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Buckled graphene: A model study based on density functional theory

dc.contributor.authorKhan, Yasser
dc.contributor.authorMukaddam, Mohsin Ahmed
dc.contributor.authorSchwingenschlögl, Udo
dc.date.accessioned2015-08-02T09:13:35Z
dc.date.available2015-08-02T09:13:35Z
dc.date.issued2010-09
dc.identifier.citationKhan, M. A., Mukaddam, M. A., & Schwingenschlögl, U. (2010). Buckled graphene: A model study based on density functional theory. Chemical Physics Letters, 498(1-3), 157–161. doi:10.1016/j.cplett.2010.08.059
dc.identifier.issn00092614
dc.identifier.doi10.1016/j.cplett.2010.08.059
dc.identifier.urihttp://hdl.handle.net/10754/561531
dc.description.abstractWe make use of ab initio calculations within density functional theory to investigate the influence of buckling on the electronic structure of single layer graphene. Our systematic study addresses a wide range of bond length and bond angle variations in order to obtain insights into the energy scale associated with the formation of ripples in a graphene sheet. © 2010 Elsevier B.V. All rights reserved.
dc.publisherElsevier BV
dc.titleBuckled graphene: A model study based on density functional theory
dc.typeArticle
dc.contributor.departmentComputational Physics and Materials Science (CPMS)
dc.contributor.departmentElectrical Engineering Program
dc.contributor.departmentMaterial Science and Engineering Program
dc.contributor.departmentPhysical Science and Engineering (PSE) Division
dc.identifier.journalChemical Physics Letters
kaust.personSchwingenschlögl, Udo
kaust.personKhan, Yasser
kaust.personMukaddam, Mohsin Ahmed


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