SIMULATION OF TRANSPORT PHENOMENA OF FULLERENES IN THE FLUID BY METHOD OF MOLECULAR DYNAMICS

Abstract

In the frameworks of classical molecular dynamics method the coefficients of
diffusion and viscosity of fullerenes in fluid (benzol) depending on the tempera
ture of nanosuspension have been calculated.The effective potential of fullerene
molecule interaction used in calculations is obtained under the assumption of
additivity of fullerene and fluid molecules interaction, where fullerene is consid
ered as a solid particle.