Amorphous layer coating induced brittle to ductile transition in single crystalline SiC nanowires: an atomistic simulation

作者:Wang, Zhiguo*; Zu, Xiaotao; Li, Zhijie; Gao, Fei
来源:Journal of Physics D: Applied Physics , 2008, 41(15): 155419.
DOI:10.1088/0022-3727/41/15/155419

摘要

Molecular dynamics simulations with Tersoff potentials were used to study the response of SiC nanowires with and without amorphous coating to a tensile strain along the axial direction. The uncoated nanowires show brittle properties and fail through bond breaking. Although the amorphous coating leads to a decrease in the Young's modulus of nanowires, yet it also leads to the appearance of plastic deformation under axial strain. These results provide an effective way to modify the brittle properties of some other semiconductor nanowires.