화학공학소재연구정보센터
Chemical Physics Letters, Vol.430, No.1-3, 84-88, 2006
Conformational behavior of semi-flexible polymers confined to a cylindrical surface
Uniform wrapping of a polymers around carbon nanotubes has been recently reported as a means to separate individual nanotubes from their natural bundled state. It has been suggested that polymers wrap the nanotubes in a helical manner due to various interactions, including pi-stacking, hydrophobic and van der Waals. In this communication, we show that surface curvature plays an important role in stabilizing helical conformations. We use Monte Carlo simulations supported by simple thermodynamics arguments to reveal that semi-flexible chains adopt ordered helical conformations at a narrow range of radii, depending only on the stiffness of the chain and cylinder radius. (c) 2006 Elsevier B.V. All rights reserved.