Carbil
From Intelligent Materials and Systems Lab
Generation of the simulation box
The CDC carbon model was constructed of carbon sheets with different amount of defects. 8 types of carbon sheet were used:
Flake type 0
Flat sheet with 24 cycles and no defects.
Flake type 1
Curved sheet with 23 normal hexagon cycles and one defect in the form of a pentagonal cycle in the middle of the flake.
Flake type 2
Sheet with one defect near the edge.
Flake type 3
Sheet with two defects: one on the edge, another near the edge.
Flake type 4
Sheet with three defects located on a straight line - one in the middle, two on the edges.
Flake type 5
Two defects near the edges.
Flake type 6
One defect in the middle, two on the edges.
Flake type 7
Sheet with one defect in the middle.