  We use molecular dynamics simulations to study the diffusion of water inside
deformed carbon nanotubes with different degrees of deformation at 300 K. We
found that the number of hydrogen bonds that water forms depends on nanotube
topology, leading to enhancement or suppression of water diffusion. The
simulation results reveal that more realistic nanotubes should be considered to
understand the confined water diffusion behavior, at least for the narrowest
nanotubes, when the interaction between water molecules and carbon atoms is
relevant.
