Noura Dawass

4 78 S URFACE E FFECTS (a) (b) Figure 4.5: (a) RDFs for systems of different sizes of a LJ fluid at T = 2 and ρ = 0.4 (dimensionless units), (b) a close–up in of the plots in (a). MD simulations in the NV T ensemble were used to compute g ( r ), and the Ganguly and van der Vegt correction [113] was applied (Eq. (3.3) ).