Ab-initio electron transport calculations of carbon based string structures

dc.creatorTongay, S.
dc.creatorSenger, R. T.
dc.creatorDag, S.
dc.creatorCiraci, S.
dc.date2004-10-16
dc.date2005-05-13
dc.date.accessioned2026-07-07T03:01:31Z
dc.date.available2026-07-07T03:01:31Z
dc.descriptionFirst-principles calculations show that monatomic strings of carbon have high cohesive energy and axial strength, and exhibit stability even at high temperatures. Due to their flexibility and reactivity, carbon chains are suitable for structural and chemical functionalizations; they form also stable ring, helix, grid and network structures. Analysis of electronic conductance of various infinite, finite and doped string structures reveal fundamental and technologically interesting features. Changes in doping and geometry give rise to dramatic variations in conductance. In even-numbered linear chains strain induces substantial decrease of conductance. The double covalent bonding of carbon atoms underlies their unusual chemical, mechanical and transport properties.
dc.description4 pages, 4 figures
dc.identifierhttps://arxiv.org/abs/cond-mat/0410418
dc.identifierhttp://arxiv.org/abs/cond-mat/0410418
dc.identifierPhysical Review Letters 93, 136404 (2004)
dc.identifierdoi:10.1103/PhysRevLett.93.136404
dc.identifier.urihttp://salesiana.dossiersoluciones.com/handle/123456789/25080
dc.subjectMaterials Science
dc.subjectMesoscale and Nanoscale Physics
dc.titleAb-initio electron transport calculations of carbon based string structures
dc.typetext

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