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College of Engineering(공과대학)Dept. of Materials Science and Engineering(신소재공학과)MS-Journal Papers(저널논문)

Study on cap closure mechanism of single-walled carbon nanotubes by molecular dynamics

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dc.contributor.authorHan, SSko
dc.contributor.authorLee, HyuckMoko
dc.date.accessioned2008-05-20T03:50:43Z-
dc.date.available2008-05-20T03:50:43Z-
dc.date.created2012-02-06-
dc.date.created2012-02-06-
dc.date.issued2004-05-
dc.identifier.citationMATERIALS TRANSACTIONS, v.45, no.5, pp.1437 - 1441-
dc.identifier.issn1345-9678-
dc.identifier.urihttp://hdl.handle.net/10203/4607-
dc.description.abstractThe closing mechanism of zigzag single-walled carbon nanotubes (SWCNT) was investigated using the molecular dynamics (MD) simulation at the experimental arcdischarge temperature of 3000 K. The (10,0) SWCNT with a diameter of 0.78 nm showed a dome-shape tip which evolved into a saddle-shaped cap that was caused by double heptagon-octagon pairs. In the case of (18,0) SWCNT with a diameter of 1.404 nm, a zipper-like closing mechanism was observed and the flat cap was obtained.-
dc.description.sponsorshipThis research was performed by the financial support of ‘Center for Nanostructured Materials Technology’ under ‘21st Century Frontier R&D Programs’ of the Ministry of Science and Technology, Korea.en
dc.languageEnglish-
dc.language.isoenen
dc.publisherJAPAN INST METALS-
dc.subjectGROWTH-
dc.titleStudy on cap closure mechanism of single-walled carbon nanotubes by molecular dynamics-
dc.typeArticle-
dc.identifier.wosid000221863900009-
dc.identifier.scopusid2-s2.0-3342940912-
dc.type.rimsART-
dc.citation.volume45-
dc.citation.issue5-
dc.citation.beginningpage1437-
dc.citation.endingpage1441-
dc.citation.publicationnameMATERIALS TRANSACTIONS-
dc.identifier.doi10.2320/matertrans.45.1437-
dc.embargo.liftdate9999-12-31-
dc.embargo.terms9999-12-31-
dc.contributor.localauthorLee, HyuckMo-
dc.contributor.nonIdAuthorHan, SS-
dc.type.journalArticleArticle-
dc.subject.keywordAuthorcarbon nanotube-
dc.subject.keywordAuthormolecular dynamics simulation-
dc.subject.keywordAuthorcap closure mechanism-
dc.subject.keywordAuthorzipper-like mechanism-
dc.subject.keywordPlusGROWTH-
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MS-Journal Papers(저널논문)
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