Molecular dynamics modeling and simulations of carbon nanotube-based gears

• Main Authors: Yeak Su Hoe,, Che Lokman Jaafar,, Ng, Teng Yong
• Format: Article
• Language: English
• Published: Universiti Kebangsaan Malaysia 2012
• Online Access: http://journalarticle.ukm.my/5304/1/13%2520Yeak%2520Su%2520Hoe.pdf; http://journalarticle.ukm.my/5304/; http://www.ukm.my/jsm/contents.html

A molecular dynamics (MD) modeling method was applied to investigate the properties of carbon nanotube-based gears (CNT gears). The Brenner’s reactive hydrocarbon potential was used in order to calculate the short range interatomic forces. The Lennard-Jones 6-12 (LJ) was used to calculate the long r...