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dc.contributor.authorKOHLI, VINAY KUMAR-
dc.date.accessioned2016-10-26T11:51:58Z-
dc.date.available2016-10-26T11:51:58Z-
dc.date.issued2016-10-
dc.identifier.urihttp://dspace.dtu.ac.in:8080/jspui/handle/repository/15261-
dc.description.abstractWe have investigated the stability and electronic properties of zigzag graphene nanoribbons (ZGNR) with Titanium and Zirconium termination using density functional theory. Stability has been analyzed on the basis of binding energy, and electronic properties are analyzed by band structure and density of state. We found that termination of Ti and Zr could be used to enhance metallicity in ZGNR, interesting results was found in case of Zr both edge termination which shows the highest binding energy than all other configurations.en_US
dc.language.isoen_USen_US
dc.relation.ispartofseriesTD NO.2529;-
dc.subjectZIGZAG GRAPHENE NANORIBBONSen_US
dc.subjectZIRCONIUM TERMINATIONen_US
dc.subjectTITANIUMen_US
dc.titleFIRST PRINCIPLE CALCULATION OF ZIGZAG GRAPHENE NANORIBBONS WITH TITANIUM AND ZIRCONIUM TERMINATIONen_US
dc.typeThesisen_US
Appears in Collections:M.E./M.Tech. Applied Physics

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