
Figure 5: Periodic Box Condition(The dotted line circle indicates the cut off radius (Rc))(The yellow colored cell indicates the central cell which is translated in x,y and z direction)

Figure 6 Periodic boundary conditions in a three dimensional view. The orange colour box is the central simulation box. All other boxes are the images of the original simulation box. The particles move in and out as shown with arrows.

Figure 7: Depiction of the difference between the cutoff and the pair list distance.(The oval shaped indicates atoms)