2015
DOI: 10.1039/c5cp00914f
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Composition-dependent buckling behaviour of hybrid boron nitride–carbon nanotubes

Abstract: The buckling of hybrid boron nitride-carbon nanotubes (BN-CNTs) with various BN compositions and locations of the BN domain is investigated using molecular dynamics. We find that BN-CNTs with large BN composition (>38%) only undergo local shell-like buckling in their BN domain. Although similar local shell-like buckling can occur in BN-CNTs with a relatively small BN composition, it can transfer to the global column-like buckling of the whole BN-CNT with increasing strains. The critical strains for local shell… Show more

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Cited by 22 publications
(6 citation statements)
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“…It is worth mentioning that in addition to the in-plane heterostructure such as the graphene/ h -BN junctions studied here, there exist other possible heterostructures, such as the graphene/ h -BN cross-plane configurations and one-dimensional (1D) nanotube junctions. In the hybrid BN-carbon nanotubes, stress mismatch is also present at the interface, which is similar to the graphene/ h -BN heterostructure considered here. Therefore, introduction of topological defects at the interface is also expected to enhance the ITC at junctions of these hybrid BN-carbon nanotubes.…”
Section: Resultsmentioning
confidence: 58%
“…It is worth mentioning that in addition to the in-plane heterostructure such as the graphene/ h -BN junctions studied here, there exist other possible heterostructures, such as the graphene/ h -BN cross-plane configurations and one-dimensional (1D) nanotube junctions. In the hybrid BN-carbon nanotubes, stress mismatch is also present at the interface, which is similar to the graphene/ h -BN heterostructure considered here. Therefore, introduction of topological defects at the interface is also expected to enhance the ITC at junctions of these hybrid BN-carbon nanotubes.…”
Section: Resultsmentioning
confidence: 58%
“…ITR at solid/solid interfaces was studied extensively in the literature [9][10][11][12][13][14][15][16][17][18]. The energy of atomic vibration, i.e.…”
Section: Introductionmentioning
confidence: 99%
“…On the other hand, An and Turner 33 used density functional theory to investigate the electrical property of heteronanotubes. Zhang and Meguid 34 investigated the stability of BNC nanotube under uniaxial compression.…”
Section: Introductionmentioning
confidence: 99%