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- W2065442854 abstract "A simple analytical model for atomic motion is used to obtain velocity autocorrelation function (VACF) for liquid Rb. The modified empty-core potential due to Hasegawa et al., which represents the orthogonalisation effect due to s-core states in such sp-bonded metals, is used for electron–ion interaction. The potential parameter rc is determined at different temperatures from the knowledge of structure factor. We find quantitative explanation for the density and temperature dependence of VACF and self-diffusion coefficients. The coherent behaviour of liquid Rb in terms of the dynamic structure factor employing viscoelastic theory has also been studied. Intrinsic temperature effects have been studied through damping term in the pair potential. The predicted results for VACF, cosine power spectrum, mean square displacement, diffusion and viscosity coefficients have been compared with recent available molecular dynamics (MD) data and a good agreement has been achieved." @default.
- W2065442854 created "2016-06-24" @default.
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- W2065442854 date "2014-02-05" @default.
- W2065442854 modified "2023-09-23" @default.
- W2065442854 title "Temperature dependent atomic transport properties of liquid Rb" @default.
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- W2065442854 doi "https://doi.org/10.1080/00319104.2013.876638" @default.
- W2065442854 hasPublicationYear "2014" @default.
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