Publications
2023
Scholarly publications
Asadinamin, M., Živković, A., Ullrich, S., Meyer, H., & Zhao, Y. (2023). Charge Dynamics of a CuO Thin Film on Picosecond to Microsecond Timescales Revealed by Transient Absorption Spectroscopy. ACS Applied Materials and Interfaces. https://doi.org/10.1021/acsami.2c22595
Živković, A., Solsona-Delgado, V., Linden, B. V. D., Leeuw, N. H. D., & Melian-Cabrera, I. (2023). Molecular-level understanding of interfacial carbonates in stabilizing CuO-ZnO(Al2O3) catalysts. Journal of Catalysis. https://doi.org/10.1016/j.jcat.2023.06.032
King, H. E., Živković, A., & de Leeuw, N. H. (2023). Evaluating the Effect of 18O Incorporation on the Vibrational Spectra of Vaterite and Calcite. Crystals, 13(1), 1-16. [48]. https://doi.org/10.3390/cryst13010048
Gemeri, D., Živković, A., Lukačević, I., Bahmann, H., & King, H. E. (2023). Density functional theory demonstrates orientation effects in the Raman spectra of hydroxy- and carbonated apatite. Journal of Raman Spectroscopy, 54(2), 159-170. https://doi.org/10.1002/jrs.6465
2022
Scholarly publications
Živković, A., Mallia, G., King, H. E., de Leeuw, N. H., & Harrison, N. M. (2022). Mind the Interface Gap. Exposing Hidden Interface Defects at the Epitaxial Heterostructure between CuO and Cu2O. ACS applied materials & interfaces, 14(50), 56331-56343. https://doi.org/10.1021/acsami.2c16889
Farkaš, B., Živković, A., Uahengo, V., Dzade, N. Y., & de Leeuw, N. H. (2022). First-Principles DFT Insights into the Stabilization of Zinc Diphosphide (ZnP2) Nanocrystals via Surface Functionalization by 4-Aminothiophenol for Photovoltaic Applications. ACS Applied Energy Materials, 5(2), 2318-2328. https://doi.org/10.1021/acsaem.1c03804
Amakali, T., Živković, A., Warwick, M. E. A., Jones, D. R., Dunnill, C. W., Daniel, L. S., Uahengo, V., Mitchell, C. E., Dzade, N. Y., & de Leeuw, N. H. (2022). Photocatalytic Degradation of Rhodamine B Dye and Hydrogen Evolution by Hydrothermally Synthesized NaBH4—Spiked ZnS Nanostructures. Frontiers in Chemistry, 10, 1-15. [835832]. https://doi.org/10.3389/fchem.2022.835832
King, H., Zivkovic, A., Ohl, M., & Plümper, O. (2022). Using Raman spectra of isotopically enriched transformation products to trace mineral reactions. Abstract from European Geoscience Union (EGU) General Assembly 2022, Vienna, Austria. https://doi.org/10.5194/egusphere-egu22-8313
Rondiya, S. R., Jadhav, Y. A., Zivkovic, A., Jathar, S. B., Rahane, G. K., Cross, R. W., Rokade, A. V., S. Devan, R., Kolekar, S., Hoye, R. L. Z., Ghosh, H. N., de Leeuw, N. H., Jadkar, S. R., & Dzade, N. Y. (2022). Solution-processed Cd-substituted CZTS nanocrystals for sensitized liquid junction solar cells. Journal of Alloys and Compounds, 890, 1-11. [161575]. https://doi.org/10.1016/j.jallcom.2021.161575
2021
Scholarly publications
Farkas, B., Zivkovic, A., Uahengo, V., Dzade, N. Y., & de Leeuw, N. H. (2021). Insights from density functional theory calculations into the effects of the adsorption and dissociation of water on the surface properties of zinc diphosphide (ZnP2) nanocrystals. Physical Chemistry Chemical Physics, 23(46), 26482-26493. https://doi.org/10.1039/d1cp02784k
Živković, A., King, H. E., Wolthers, M., & De Leeuw, N. H. (2021). Magnetic structure and exchange interactions in pyrrhotite end member minerals: Hexagonal FeS and monoclinic Fe7S8. Journal of Physics Condensed Matter, 33(46), 1-10. [465801]. https://doi.org/10.1088/1361-648x/ac1cb2
Zivkovic, A., Sheehama, J., Warwick, M. E. A., Jones, D. R., Mitchel, C., Likius, D., Uahengo, V., Dzade, N. Y., Meenakshisundaram, S., Dunnill, C. W., & de Leeuw, N. H. (2021). Structural and electronic properties of Cu4O3 (paramelaconite): the role of native impurities. Pure and Applied Chemistry, 93(10), 1229-1244. https://doi.org/10.1515/pac-2021-0114
Tayar Galante, M., Zivkovic, A., Costa Alvim, J., Cristina Calchi Kleiner, C., Sangali, M., Taylor, S. F. R., Greer, A. J., Hardacre, C., Rajeshwar, K., Caram, R., Bertazzoli, R., Macaluso, R. T., de Leeuw, N. H., & Longo, C. (2021). Arc Synthesis, Crystal Structure, and Photoelectrochemistry of Copper(I) Tungstate. ACS applied materials & interfaces, 13(28), 32865-32875. https://doi.org/10.1021/acsami.1c03928
Zivkovic, A., Somers, M., Camprubí, E., King, H., Wolthers, M., & de Leeuw, N. H. (2021). Changes in CO2 Adsorption Affinity Related to Ni Doping in FeS Surfaces: A DFT-D3 Study. Catalysts, 11(4), [486]. https://doi.org/10.3390/catal11040486
https://dspace.library.uu.nl/bitstream/handle/1874/411879/catalysts_1170062_peer_review_v2.pdf?sequence=2
https://dspace.library.uu.nl/bitstream/handle/1874/411879/catalysts_1170062_peer_review_v2.pdf?sequence=2
2020
Scholarly publications
Zivkovic, A., de Leeuw, N. H., Searle, B., & Bernasconi, L. (2020). Electronic Excitations in Copper Oxides: Time-Dependent Density Functional Theory Calculations with a Self-Consistent Hybrid Kernel. Journal of Physical Chemistry C, 124(45), 24995-25003. https://doi.org/10.1021/acs.jpcc.0c08270
Zivkovic, A., & de Leeuw, N. H. (2020). Exploring the formation of intrinsic p-type and n-type defects in CuO. Physical Review Materials, 4(7), 1-10. [074606]. https://doi.org/10.1103/PhysRevMaterials.4.074606
2019
Scholarly publications
Zivkovic, A., Roldan, A., & de Leeuw, N. H. (2019). Density functional theory study explaining the underperformance of copper oxides as photovoltaic absorbers. Physical Review B, 99(3), 1-10. [035154]. https://doi.org/10.1103/PhysRevB.99.035154
Živković, A., Roldan, A., & de Leeuw, N. H. (2019). Tuning the electronic band gap of Cu2O via transition metal doping for improved photovoltaic applications. Physical Review Materials, 3(11), 1-13. [115202]. https://doi.org/10.1103/PhysRevMaterials.3.115202
Živkovic, A., Farkaš, B., Uahengo, V., De Leeuw, N. H., & Dzade, N. Y. (2019). First-principles DFT insights into the structural, elastic, and optoelectronic properties of α and β-znp2: Implications for photovoltaic applications. Journal of Physics Condensed Matter, 31(26), [265501]. https://doi.org/10.1088/1361-648X/ab111c
2017
Scholarly publications
Holt, K., Jewell, L., Niemantsverdriet, H., Macheli, L., Shozi, M., Hutchings, G., Wezendonk, T., Bowker, M., Catlow, R., Adam, S., Kooyman, P. J., Hensen, E., Hayward, J., Coville, N., Weststrate, K-J., Fischer, N., Roldan, A., Redekop, E., Steen, E. V., ... Kapteijn, F. (2017). Designing new catalysts for synthetic fuels: general discussion. Faraday Discuss. https://doi.org/10.1039/c7fd90011b
2016
Scholarly publications
Živković, A., & Lukačević, I. (2016). Ferroelastic nature of high pressure phase transition in MgF2. Journal of Alloys and Compounds, 682, 839-843. https://doi.org/10.1016/j.jallcom.2016.05.059