica Aleksandra R,Fonovic Matej,Zagorac Dejan B},
year={2023},
title={Exploring the energy landscape and crystal structures of CrSi2N4},
journal={ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE},
volume={},
number={},
pages={-},
document_type={Article; Early Access},
} 

@ARTICLE{
author={Fischer Dieter,Zagorac Dejan B,Schoen Johann Christian},
year={2023},
title={Fundamental insight into the formation of the zinc oxide crystal structure},
journal={THIN SOLID FILMS},
volume={782},
number={},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Jelena B,Schoen Johann Christian,Matovic Branko Z,Pejic Milan,Prekajski-Djordjevic Marija D,Zagorac Dejan B},
year={2023},
title={Computational Discovery of New Feasible Crystal Structures in Ce3O3N},
journal={CRYSTALS},
volume={13},
number={5},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Jelena B,Zagorac Dejan B,Srot Vesna,Randjelovic Marjan S,Pejic Milan,Van Aken Peter A,Matovic Branko Z,Schoen Johann Christian},
year={2023},
title={Synthesis, Characterization, and Electronic Properties of ZnO/ZnS Core/Shell Nanostructures Investigated Using a Multidisciplinary Approach},
journal={MATERIALS},
volume={16},
number={1},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Pejic Milan,Zagorac Dejan B,Zagorac Jelena B,Matovic Branko Z,Schoen Johann Christian},
year={2022},
title={Structure prediction via global energy landscape exploration of the ternary rare-earth compound LaOI},
journal={ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE},
volume={648},
number={24},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Buyer Constantin,Grossholz Hagen,Wolf Sarah,Zagorac Dejan B,Zagorac Jelena B,Schoen Johann Christian,Schleid Thomas},
year={2022},
title={Crystal-Structure Prediction and Experimental Investigation of the Polymorphic Lanthanum Fluoride Selenides LaFSe and La2F4Se},
journal={CRYSTAL GROWTH & DESIGN},
volume={},
number={},
pages={-},
document_type={Article; Early Access},
} 

@ARTICLE{
author={Zagorac Dejan B,Zagorac Jelena B,Fonovic Matej,Pejic Milan,Schoen Johann Christian},
year={2022},
title={Computational discovery of new modifications in scandium oxychloride (ScOCl) using a multi-methodological approach},
journal={ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE},
volume={648},
number={23},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Fischer Dieter,Zagorac Dejan B,Schoen Johann Christian},
year={2022},
title={The presence of superoxide ions and related dioxygen species in zinc oxide-A structural characterization by in situ Raman spectroscopy},
journal={JOURNAL OF RAMAN SPECTROSCOPY},
volume={53},
number={12},
pages={2137-2146},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Dejan B,Zagorac Jelena B,Pejic Milan,Matovic Branko Z,Schoen Johann Christian},
year={2022},
title={Band Gap Engineering of Newly Discovered ZnO/ZnS Polytypic Nanomaterials},
journal={NANOMATERIALS},
volume={12},
number={9},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Skundric Tamara M,Zagorac Dejan B,Schoen Johann Christian,Pejic Milan,Matovic Branko Z},
year={2021},
title={Crystal Structure Prediction of the Novel Cr2SiN4 Compound via Global Optimization, Data Mining, and the PCAE Method},
journal={CRYSTALS},
volume={11},
number={8},
pages={-},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Jelena B,Schoen Johann Christian,Matovic Branko Z,Skundric Tamara M,Zagorac Dejan B},
year={2020},
title={Predicting Feasible Modifications of Ce(2)ON(2)Using a Combination of Global Optimization and Data Mining},
journal={JOURNAL OF PHASE EQUILIBRIA AND DIFFUSION},
volume={41},
number={4},
pages={538-549},
document_type={Article},
} 

@ARTICLE{
author={Jovanovic Dusica,Zagorac Dejan B,Schoen Johann Christian,Milovanovic Branislav M,Zagorac Jelena B},
year={2020},
title={A new theoretical model for hexagonal ice, Ih(d), from first principles investigations},
journal={ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES},
volume={75},
number={1-2},
pages={125-128},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Dejan B,Zagorac Jelena B,Schoen Johann Christian,Stojanovic Nemanja,Matovic Branko Z},
year={2018},
title={ZnO/ZnS (hetero) structures: ab initio investigations of polytypic behavior of mixed ZnO and ZnS compounds},
journal={ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS},
volume={74},
number={},
pages={628-642},
document_type={Article},
} 

@ARTICLE{
author={Lukovic Jelena M,Zagorac Dejan B,Schoen Johann Christian,Zagorac Jelena B,Jordanov Dragana J,Volkov-Husovic Tatjana D,Matovic Branko Z},
year={2017},
title={Tungsten Disilicide (WSi2): Synthesis, Characterization, and Prediction of New Crystal Structures},
journal={ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE},
volume={643},
number={23},
pages={2088-2094},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Jelena B,Zagorac Dejan B,Rosic Milena M,Schoen Johann Christian,Matovic Branko Z},
year={2017},
title={Structure prediction of aluminum nitride combining data mining and quantum mechanics},
journal={CRYSTENGCOMM},
volume={19},
number={35},
pages={5259-5268},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Dejan B,Schoen Johann Christian,Zagorac Jelena B,Jansen Martin},
year={2015},
title={Theoretical investigations of novel zinc oxide polytypes and in-depth study of their electronic properties},
journal={RSC ADVANCES},
volume={5},
number={33},
pages={25929-25935},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Jelena B,Zagorac Dejan B,Zarubica Aleksandra R,Schoen Johann Christian,Djuris Katarina,Matovic Branko Z},
year={2014},
title={Prediction of possible CaMnO3 modifications using an ab initio minimization data-mining approach},
journal={ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS},
volume={70},
number={},
pages={809-819},
document_type={Article},
} 

@ARTICLE{
author={Zagorac Dejan B,Schoen Johann Christian,Zagorac Jelena B,Pentin Ilya Vladimirovich,Jansen Martin},
year={2013},
title={Zinc oxide: Connecting theory and experiment},
journal={PROCESSING AND APPLICATION OF CERAMICS},
volume={7},
number={3},
pages={111-116},
document_type={Article},
}