Generalized Form for Finite-Size Corrections in Mutual...

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Journal of Chemical Theory and Computation 2020 / 05

Generalized Form for Finite-Size Corrections in Mutual Diffusion Coefficients of Multicomponent Mixtures Obtained from Equilibrium Molecular Dynamics Simulation

Jamali, Seyed Hossein, Bardow, André, Vlugt, Thijs J. H., Moultos, Othonas A.
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Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.0c00268
Date:
May, 2020
File:
PDF, 1.07 MB
2020
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