Carbon Nanotube Initiated Formation of Carbon Nanoscrolls

Physics – Condensed Matter – Mesoscale and Nanoscale Physics

Scientific paper

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12 pages, 3 figures

Scientific paper

10.1063/1.3479050

The unique topology and exceptional properties of carbon nanoscrolls (CNSs) have inspired unconventional nano-device concepts, yet the fabrication of CNSs remains rather challenging. Using molecular dynamics simulations, we demonstrate the spontaneous formation of a CNS from graphene on a substrate, initiated by a carbon nanotube (CNT). The rolling of graphene into a CNS is modulated by the CNT size, the carbon-carbon interlayer adhesion, and the graphene-substrate interaction. A phase diagram emerging from the simulations can offer quantitative guideline toward a feasible and robust physical approach to fabricating CNSs.

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