Recent publication in Journal of Chemical Theory and Computation

18/04/2018
 

Title: Finite-size Effects of Binary Mutual Diffusion Coefficients from Molecular Dynamics

Authors: Seyed Hossein Jamali, Ludger Wolff, Tim M. Becker, André Bardow, Thijs J. H. Vlugt, and Othonas A. Moultos

DOI: 10.1021/acs.jctc.8b00170