R. Heyd et al., UNIAXIAL-STRESS EFFECTS ON THE ELECTRONIC-PROPERTIES OF CARBON NANOTUBES, Physical review. B, Condensed matter, 55(11), 1997, pp. 6820-6824
Using a semiempirical tight-binding approach modified through introduc
tion of a deformation potential, we have calculated the effects of uni
axial stress on the electronic density of states of carbon tubules. Fo
r zigzag tubules (n,0) the gap varies linearly with stress and indepen
dently of diameter: \dE(gap)/d sigma\ = 10.7 meV/GPa for \sigma\ < 10
GPa, and a semiconductor to metal transition is predicted. The behavio
r is strongly dependent on whether n = 3q, 3q - 1, 3q + 1. The armchai
r tubules remain metallic under all conditions studied.