Перегляд за автором "Syrotyuk, S.V."

Сортувати за: Порядок: Результатів:

  • Band structure of LaPO₄ 
    Syrotyuk, S.V.; Chornodolskyy, Ya.M.; Vistovskyy, V.V.; Voloshinovskii, A.S.; Gektin, A.V. (Functional Materials, 2013)
    The calculations of band structure of LaPO₄ crystal of monoclinic and hexagonal lattice symmetry is performed using the PAW formalism and taking into account the strong local correlations in the PBE0 GGA approximation. The ...
  • Electronic and magnetic properties of ZnS crystal doped by Mn and Cu substitution atoms 
    Syrotyuk, S.V.; Shved, V.M. (Functional Materials, 2011)
  • Electronic properties of AlN crystal doped with Cr, Mn and Fe 
    Syrotyuk, S.V.; Shved, V.M. (Condensed Matter Physics, 2013)
    The spin-resolved electronic energy band spectra, as well as partial and total density of electronic states of the crystal AlN, doped with Cr, Mn and Fe, have been evaluated within the projector augmented waves (PAW) ...
  • Excited state properties of polycyclic hydrocarbons based dyes 
    Klysko, Yu.V.; Syrotyuk, S.V. (Condensed Matter Physics, 2019)
    In this paper we present a comprehensive ab initio study of polycyclic hydrocarbons based dyes. The purpose of the work is to obtain electronic properties of the materials which are supposed to be used in organic ...
  • Quasiparticle electronic band structure of the alkali metal chalcogenides 
    Syrotyuk, S.V.; Shved, V.M. (Condensed Matter Physics, 2015)
    The electronic energy band spectra of the alkali metal chalcogenides M₂A (M: Li, Na, K, Rb; A: O, S, Se, Te) have been evaluated within the projector augmented waves (PAW) approach by means of the ABINIT code. The Kohn-Sham ...
  • The effects of strong correlations on the band structure of Ag₈SnSe₆ argyrodite 
    Syrotyuk, S.V.; Semkiv, I.V.; Ilchuk, H.A.; Shved, V.M. (Condensed Matter Physics, 2016)
    The electronic energy band spectra, as well as partial and total density of electronic states of the crystal argyrodite Ag₈SnSe₆ have been evaluated within the projector augmented waves (PAW) approach by means of the ABINIT ...