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Diffusion coefficients of elastic macromolecules

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In elastic macromolecules, the value of the short-time diffusion coefficient depends on the choice of the point the displacement of which is tracked. On the other hand, the experimentally more… Click to show full abstract

In elastic macromolecules, the value of the short-time diffusion coefficient depends on the choice of the point the displacement of which is tracked. On the other hand, the experimentally more relevant long-time diffusion coefficient is independent of the reference point, but its estimation usually requires computationally expensive Brownian dynamics simulations. Here we show how to obtain a precise estimate of the long-time diffusion coefficient of elastic macromolecules in a fast and robust manner, without invoking Brownian dynamics.

Keywords: diffusion; diffusion coefficient; elastic macromolecules; diffusion coefficients; time diffusion; coefficients elastic

Journal Title: Journal of Fluid Mechanics
Year Published: 2019

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