Электронная библиотека (репозиторий) Томского государственного университета

Add to Quick Collection   All 15 Results

Showing items 1 - 15 of 15.
  • «
  • ←
  • 1
  • →
  • »
Sort:
 Add All Items to Quick Collection
Add   Electronically excited states in model complexes of noble metal clusters with carbon nanodots
Authors: Pomogaev, Vladimir A. | Lee, H. J. | Goh, E. | Tchaikovskaya, Olga N. | Kononov, Alexei I. | Avramov, Pavel V.
Source: Russian physics journal. 2022. Vol. 64, № 11. P. 2076-2081
Type: статьи в журналах
Date: 2022
Description: Theoretical calculations of excited states in the complexes of gold and silver three-atom nanoclusters with carbon quantum nanodots are performed using the M062X functional and the def2SVP {H}/def2TZV ... More
Add   Extreme structure and spontaneous lift of spin degeneracy in doped perforated bilayer graphenes
Authors: Melchakova, Iuliia A. | Tenev, T. G. | Vitanov, N. V. | Tchaikovskaya, Olga N. | Chernozatonskii, L. A. | Yakobson, B. I. | Avramov, Pavel V.
Source: Carbon. 2022. Vol. 192. P. 61-70
Type: статьи в журналах
Date: 2022
Description: Extreme structure and spin states of doped and undoped perforated bigraphenes was studied using DFT simulations. It was found that folded nanopores possess extremely high curvature of 0.34 Å−1. Dramat ... More
Add   Localized d-electron effect on spin polarization of vertical heterostructures of nanoporous bilayer graphene
Authors: Melchakova, Iuliia A | Avramov, Pavel V.
Source: Russian physics journal. 2022. Vol. 65, № 7. P. 1138-1141
Type: статьи в журналах
Date: 2022
Description: The paper presents a novel composite material based on nanoporous AB-stacked bilayer graphene. The influence of the dopant atom on the electronic properties of the heterostructure and its position in ... More
Add   Structure and properties of exotic nano- and mesodiamonds with pentagonal symmetry
Authors: Tomilin, Felix N. | Pomogaev, Vladimir A. | Melchakova, Iuliia A. | Artyushenko, Polina V. | Shubin, Aleksandr A. | Volodin, A. M. | Zilberberg, I. L. | Avramov, Pavel V.
Source: Russian physics journal. 2022. Vol. 64, № 11. P. 2046-2051
Type: статьи в журналах
Date: 2022
Description: A comprehensive critical survey of structures of exotic nano-, meso- and microdiamonds with dodecahedral and icosahedral symmetry (N/MDPS) is presented. Due to their high dodecahedral or icosahedral s ... More
Add   Migration of excitation energy in furocoumarins
Authors: Tchaikovskaya, Olga N. | Dmitrieva, N. G. | Bocharnikova, Elena N. | Chaidonova, Vlada S. | Avramov, Pavel V.
Source: Frontiers in chemistry. 2021. Vol. 9. P. 754950 (1-10)
Type: статьи в журналах
Date: 2021
Description: The migration of excitation energy of a number of psoralen compounds has been studied. For this, the methods of induced absorption spectroscopy, stationary electron spectroscopy, fluorescence and phos ... More
Add   Potential energy surfaces of adsorption and migration of transition metal atoms on nanoporus materials: The case of nanoporus bigraphene and G-C3N4
Authors: Melchakova, Iuliia A | Nikolaeva, Kristina M. | Kovaleva, Evgenia A. | Tomilin, Felix N. | Ovchinnikov, Sergey G. | Tchaikovskaya, Olga N. | Avramov, Pavel V. | Kuzubov, Alexander A.
Source: Applied surface science. 2021. Vol. 540. P. 148223 (1-9)
Type: статьи в журналах
Date: 2021
Description: Abstract First-row transition metal (TM) atoms adsorption and migration on nanoporus 2D materials like bigraphene with double vacancies and g-C3N4 as the active sites for TM nanocluster’s growth was s ... More
Add   Synthesis, mass spectroscopy detection, and density functional theory investigations of the gd endohedral complexes of C82 fullerenols
Authors: Shakirova, Anastasia A. | Tomilin, Felix N. | Pomogaev, Vladimir A. | Vnukova, Natalia G. | Churilov, Grigory N. | Kudryasheva, Nadezhda S. | Tchaikovskaya, Olga N. | Ovchinnikov, Sergey G. | Avramov, Pavel V.
Source: Computation. 2021. Vol. 9, № 5. P. 58 (1-12)
Type: статьи в журналах
Date: 2021
Description: Gd endohedral complexes of C82 fullerenols were synthesized and mass spectrometry analysis of their composition was carried out. It was established that the synthesis yields a series of fullerenols Gd ... More
Add   Theoretical design of LSMO/6T spinterface
Authors: Melchakova, Iu. A. | Avramov, Pavel V.
Source: Pulsed lasers and laser applications AMPL-2021 : the 15th International conference, September 12-17, 2021, Tomsk, Russia : abstracts. Tomsk, 2021. P. 30-31
Type: статьи в сборниках
Date: 2021
Add   Towards advanced complex quantum materials for spin-related applications and photo-induced heterogeneous catalysis: The case of (Fen) @g-CN1 (n = 2,3) and (Mn)@(g-CN1)2
Authors: Melchakova, Iuliia A. | Tchaikovskaya, Olga N. | Avramov, Pavel V.
Source: Computational materials science. 2021. Vol. 197. P. 110610 (1-6)
Type: статьи в журналах
Date: 2021
Description: Perspective heterostructures based on Fe and Mn adatoms on 2D g-C3N4 films of different morphology were designed and investigated by means of DFT GGA/PBE and GGA/HSE levels of theory. Spontaneous spin ... More
Add   Towards carbon-based advanced 2D quantum materials: structure and strong electronic correlations in nanodiamond islands confined between two graphene sheets
Authors: Avramov, Pavel V. | Oyeniyi, G. T. | Melchakova, Iu. A.
Source: Pulsed lasers and laser applications AMPL-2021 : the 15th International conference, September 12-17, 2021, Tomsk, Russia : abstracts. Tomsk, 2021. P. 8-9
Type: статьи в сборниках
Date: 2021
Add   Unusual shift in the visible absorption spectrum of an active ctenophore photoprotein elucidated by time‑dependent density functional theory
Authors: Tomilin, Felix N. | Rogova, Anastasia V. | Burakova, Ludmila P. | Tchaikovskaya, Olga N. | Avramov, Pavel V. | Fedorov, Dmitri G. | Vysotski, Eugene S.
Source: Photochemical & photobiological sciences. 2021. Vol. 20, № 4. P. 559-570
Type: статьи в журналах
Date: 2021
Description: Active hydromedusan and ctenophore Ca2+-regulated photoproteins form complexes consisting of apoprotein and strongly non-covalently bound 2-hydroperoxycoelenterazine (an oxygenated intermediate of coe ... More
Add   Dirac cone spin polarization of graphene by magnetic insulator proximity effect probed with outermost surface spin spectroscopy
Authors: Erohin, Sergei V. | Popov, Zakhar I. | Haku, Satoshi | Watanabe, Takahiro | Yamada, Yoichi | Entani, Shiro | Li, Songtian | Avramov, Pavel V. | Naramoto, Hiroshi | Ando, Kazuya | Sorokin, Pavel B. | Yamauchi, Yasushi | Sakai, Seiji
Source: Advanced functional materials. 2018. Vol. 28, № 20. P. 1800462 (1-10)
Type: статьи в журналах
Date: 2018
Description: The effects of the proximity contact with magnetic insulator on the spin‐dependent electronic structure of graphene are explored for the heterostructure of single‐layer graphene (SLG) and yttrium iron ... More
Add   Electronic structure of Li+@C60: Photoelectron spectroscopy of the Li+@C60[PF6−] salt and STM of the single Li+@C60 molecules on Cu(111)
Authors: Kuklin, Artem V. | Sato, Sho | Esaka, Fumitaka | Sumi, Naoto | Zhang, Chunyang | Sasaki, Masahiro | Kwon, Eunsung | Kasama, Yukihiko | Avramov, Pavel V. | Yamada, Yoichi | Sakaih, Seiji
Source: Carbon. 2018. Vol. 133. P. 23-30
Type: статьи в журналах
Date: 2018
Description: We report the scanning tunneling microscope (STM) observation of the Li+ ion endohedral C60 on Cu(111), prepared by means of evaporation of a high-purity Li+@C60[PF6−] salt. The electronic state of Li ... More
Add   Inheritance of photochromic properties of nitro-substituted and halogenated spiropyrans containing the pyrrolidino[60]fullerene
Authors: Barachevsky, Valery A. | Tuktarov, Airat R. | Avramov, Pavel V. | Artyukhov, Viktor Ya. | Pomogaev, Vladimir A.
Source: The Journal of Physical Chemistry A. 2018. Vol. 122, № 2. P. 505-515
Type: статьи в журналах
Date: 2018
Description: The photophysical and isomerization properties of hybrid molecular compounds that consist of photochromic nitro-substituted and halogenated spiropyran derivatives bonded to the surface of the [60]full ... More
Add   Structure and electronic properties of hollow-caged C60 fullerene-derived (MN4)nC6(10-n) (M = Zn, Mg, Fe, n=1-6) complexes
Authors: Pomogaev, Vladimir A. | Kuzubov, Alex A. | Artyukhov, Viktor Ya. | Avramov, Pavel V.
Source: International journal of quantum chemistry. 2015. Vol. 115, № 4. P. 239-244
Type: статьи в журналах
Date: 2015
  • «
  • ←
  • 1
  • →
  • »
^