Small · 2017 · 44 citations · 53 references
Natural SciencesMaterials EngineeringMaterials ScienceMolecular PhysicsNanomaterialsNanotechnologyCarbon NanotubesMolecular DynamicsMolecular RotationNanomechanicsNanotubesRotational StructureCarbon Nanotube MechanicsResponsivenessRotational Properties
Using molecular dynamics simulations, it is shown that a carbon nanotube (CNT) suspended in water and subjected to a rotating electric field of proper magnitude and angular speed can be rotated with the aid of water dipole orientations. Based on this principle, a rotational nanomotor structure is designed and the system is simulated in water. Use of the fast responsiveness of electric‐field‐induced CNT orientation in water is employed and its operation at ultrahigh‐speed (over 10 11 r.p.m.) is shown. To explain the basic mechanism, the behavior of the rotational actuation, originated from the water dipole orientation, is also analyzed . The proposed nanomotor is capable of rotating an attached load (such as CNT) at a precise angle as well as nanogear‐based complex structures. The findings suggest a potential way of using the electric‐field‐induced CNT rotation in polarizable fluids as a novel tool to operate nanodevices and systems.
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VMD: Visual molecular dynamics
William Humphrey, Andrew Dalke, Klaus Schulten · Journal of Molecular Graphics · 1996 · 66.6K citations
Molecular dynamics with coupling to an external bath
Herman J. C. Berendsen, Johan P. M. Postma, Wilfred F. van Gunsteren et al. · The Journal of Chemical Physics · 1984 · 31K citations · Full text
Natural Sciences, Chemistry, Physics +17