Gp. Dimitrakopulos et al., THE DEFECT CHARACTER OF CARBON NANOTUBES AND NANOPARTICLES, Acta crystallographica. Section A, Foundations of crystallography, 53, 1997, pp. 341-351
Circuit mapping is employed to study the defect content of buckytubes
and carbon nanoparticles. The topological analysis enables the connect
ion with the well established defect theory of crystalline materials.
The complementarity between defect models of two- and three-dimensiona
l structures is considered as well as the significance of dislocation
descriptions of these materials. In accordance with recent experimenta
l observations, the possibility of three-dimensional hexagonal graphit
ic stacking of atoms in these structures is examined through the intro
duction of appropriate defects that are admissible in graphite. Defect
s in graphene sheets introduce cap closure of isolated tubules and cha
nges in tubule orientation, radius and helicity. In multilayered tubes
, appropriate defects can accommodate curvature among adjacent sheets
so that the ...ABAB... stacking is preserved. However, the graphite st
acking is generally destroyed in multilayered caps owing to the lack o
f appropriate graphite defects for their accommodation.