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Orientation of a benzene molecule inside a carbon nanotube

✍ Scribed by Thien Tran-Duc; Ngamta Thamwattana; James M. Hill

Book ID
106419959
Publisher
Springer
Year
2011
Tongue
English
Weight
385 KB
Volume
49
Category
Article
ISSN
0259-9791

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Structural stability of a coaxial carbon
Structural stability of a coaxial carbon nanotube inside a boron–nitride nanotube
✍ Jianhui Yuan; K.M. Liew πŸ“‚ Article πŸ“… 2011 πŸ› Elsevier Science 🌐 English βš– 922 KB

The structural stability of a coaxial carbon nanotube inside a boron-nitride nanotube (C@BNNT) is investigated by molecular dynamics simulation. The geometric structures of armchair C(5,5)@BN(n,n) and zigzag C(9,0)@BN(m,0) nanotubes (n = 8-15; m = 15-22) are optimized by the density functional theor