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1,3-Dipolar cycloadditions of Stone-Wales defective single-walled carbon nanotubes: A theoretical study

✍ Scribed by Yang, Tao; Zhao, Xiang; Nagase, Shigeru


Book ID
121207978
Publisher
John Wiley and Sons
Year
2013
Tongue
English
Weight
813 KB
Volume
34
Category
Article
ISSN
0192-8651

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Using molecular dynamics simulation, we investigate the influence of Stone-Thrower-Wales defects in the mechanical behavior of a zigzag (5, 0) single-walled carbon nanotube considering two different interatomic potential functions, the Tersoff-Brenner bond order potential and the Tight-Binding poten