Электронная библиотека (репозиторий) Томского государственного университета
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Add   Interaction of oxygen with the stable Ti5Si3 surface
Authors: Chumakova, Lora S. | Bakulin, Alexander V. | Hocker, Stephen | Schmauder, Siegfried | Kulkova, Svetlana E.
Source: Metals. 2022. Vol. 12, № 3. P. 492 (1-12)
Type: статьи в журналах
Date: 2022
Description: The atomic structure and surface energies of several low-index surfaces (0001), (1100) and (1120) of Ti5Si3 in dependence on their termination were calculated by the projector augmentedwave method wit ... More
Add   Role of oxygen and fluorine in passivation of the GaSb(111) surface depending on its termination
Authors: Bakulin, Alexander V. | Chumakova, Lora S. | Korchuganov, Aleksandr V. | Kulkova, Svetlana E.
Source: Crystals. 2022. Vol. 12, № 4. P. 477 (1-15)
Type: статьи в журналах
Date: 2022
Description: The mechanism of the chemical bonding of oxygen and fluorine on the GaSb(111) surface depending on its termination is studied by the projector augmented-waves method within density functional theory. ... More
Add   Ab-initio study of cation-rich InP(001) and GaP(001) surface reconstructions and iodine adsorption
Authors: Bakulin, Alexander V. | Ponomarev, A. N. | Kulkova, Svetlana E.
Source: IOP Conference Series: Materials Science and Engineering. 2015. Vol. 77. P. 012004 (1-5)
Type: статьи в журналах
Date: 2015
Description: Atomic and electronic structures for a number of InP and GaP (001) surface geometries were studied within the density functional theory (DFT) in order to reexamine the energy stability of surface reco ... More
Add   Adsorption and diffusion of oxygen on γ-TiAl(001) and (100) surfaces
Authors: Kulkova, Svetlana E. | Hu, Q. M. | Yang, Rui | Bakulin, Alexander V.
Source: Computational materials science. 2015. Vol. 97. P. 55-63
Type: статьи в журналах
Date: 2015
Add   The peculiarities of halogens adsorption on A3B5(001) surface
Authors: Bakulin, Alexander V. | Tereshchenko, Oleg E. | Shaposhnikov, Anton A. | Smolin, Igor Yu. | Kulkova, Svetlana E.
Source: IOP Conference Series: Materials Science and Engineering. 2015. Vol. 77. P. 012002 (1-4)
Type: статьи в журналах
Date: 2015
Description: Theoretical study of the F, Cl, Br, I adsorption on GaAs(001) surface is presented. The most stable configurations of halogens on Ga-rich ζ-(4×2) reconstruction are determined with increasing of adato ... More
Add   Etching or Stabilization of GaAs(001) under Alkali and Halogen Adsorption
Authors: Paget, D. | Toropetsky, K. V. | Alperovich, V. L. | Eremeev, Sergey V. | Bakulin, Alexander V. | Kulkova, Svetlana E. | Doyle, B. P. | Nannarone, S. | Tereshchenko, Oleg E.
Source: The Journal of Physical Chemistry C. 2012. Vol. 116, № 15. P. 8535-8540
Type: статьи в журналах
Date: 2012
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