Surface segregation in binary metallic nanoparticles: atomistic and thermodynamic simulations

V. M. Samsonov 1
A. A. Romanov 1
I. V. Talyzin 1
D. V. Zhigunov 1
V. V. Puitov 1
Publication typeJournal Article
Publication date2024-12-23
Abstract

The results of molecular dynamics and atomistic simulations demonstrate segregation of Pd atoms to the surface of binary Pt-Pd nanoparticles and the surface segregation of Cr in Ni-Cr nanoparticles. At the same time, molecular dynamics results predict a transition from the surface segregation of Cr to the surface segregation of Ni at low Cr contents in Ni-Cr nanoparticles.

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Samsonov V. M. et al. Surface segregation in binary metallic nanoparticles: atomistic and thermodynamic simulations // Известия Российской академии наук Серия физическая. 2024. Vol. 88. No. 5. pp. 767-773.
GOST all authors (up to 50) Copy
Samsonov V. M., Romanov A. A., Talyzin I. V., Zhigunov D. V., Puitov V. V. Surface segregation in binary metallic nanoparticles: atomistic and thermodynamic simulations // Известия Российской академии наук Серия физическая. 2024. Vol. 88. No. 5. pp. 767-773.
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TY - JOUR
DO - 10.31857/s0367676524050125
UR - https://journals.rcsi.science/0367-6765/article/view/274211
TI - Surface segregation in binary metallic nanoparticles: atomistic and thermodynamic simulations
T2 - Известия Российской академии наук Серия физическая
AU - Samsonov, V. M.
AU - Romanov, A. A.
AU - Talyzin, I. V.
AU - Zhigunov, D. V.
AU - Puitov, V. V.
PY - 2024
DA - 2024/12/23
PB - The Russian Academy of Sciences
SP - 767-773
IS - 5
VL - 88
SN - 0367-6765
ER -
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@article{2024_Samsonov,
author = {V. M. Samsonov and A. A. Romanov and I. V. Talyzin and D. V. Zhigunov and V. V. Puitov},
title = {Surface segregation in binary metallic nanoparticles: atomistic and thermodynamic simulations},
journal = {Известия Российской академии наук Серия физическая},
year = {2024},
volume = {88},
publisher = {The Russian Academy of Sciences},
month = {dec},
url = {https://journals.rcsi.science/0367-6765/article/view/274211},
number = {5},
pages = {767--773},
doi = {10.31857/s0367676524050125}
}
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Samsonov, V. M., et al. “Surface segregation in binary metallic nanoparticles: atomistic and thermodynamic simulations.” Известия Российской академии наук Серия физическая, vol. 88, no. 5, Dec. 2024, pp. 767-773. https://journals.rcsi.science/0367-6765/article/view/274211.