Molecular dynamic calculation of the viscosity of an aqueous solution of sodium chloride: model approbation and analysis of its computational complexity. PART №3

In this work, computational experiments using the classical molecular dynamics method were carried out to study the electrolyte dissociation of sodium chloride ions in distilled water, depending on the shape of the immersed crystals and the temperature of the considered ensemble, on the Fisher supercomputer (JIHT RAS). Cubic, spherical, tablet-shaped, and rod-shaped nanocrystals were examined, and the calculations revealed that the initial shape can have a significant influence on the dissolution process.