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Article: Theoretical interpretation of different nanotube morphologies among Group III (B, Al, Ga) nitrides

TitleTheoretical interpretation of different nanotube morphologies among Group III (B, Al, Ga) nitrides
Authors
Issue Date2005
PublisherElsevier BV. The Journal's web site is located at http://www.elsevier.com/locate/cplett
Citation
Chemical Physics Letters, 2005, v. 408 n. 1-3, p. 145-149 How to Cite?
AbstractThree different nanotube structures, armchair, zigzag and wurtzite, were studied using B3LYP/6-31G(d) for carbon, BN, AlN and GaN nanotubes, respectively. Our calculations found that AlN and GaN can implausibly form the usual tubular morphologies of carbon and BN nanotubes. The same conclusion was confirmed based on analyzing the different configurations of benzene, borazine, and the analogies of the hexagonal Al3N3H6 and Ga3N3H6 at the same level of calculations. © 2005 Elsevier B.V. All rights reserved.
Persistent Identifierhttp://hdl.handle.net/10722/167925
ISSN
2015 Impact Factor: 1.86
2015 SCImago Journal Rankings: 0.757
ISI Accession Number ID
References

 

DC FieldValueLanguage
dc.contributor.authorZhang, Men_US
dc.contributor.authorSu, ZMen_US
dc.contributor.authorYan, LKen_US
dc.contributor.authorQiu, YQen_US
dc.contributor.authorChen, GHen_US
dc.contributor.authorWang, RSen_US
dc.date.accessioned2012-10-08T03:13:00Z-
dc.date.available2012-10-08T03:13:00Z-
dc.date.issued2005en_US
dc.identifier.citationChemical Physics Letters, 2005, v. 408 n. 1-3, p. 145-149en_US
dc.identifier.issn0009-2614en_US
dc.identifier.urihttp://hdl.handle.net/10722/167925-
dc.description.abstractThree different nanotube structures, armchair, zigzag and wurtzite, were studied using B3LYP/6-31G(d) for carbon, BN, AlN and GaN nanotubes, respectively. Our calculations found that AlN and GaN can implausibly form the usual tubular morphologies of carbon and BN nanotubes. The same conclusion was confirmed based on analyzing the different configurations of benzene, borazine, and the analogies of the hexagonal Al3N3H6 and Ga3N3H6 at the same level of calculations. © 2005 Elsevier B.V. All rights reserved.en_US
dc.languageengen_US
dc.publisherElsevier BV. The Journal's web site is located at http://www.elsevier.com/locate/cpletten_US
dc.relation.ispartofChemical Physics Lettersen_US
dc.titleTheoretical interpretation of different nanotube morphologies among Group III (B, Al, Ga) nitridesen_US
dc.typeArticleen_US
dc.identifier.emailChen, GH:ghc@yangtze.hku.hken_US
dc.identifier.authorityChen, GH=rp00671en_US
dc.description.naturelink_to_subscribed_fulltexten_US
dc.identifier.doi10.1016/j.cplett.2005.04.025en_US
dc.identifier.scopuseid_2-s2.0-18844413616en_US
dc.identifier.hkuros101887-
dc.relation.referenceshttp://www.scopus.com/mlt/select.url?eid=2-s2.0-18844413616&selection=ref&src=s&origin=recordpageen_US
dc.identifier.volume408en_US
dc.identifier.issue1-3en_US
dc.identifier.spage145en_US
dc.identifier.epage149en_US
dc.identifier.isiWOS:000229655200027-
dc.publisher.placeNetherlandsen_US
dc.identifier.scopusauthoridZhang, M=36043218200en_US
dc.identifier.scopusauthoridSu, ZM=7402248791en_US
dc.identifier.scopusauthoridYan, LK=7402670602en_US
dc.identifier.scopusauthoridQiu, YQ=7403279532en_US
dc.identifier.scopusauthoridChen, GH=35253368600en_US
dc.identifier.scopusauthoridWang, RS=7405336974en_US

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