Prediction of Segregation in Binary Metal Nanoparticles: Thermodynamic and Atomistic Simulations
- Авторы: Samsonov V.1, Talyzin I.1, Kartoshkin A.1, Samsonov M.1
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Учреждения:
- Tver State University
- Выпуск: Том 120, № 6 (2019)
- Страницы: 578-583
- Раздел: Structure, Phase Transformations, and Diffusion
- URL: https://journals.rcsi.science/0031-918X/article/view/168535
- DOI: https://doi.org/10.1134/S0031918X19060115
- ID: 168535
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Аннотация
A complex approach based on thermodynamic and atomistic simulations is used to predict segregation in binary metal nanoparticles of Cu–Ni and Ag–Au. The results of thermodynamic simulation within the model of limited source of segregating component agree with those of the atomistic simulation, and both predict the surface segregation of Cu atoms in the Cu–Ni nanoalloys and the segregation of Ag atoms at the surface of the binary Ag–Au nanoparticles.
Об авторах
V. Samsonov
Tver State University
Автор, ответственный за переписку.
Email: samsonoff@inbox.ru
Россия, Tver, 170100
I. Talyzin
Tver State University
Email: samsonoff@inbox.ru
Россия, Tver, 170100
A. Kartoshkin
Tver State University
Email: samsonoff@inbox.ru
Россия, Tver, 170100
M. Samsonov
Tver State University
Email: samsonoff@inbox.ru
Россия, Tver, 170100