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- W3141801762 abstract "A new method to calculate mutual-diffusion coefficients of the binary alloy has been proposed in this report.At first self-diffusion coefficient of the constituent element was calculated using molecular dynamics method,thermodynamic factor of the alloy was got with the NRTL (non-random-two-liquid) equation,then mutual-diffusion coefficient was obtained with Darken formula.Using this method the mutual-diffusion coefficient of Pb-Mg alloy with different Pb content was calculated.The calculated values were compared with the available experimental ones and the reason of the maximal mutual-diffusion coefficient appearing at 33.3 at.%Pb was discussed.Partial pair correlation function and partial coordination number were calculated to analyze the effect of the melt structure on mutual-diffusion coefficient." @default.
- W3141801762 created "2021-04-13" @default.
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- W3141801762 date "2010-01-01" @default.
- W3141801762 modified "2023-09-25" @default.
- W3141801762 title "Molecular dynamics simulation on diffusion properties of Pb-Mg alloy" @default.
- W3141801762 hasPublicationYear "2010" @default.
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