Mechanics of atoms interacting with a carbon nanotorus: optimal configuration and oscillation behaviour
Date
2019
Authors
Sarapat, P.
Hill, J.M.
Baowan, D.
Editors
Advisors
Journal Title
Journal ISSN
Volume Title
Type:
Journal article
Citation
Philosophical Magazine, 2019; 99(11):1386-1399
Statement of Responsibility
Conference Name
Abstract
In this paper, we investigate a carbon nanotorus as a caged molecular structure interacting with an atom. Assuming that the atom is located along the central axis perpendicular to the torus, the interaction energy of the system is determined using the continuum approximation together with the Lennard-Jones potential. This approach avoids the intensive computational calculations that are involved in other modelling approaches. Numerical results are presented in terms of dimensionless variables. The results show that the optimal major radius of the torus has a linear relationship with its minor radius when the atom is symmetrically situated along the torus axis. When the atom is offset from this axis, the minimum energy location shifts away from the centre as the ratio of the major and minor radii exceeds the value of 0.90. Finally, the oscillatory behaviour for the carbon atom is investigated. Our findings predict a novel nano-oscillator which can produce frequencies in the gigahertz range.
School/Discipline
Dissertation Note
Provenance
Description
Access Status
Rights
Copyright 2019 Informa UK, trading as Taylor & Francis Group