B. A. Klumov, R. E. Ryltsev, N. M. Chtchelkachev, “Simulated $\mathrm{Cu}$-$\mathrm{Zr}$ glassy alloys: the impact of composition on icosahedral order”, Pis'ma v Zh. Èksper. Teoret. Fiz., 104:8 (2016), 568–569; JETP Letters, 104:8 (2016), 546

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Pis'ma v Zhurnal Èksperimental'noi i Teoreticheskoi Fiziki, 2016, Volume 104, Issue 8, Pages 568–569
DOI: https://doi.org/10.7868/S0370274X16200054 (Mi jetpl5092)

This article is cited in 12 scientific papers (total in 12 papers)

CONDENSED MATTER

Simulated

$\mathrm{Cu}$ -

$\mathrm{Zr}$ glassy alloys: the impact of composition on icosahedral order

B. A. Klumov^abc, R. E. Ryltsev^ade, N. M. Chtchelkachev^afdg

^a Landau Institute for Theoretical Physics, Russian Academy of Sciences, Moscow, Russia
^b Joint Institute for High Temperatures, Russian Academy of Sciences, Moscow, Russia
^c Aix-Marseille-Université, Laboratoire PIIM, CNRSMarseilleFrance
^d Institute of Metallurgy, Ural Branch, Russian Academy of Sciences, Ekaterinburg, Russia
^e Ural Federal University, Ekaterinburg, Russia
^f Moscow Institute of Physics and Technology (State University), Dolgoprudnyi, Moscow region, Russia
^g All-Russia Research Institute of Automatics, Moscow, Russia

Full-text PDF (160 kB) Citations (12)

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DOI: https://doi.org/10.7868/S0370274X16200054

Abstract: The structural properties of the simulated

$\mathrm{Cu}_{\alpha}\mathrm{Zr}_{1-\alpha}$ glassy alloys are studied in the wide range of the copper concentration to clarify the impact of the composition on the number density of the icosahedral clusters. Both bond orientational order parameters and Voronoi tessellation methods are used to identify these clusters. Our analysis shows that abundance of the icosahedral clusters and the chemical composition of these clusters are essentially nonmonotonic versus and demonstrate local extrema. That qualitatively explains the existence of pinpoint compositions of high glass-forming ability observing in

$\mathrm{Cu Zr}$ alloys. Finally, it has been shown that Voronoi method overestimates drastically the abundance of the icosahedral clusters in comparison with the bond orientational order parameters one.

Funding agency	Grant number
Russian Science Foundation	14-50-00124 14-12-01185
Agence Nationale de la Recherche	ANR-11-IDEX-0001-02
MD simulations was supported by the Russian Science Foundation (grant # 14-50-00124). Structural analysis was supported by Russian Science Foundation (grant # 14-12-01185). BAK was supported by the A*MIDEX grant (# ANR-11-IDEX-0001-02) funded by the French Government “Investissements d’Avenir” program managed by the French National Research Agency (ANR).

Received: 25.08.2016

English version:
Journal of Experimental and Theoretical Physics Letters, 2016, Volume 104, Issue 8, Pages 546–551
DOI: https://doi.org/10.1134/S0021364016200017

Bibliographic databases:

Document Type: Article

Language: English

Citation: B. A. Klumov, R. E. Ryltsev, N. M. Chtchelkachev, “Simulated

$\mathrm{Cu}$ -

$\mathrm{Zr}$ glassy alloys: the impact of composition on icosahedral order”, Pis'ma v Zh. Èksper. Teoret. Fiz., 104:8 (2016), 568–569; JETP Letters, 104:8 (2016), 546–551

Citation in format AMSBIB

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Linking options:

https://www.mathnet.ru/eng/jetpl5092

https://www.mathnet.ru/eng/jetpl/v104/i8/p568

This publication is cited in the following 12 articles:

R. A. Konchakov, A. S. Makarov, N. P. Kobelev, V. A. Khonik, Žurnal èksperimentalʹnoj i teoretičeskoj fiziki, 165:3 (2024)
B. A. Klumov, Phys. Usp., 66:3 (2023), 288–311
R M Khusnutdinoff, R R Khairullina, A A Suslov, V I Lad'yanov, A V Mokshin, J. Phys.: Condens. Matter, 34:36 (2022), 365403
S. A. Uporov, R. E. Ryltsev, V. A. Bykov, N. S. Uporova, S. Kh. Estemirova, N. M. Chtchelkatchev, J. Alloy. Compd., 854 (2021), 157170
B. A. Klumov, JETP Letters, 114:7 (2021), 406–411
R. E. Ryltsev, N. M. Chtchelkatchev, J. Cryst. Growth, 531 (2020), 125374
L. V. Kamaeva, R. E. Ryltsev, V. I. Lad'yanov, N. M. Chtchelkatchev, J. Mol. Liq., 299 (2020), 112207
V. A. Levashov, R. Ryltsev, N. Chtchelkatchev, Soft Matter, 15:43 (2019), 8840–8854
Ya. Di, J. Wang, Sh. Zhu, L. Wang, Sh. Guan, T. Zhang, J. Non-Cryst. Solids, 483 (2018), 118–125
B. A. Klumov, R. E. Ryltsev, N. M. Chtchelkatchev, J. Chem. Phys., 149:13 (2018), 134501
R. E. Ryltsev, B. A. Klumov, N. M. Chtchelkatchev, K. Yu. Shunyaev, J. Chem. Phys., 149:16 (2018), 164502
Nadezhda V. Pechishcheva, Konstantin Yu. Shunyaev, Olga V. Melchakova, Reviews in Analytical Chemistry, 37:2 (2018)

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