Physical Review Letters · 2004 · 957 citations · 21 references
Natural SciencesMaterials SciencePhysicsCondensed Matter PhysicsNanotechnologySpectroscopyAtomic ExcitationCarbon NanomaterialsCarbon NanotubesElectron CorrelationNanotubesOptical Properties Of SemiconductorsAb Initio CalculationsAb Initio SimulationsCarbon Nanotube Electronic StructureExcitonic EffectsExcitonsFirst-principles ModelingOptical Properties Of NanotubesSingle-walled Carbon Nanotubes
Many-electron effects often dramatically modify the properties of reduced dimensional systems. We report calculations, based on an ab initio many-electron Green's function approach, of electron-hole interaction effects on the optical spectra of small-diameter single-walled carbon nanotubes. Excitonic effects qualitatively alter the optical spectra of both semiconducting and metallic tubes. Excitons are bound by approximately 1 eV in the semiconducting (8,0) tube and by approximately 100 meV in the metallic (3,3) tube. These large many-electron effects explain the discrepancies between previous theories and experiments.
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Self-Consistent Equations Including Exchange and Correlation Effects
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