Molecular dynamics simulation of the transport properties of molten LiF–NaBr and LiF–KBr
- Autores: Kobelev M.1
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Afiliações:
- Institute of High-Temperature Electrochemistry, Ural Branch
- Edição: Volume 2016, Nº 8 (2016)
- Páginas: 709-714
- Seção: Article
- URL: https://journals.rcsi.science/0036-0295/article/view/170734
- DOI: https://doi.org/10.1134/S0036029516020063
- ID: 170734
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Resumo
A molecular dynamics simulation of molten LiF–NaBr and LiF–KBr mixtures at a temperature of 1280 K is performed over a wide concentration range to calculate the self-diffusion coefficients of the ions forming these mutual mixtures. It is found that the concentration dependence of the self-diffusion coefficient of the lithium cation in LiF–NaBr has an extremal character with a minimum, the position of which corresponds to the equimolar composition of the mixture.
Sobre autores
M. Kobelev
Institute of High-Temperature Electrochemistry, Ural Branch
Autor responsável pela correspondência
Email: coulomb76@mail.ru
Rússia, ul. Akademicheskaya 20, Yekaterinburg, 620219
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