2016
  1. R.I. Eglitis, S. Piskunov, and Yu.F. Zhukovskii, Ab initio calculations of PbTiO3/SrTiO3 (001) heterostructures. - Phys. Stat. Sol. C, 2016, 13, p. 913–920. pdf

  2. A. Platonenko, D. Gryaznov, S. Piskunov, Yu.F. Zhukovskii, and E.A. Kotomin, Charged oxygen interstitials in corundum: first principles simulations. - Phys. Stat. Sol. C, 2016, 13, p. 932–936. pdf

  3. Yu.F. Zhukovskii, S. Piskunov, O. Lisovski, E. Spohr, and R.A. Evarestov, Quantum chemical simulations of doped ZnO nanowires for photocatalytic hydrogen generation. - Phys. Status Solidi B, 2016, 253, p. 2120-2128. pdf

  4. A. Gopejenko, Yu.F. Zhukovskii, E.A. Kotomin, Yu.A.. Mastrikov, P.V. Vladimirov, V.A. Borodin, and A. Möslang, Ab initio modelling of Y–O cluster formation in fсс-Fe lattice. - Phys. Status Solidi B, 2016, 253, p. 2136-2143. pdf

  5. B. Polyakov, A. Kuzmin, K. Smits, J. Zideluns, E. Butanovs, J. Butikova, S. Vlassov, S. Piskunov, and Yu.F. Zhukovskii, Unexpected epitaxial growth of a few WS2 layers on {11̅00} facets of ZnO nanowires. - J. Phys. Chem. C, 2016, 120, p. 21451−21459. pdf

  6. O. Dumbrajs, E.M. Khutoryan, and T. Idehara, Hysteresis and frequency tunability of gyrotrons. - J. Infrared Millim. Terahz. Waves, 2016, 37, p. 551-560. pdf

  7. O. Dumbrajs, T. Saito, and Y. Tatematsu, Start-up scenario of a high-power pulsed gyrotron for 300 GHz band collective Thomson scattering diagnostics in the Large Helical Device. - Phys. Plasmas, 2016, 23, 023106 (p. 1-8). pdf

  8. O. Dumbrajs and G.S. Nusinovich, Self-consistent non-stationary theory of gyrotrons. - Phys. Plasmas, 2106, 23, 083125 (p. 1-7). pdf

  9. O. Dumbrajs, T. Saito, Y. Tatematsu, and Y. Yamaguchi, Influence of the electron velocity spread and the beam width on efficiency and mode competition in the high-power pulsed gyrotron for 300 GHz band collective Thomson scattering diagnostics in the Large Helical Device. - Phys. Plasmas, 2016, 23, 093109 (p. 1-8). pdf

  10. A.I. Popov, J. Zimmermann, G.J. McIntyre, and C. Wilkinson, Photostimulated luminescence properties of neutron image plates. - Opt. Mater., 2016, 59, p. 83–86. pdf

  11. D. Gryaznov, R. Merkle, E.A. Kotomin and J. Maier, Ab initio modelling of oxygen vacancies and protonic defects in La1-xSrxFeO3-d perovskite solid solutions. - J. Mater. Chem. A, 2016, 4, p. 13093 - 13104. pdf

  12. S. Piskunov, P.A. Žguns, D. Bocharov, A. Kuzmin, J. Purans, A. Kalinko, R.A. Evarestov, S.E. Ali, and F. Rocca, Interpretation of unexpected behavior of infrared absorption spectra of ScF3 beyond the quasiharmonic approximation. - Phys. Rev. B, 2016, 93, 214101 (p. 1-9). pdf

  13. H. Klym, A. Ingram, O. Shpotyuk, O. Hotra, and A.I. Popov, Positron trapping defects in free-volume investigation of Ge-Ga-S-CsCl glasses. - Radiat. Meas., 2016, 90, p. 117-121. pdf

  14. I. Karbovnyk, I. Olenych, A. Kukhta, A. Lugovskii, G. Sasnouski, Yu. Olenych, A. Luchechko, A.I. Popov, L. Yarytska, Multicolor photon emission from organic thin films on different substrates. - Radiat. Meas., 2016, 90, p. 38-42. pdf

  15. D. Bocharov, M. Krack, A. Kalinko, J. Purans, F. Rocca, S.E. Ali, and A. Kuzmin, Ab initio molecular dynamics simulations of the Sc K-edge EXAFS of scandium trifluoride. - J. Phys. Conf. Ser., 2016, 712, 012009 (p. 1-4). pdf

  16. J. Purans, S. Piskunov, D. Bocharov, A. Kalinko, A. Kuzmin, S.E. Ali, and F. Rocca, Local structure of perovskites ReO3 and ScF3 with negative thermal expansion: interpretation beyond the quasiharmonic approximation. - J. Phys. Conf. Ser., 2016, 712, 012013 (p. 1-4). pdf

  17. D. Bocharov, M. Chollet, M. Krack, J. Bertsch, D. Grolimund, M. Martin, A. Kuzmin, J.Purans, and E.A. Kotomin, Interpretation of the U L3-edge EXAFS in uranium dioxide using molecular dynamics and density functional theory simulations. - J. Phys. Conf. Ser., 2016, 712, 012013 (p. 1-4). pdf

  18. R.I. Eglitis and S. Piskunov, First principles calculations of SrZrO3 bulk and ZrO2-terminated (001) surface F centers. - Computational Condensed Matter , 2016, 7, p. 1-6. pdf

  19. A.I. Popov, A. Lushchik, and E.A. Kotomin, Low-temperature radiation effects in wide gap materials. - Low Temp. Phys., 2016, 42, p. 687-688. pdf

  20. A. Kuzmin, V. Pankratov, A. Kalinko, A. Kotlov, L. Shirmane, and A.I. Popov, UV-VUV synchrotron radiation spectroscopy of NiWO4. - Low Temp. Phys., 2016, 42, p. 694-698. pdf

  21. D. Bocharov, P. Žguns, S. Piskunov, A. Kuzmin, and J. Purans, Electronic structure of cubic ScF3 from first-principles calculations. - Low Temp. Phys., 2016, 42, p. 710-715. pdf

  22. E. Klotins, A novel quantum field approach to photoexcited insulators. - Low Temp. Phys., 2016, 42, p. 726-732. pdf

  23. N. Mironova-Ulmane, V. Skvortsova, and A.I. Popov, Optical absorption and luminescence studies of fast neutron-irradiated complex oxides for jewellery applications. - Low Temp. Phys., 2016, 42, p. 743-747. pdf

  24. V.N. Kuzovkov, A.I. Popov, E.A. Kotomin, A.M. Moskina, E. Vasil'chenko, and A. Lushchik, Theoretical analysis of the kinetics of low-temperature defect recombination in alkali halide crystals. - Low Temp. Phys., 2016, 42, p. 748-755. pdf

  25. I. Karbovnyk, I. Bolesta, I. Rovetskyi, V. Lesivtsiv, Ya. Shmygelsky, S. Velgosh, and A.I. Popov, Long-term evolution of luminescent properties in CdI2 crystals. - Low Temp. Phys., 2016, 42, p. 756-759. pdf

  26. V.P. Savchyn, A.I. Popov, O.I. Aksimentyeva, H. Klym, Yu.Yu. Horbenko, V. Serga, A. Moskina, and I. Karbovnyk, Cathodoluminescence characterization of polystyrene–BaZrO3 hybrid composites. - Low Temp. Phys., 2016, 42, p. 760-763. pdf

  27. H. Klym, A. Ingram, O. Shpotyuk, I. Hadzaman, V. Solntsev, O. Hotra, and A.I. Popov, Positron annihilation characterization of free volume in micro- and macro-modified Cu0.4Co0.4Ni0.4Mn1.8O4 ceramics. - Low Temp. Phys., 2016, 42, p. 764-769. pdf

  28. A. Lushchik, Ch. Lushchik, A.I. Popov, K. Schwartz, E. Shablonin, and E. Vasil’chenko, Influence of complex impurity centres on radiation damage in wide-gap metal oxides. - Nucl. Instrum. Meth. B. , 2016, 374, p. 90-96. pdf

  29. M. Arrigoni, T.S. Bjørheim, E.A. Kotomin, and J. Maier, First principles study of confinement effects for oxygen vacancies in BaZrO3 (001) ultra-thin films. - Phys.Chem.Chem.Phys., 2016, 18, p. 9902-9908. pdf 

  30. S. Piskunov and R.I. Eglitis, Comparative ab initio calculations of SrTiO3/BaTiO3 and SrZrO3/PbZrO3 (001) heterostructures. - Nucl. Instr. Meth. Phys. Res. B, 2016, 374, p. 20–23.pdf

  31. V.M. Lisitsyn, L.A. Lisitsyna, A.I. Popov, E.A. Kotomin, F.U. Abuova, A. Akilbekov, and J. Maier, Stabilization of primary mobile radiation defects in MgF2 crystals. - Nucl. Instr. Meth. Phys. Res. B, 2016, 374, p. 24–28. pdf

  32. Yu.F. Zhukovskii, A. Platonenko, S. Piskunov, and E.A. Kotomin, Ab initio simulations on migration paths of interstitial oxygen in corundum. - Nucl. Instr. Meth. Phys. Res. B, 2016, 374, p. 29–34. pdf

  33. E.A. Kotomin, V.N. Kuzovkov, A.I. Popov, and R. Vila, Kinetics of F center annealing and colloid formation in Al2O3. - Nucl. Instr. Meth. Phys. Res. B, 2016, 374, p. 107–110. pdf

  34. Yu.A. Mastrikov, S. Guo, F. Puleo, L.F. Liotta, and E.A. Kotomin, First principles modeling of Pd-doped (La,Sr)(Co,Fe)O3 complex perovskites. - Fuel Cells, 2016, 16, p. 267–271. pdf

  35. T.S. Bjørheim, M. Arrigoni, S.W. Saeed, E.A. Kotomin, and J. Maier, Surface segregation entropy of protons and oxygen vacancies in BaZrO3. - Chem. Mater., 2016, 28, p.1363−1368. pdf  

  36. H. Klym, I. Karbovnyk, M. Cestelli Guidi, O. Horta, and A.I. Popov, Optical and vibrational spectra of CsCl-enriched GeS2-Ga2S3 glasses. - Nanoscale Res. Lett., 2016, 11, 132 (p. 1-6). pdf

  37. G. Zvejnieks, P. Merzlyakov, V.N. Kuzovkov, and E.A. Kotomin, Void lattice formation in electron irradiated CaF2: Statistical analysis of experimental data and cellular automata simulations. - Nucl. Instrum. Meth. B., 2016, 368, p. 138-143. pdf

  38. O. Lisovski, A. Chesnokov, S. Piskunov, D. Bocharov, Yu.F. Zhukovskii, M. Wessel, and E. Spohr, Ab initio calculations of doped TiO2 anatase (101) nanotubes for photocatalytical water splitting applications. – Mater. Sci. Semicond. Process. 2016, 42, p. 138-141. pdf

Chapters in Scientific Books

  1. Yu.F. Zhukovskii, S. Piskunov, O. Lisovski, A. Chesnokov, and D. Bocharov, First principle evaluation of photocatalytic suitability for TiO2-based nanotubes. - Chapter in a book: W. Cao (Ed.) Semiconductor Photocatalysis - Materials, Mechanisms and Applications (InTech Open Access Publishers, Croatia), 2016, p. 105-133. pdf

  2. M. Arrigoni, E.A. Kotomin, and J. Maier, Large scale modeling of defects in advanced oxides: Oxygen vacancies in BaZrO3 crystals. - Chapter in a book: W. Nagel et al. (eds.) High Performance Computing in Science and Engineering, (Springer, Switzerland), 2016, p. 187-198. pdf

Non-SCI Publications 

  1. Yu.N. Shunin, D. Fink, A.E. Kiv, L. Alfonta, A. Mansharipova, R. Muhamediyev, Yu.F. Zhukovskii, T. Lobanova-Shunina, N. Burlutskaya, V.I. Gopeyenko, and S. Bellucci, Theory and modelling of real-time physical and bio- nanosensor systems. - Computer Modelling & New Technologies, 2016, 20(4), p. 7-17. pdf