2021
DOI: 10.3367/ufne.2020.05.038759
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Collective contributions to self-diffusion in liquids

Abstract: The present work is devoted to describing the current state of the collective transport theory in liquids. In this connection, the results of MD-modeling of the root mean square displacement and the velocity autocorrelation function of a molecule (VACFM) at large enough times are discussed. The characteristic function allowing one to estimate the relative value of collective contributions to the self-diffusion coefficient is introduced and studied in detail. Low-frequency spectra of the VACFM are used to deter… Show more

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Cited by 4 publications
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