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dc.creatorScuracchio, Pablo Martín-
dc.creatorCostamagna, Sebastian-
dc.creatorPeeters, F. M.-
dc.creatorDobry, Ariel Oscar-
dc.date2016-06-15T18:26:40Z-
dc.date2016-06-15T18:26:40Z-
dc.date2014-07-
dc.date2016-06-10T18:39:40Z-
dc.date.accessioned2019-04-29T15:48:20Z-
dc.date.available2019-04-29T15:48:20Z-
dc.date.issued2014-07-
dc.identifierScuracchio, Pablo Martín; Costamagna, Sebastian; Peeters, F. M. ; Dobry, Ariel Oscar; Role of atomic vacancies and boundary conditions on ballistic thermal transport in graphene nanoribbons; American Physical Society; Physical Review B: Condensed Matter and Materials Physics; 90; 7-2014; 35429-35429-
dc.identifier0556-2805-
dc.identifierhttp://hdl.handle.net/11336/6190-
dc.identifier.urihttp://rodna.bn.gov.ar:8080/jspui/handle/bnmm/302504-
dc.descriptionQuantum thermal transport in armchair and zigzag graphene nanoribbons is investigated in the presence of single atomic vacancies and subject to different boundary conditions. We start with a full comparison of the phonon polarizations and energy dispersions as given by a fifth-nearest-neighbor force-constant model (5NNFCM) and by elasticity theory of continuum membranes (ETCM). For free-edge ribbons, we discuss the behavior of an additional acoustic edge-localized flexural mode, known as fourth acoustic branch (4ZA), which has a small gap when it is obtained by the 5NNFCM. Then, we show that ribbons with supported edges have a sample-size dependent energy gap in the phonon spectrum which is particularly large for in-plane modes. Irrespective to the calculation method and the boundary condition, the dependence of the energy gap for the low-energy optical phonon modes against the ribbon width W is found to be proportional to 1/W for in-plane, and 1/W2 for out-of-plane phonon modes. Using the 5NNFCM, the ballistic thermal conductance and its contributions from every single phonon mode are then obtained by the nonequilibrium Green´s function technique. We found that, while edge and central localized single atomic vacancies do not affect the low-energy transmission function of in-plane phonon modes, they reduce considerably the contributions of the flexural modes. On the other hand, in-plane modes contributions are strongly dependent on the boundary conditions and at low temperatures can be highly reduced in supported-edge samples. These findings could open a route to engineer graphene based devices where it is possible to discriminate the relative contribution of polarized phonons and to tune the thermal transport on the nanoscale.-
dc.descriptionFil: Scuracchio, Pablo Martín. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Rosario. Instituto de Física de Rosario (i); Argentina. Universidad Nacional de Rosario. Facultad de Ciencias Exactas, Ingeniería y Agrimensura; Argentina-
dc.descriptionFil: Costamagna, Sebastian. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Rosario. Instituto de Física de Rosario (i); Argentina. Universidad Nacional de Rosario. Facultad de Ciencias Exactas, Ingeniería y Agrimensura; Argentina. Universiteit Antwerpen; Bélgica-
dc.descriptionFil: Peeters, F. M. . Universiteit Antwerpen; Bélgica-
dc.descriptionFil: Dobry, Ariel Oscar. Universidad Nacional de Rosario. Facultad de Ciencias Exactas, Ingeniería y Agrimensura; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Rosario. Instituto de Física de Rosario (i); Argentina-
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dc.formatapplication/pdf-
dc.formatapplication/pdf-
dc.languageeng-
dc.publisherAmerican Physical Society-
dc.relationinfo:eu-repo/semantics/altIdentifier/url/http://journals.aps.org/prb/abstract/10.1103/PhysRevB.90.035429-
dc.relationinfo:eu-repo/semantics/altIdentifier/doi/http://dx.doi.org/10.1103/PhysRevB.90.035429-
dc.relationinfo:eu-repo/semantics/altIdentifier/doi/10.1103/PhysRevB.90.035429-
dc.relationinfo:eu-repo/semantics/altIdentifier/url/http://arxiv.org/abs/1407.6048v1-
dc.relationinfo:eu-repo/semantics/altIdentifier/arxiv/1407.6048v1-
dc.rightsinfo:eu-repo/semantics/restrictedAccess-
dc.rightshttps://creativecommons.org/licenses/by-nc-sa/2.5/ar/-
dc.sourcereponame:CONICET Digital (CONICET)-
dc.sourceinstname:Consejo Nacional de Investigaciones Científicas y Técnicas-
dc.sourceinstacron:CONICET-
dc.source.urihttp://hdl.handle.net/11336/47415-
dc.subjectGraphene-
dc.subjectThermal Conductivity-
dc.subjectNanoribbons-
dc.subjectBallistic-
dc.subjectFísica de los Materiales Condensados-
dc.subjectCiencias Físicas-
dc.subjectCIENCIAS NATURALES Y EXACTAS-
dc.titleRole of atomic vacancies and boundary conditions on ballistic thermal transport in graphene nanoribbons-
dc.typeinfo:eu-repo/semantics/article-
dc.typeinfo:eu-repo/semantics/publishedVersion-
dc.typeinfo:ar-repo/semantics/articulo-
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