Tsimpanogiannis, Ioannis N. (author), Moultos, O. (author), Franco, Luís F.M. (author), Spera, Marcelle B.de M. (author), Erdös, M. (author), Economou, Ioannis G. (author) We present a detailed overview of classical molecular simulation studies examining the self-diffusion coefficient of water. The self-diffusion coefficient is directly associated with the calculations of tracer or mutual diffusion coefficient of mixtures and, therefore, is a fundamental transport property, essential for an accurate description...
review 2019