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  1. 2019

  2. Near-Infrared [Ir(N^C)2(N^N)]+ Emitters and Their Noncovalent Adducts with Human Serum Albumin: Synthesis and Photophysical and Computational Study

    Kritchenkov, I. S., Chelushkin, P. S., Sokolov, V. V., Pavlovskiy, V. V., Porsev, V. V., Evarestov, R. A. & Tunik, S. P., 14 Oct 2019, In: Organometallics. 38, 19, p. 3740-3751 12 p.

    Research output: Contribution to journal › Article › peer-review

  3. 2018

  4. Binuclear platinum(II) complexes based on a new bis-bidentate 3,6-di(thien-2-yl)pyridazine skeleton, a novel type of deep-red phosphorescent emitters: Synthesis and nonempirical calculations

    Zhukovskaya, M. A., Zhukovsky, D. D., Pavlovskiy, V. V., Porsev, V. V., Evarestov, R. A. & Tunik, S. P., Dec 2018, In: Inorganic Chemistry Communication. 98, p. 105-110 6 p.

    Research output: Contribution to journal › Article › peer-review

  5. 2017

  6. Water adsorption on α-V2O5 surface and absorption in V2O5∙nH2O xerogel: DFT study of electronic structure

    Porsev, V. V., Bandura, A. V. & Evarestov, R. A., 1 Dec 2017, In: Surface Science. 666, p. 76-83 8 p.

    Research output: Contribution to journal › Article › peer-review

  7. Phonon spectra, electronic, and thermodynamic properties of WS2 nanotubes

    Evarestov, R. A., Bandura, A. V., Porsev, V. V. & Kovalenko, A. V., 15 Nov 2017, In: Journal of Computational Chemistry. 38, 30, p. 2581-2593 13 p.

    Research output: Contribution to journal › Article › peer-review

  8. First-principles modeling of hafnia-based nanotubes

    Evarestov, R. A., Bandura, A. V., Porsev, V. V. & Kovalenko, A. V., 15 Sep 2017, In: Journal of Computational Chemistry. 38, 24, p. 2088-2099 12 p.

    Research output: Contribution to journal › Article › peer-review

  9. Use of Wyckoff position splittings in the supercell model of crystals with point defects

    Evarestov, R. A., Kitaev, Y. E. & Porsev, V. V., 1 Jun 2017, In: Journal of Applied Crystallography. 50, 3, p. 893-900 8 p.

    Research output: Contribution to journal › Article › peer-review

  10. 2016

  11. Symmetry and First-principles Calculations of Inorganic Nanostructures

    Эварестов, Р. А., Бандура, А. В. & Порсев, В. В., 17 Mar 2016.

    Research output: Contribution to conference › Abstract

  12. Application of zone-folding approach to the first-principles estimation of thermodynamic properties of carbon and ZrS2-based nanotubes

    Bandura, A. V., Porsev, V. V. & Evarestov, R. A., 2016, In: Journal of Computational Chemistry. 37, 7, p. 641-652

    Research output: Contribution to journal › Article

  13. Temperature dependence of strain energy and thermodynamic properties of V2O5-based single-walled nanotubes: Zone-folding approach

    Porsev, V. V., Bandura, A. V. & Evarestov, R. A., 2016, In: Journal of Computational Chemistry. 37, 16, p. 1442-1450 9 p.

    Research output: Contribution to journal › Article › peer-review

  14. Teorinis α- ir γ-V2O5 dvigubų sienelių nanovamzdelių tyrimas

    Porsev, V. V., Bandura, A. V. & Evarestov, R. A., 2016, In: Lithuanian Journal of Physics. 56, 2, p. 79-85 7 p.

    Research output: Contribution to journal › Article › peer-review

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