Zobrazeno 1 - 10
of 18
pro vyhledávání: '"V S Baidyshev"'
Publikováno v:
JETP Letters. 117:441-448
Bilayer compounds of two-dimensional T12 phase carbon allotrope and penta-graphene have been studied using the electron density functional theory. The stability of the considered two-dimensional structures with different types of stacking order at di
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::ef95caabf2534dbf134d1074d1b506e7
https://doi.org/10.1134/s0021364023600283
https://doi.org/10.1134/s0021364023600283
Autor:
Zakhar I. Popov, Anton Manakhov, V. S. Baidyshev, I. V. Chepkasov, M.A. Visotin, Evgenia A. Kovaleva
Publikováno v:
The Journal of Physical Chemistry C. 122:18070-18076
The structural as well as electronic properties of PtPd nanoparticles (NPs) were investigated by using molecular dynamics simulations and density functional theory calculations. A wide range of NPs...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6645525f846dfc17d6adfdef1967603c
https://doi.org/10.1021/acs.jpcc.8b04177
https://doi.org/10.1021/acs.jpcc.8b04177
Publikováno v:
Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов, Iss 9, Pp 505-509 (2017)
The thermal stability of the structure of nanoparticles (D = 5 nm) of various types (binary alloy, core-shell, «Janus» type) and with different percentage of copper atoms was studied by molecular dynamic simulation. The most thermodynamically advan
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5cdadc7583f4369e8a9ef8cb5fe8f926
https://doi.org/10.26456/pcascnn/2017.9.505
https://doi.org/10.26456/pcascnn/2017.9.505
Publikováno v:
Physics of the Solid State. 59:2512-2518
The catalytic activity of Pt clusters is dependent not only on the nanoparticle size and its composition, but also on its internal structure. To determine the real structure of the nanoparticles used in catalysis, the boundaries of the thermal struct
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::07e98e2fc678f8bf3c07650795d3465d
https://doi.org/10.1134/s1063783417120071
https://doi.org/10.1134/s1063783417120071
Autor:
Yu. Ya. Gafner, V. S. Baidyshev
Publikováno v:
Crystallography Reports. 61:1096-1101
The thermal effect on lead clusters with radii up to 5.5 nm has been investigated by the molecular dynamics method using a modified tight-binding potential TB-SMA. The melting of Pb nanoparticles of these sizes is strictly homogeneous, without the fo
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::0a9519ef2145142d9163ee55234f1c1e
https://doi.org/10.1134/s1063774516070038
https://doi.org/10.1134/s1063774516070038
Autor:
I. V. Chepkasov, Ekaterina V. Sukhanova, Zakhar I. Popov, P. Süle, V. S. Baidyshev, M.A. Visotin
Publikováno v:
Applied Surface Science. 527:146736
The iron silicides formation during epitaxial film grown process on the (100) and (111) silicon surfaces were investigated using molecular dynamics (MD). The iron and silicon atom deposition rate and silicon substrate temperature influence on the for
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f0bc37a2c867d8ccab6449f484bce00d
https://doi.org/10.1016/j.apsusc.2020.146736
https://doi.org/10.1016/j.apsusc.2020.146736
Analysis of the heat capacity of nanoclusters of FCC metals on the example of Al, Ni, Cu, Pd, and Au
Publikováno v:
The Physics of Metals and Metallography. 116:568-575
The heat capacity of ideal nickel, copper, gold, aluminum, and palladium fcc clusters with diameter of up to 6 nm has been studied in the temperature range of 150–800 K in terms of the molecular-dynamics theory using a tight-binding potential. The
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a33a70302917efe980047e14bba27366
https://doi.org/10.1134/s0031918x15040055
https://doi.org/10.1134/s0031918x15040055
Publikováno v:
Physics of the Solid State. 57:188-196
The boundaries of thermal stability of the initial face-centered cubic (fcc) phase in perfect aluminum clusters with a diameter up to 3 nm have been investigated by the molecular dynamics method using a modified tight-binding (TB-SMA) potential. Base
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d536ff00860fbe6c0d17c2b8830130f1
https://doi.org/10.1134/s1063783415010102
https://doi.org/10.1134/s1063783415010102
Publikováno v:
Journal of Physics: Conference Series. 1015:032022
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::76cbc17af56efe543b7f33304539fa8d
https://doi.org/10.1088/1742-6596/1015/3/032022
https://doi.org/10.1088/1742-6596/1015/3/032022
Publikováno v:
Journal of Physics: Conference Series. 1015:032021
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::533493ecc3927c189b99c1542c43ea23
https://doi.org/10.1088/1742-6596/1015/3/032021
https://doi.org/10.1088/1742-6596/1015/3/032021