碳纳米管
激子
谱线
材料科学
电子
从头算
光学光谱
从头算量子化学方法
金属
分子物理学
原子物理学
凝聚态物理
纳米技术
物理
量子力学
分子
冶金
作者
Catalin D. Spataru,Sohrab Ismail‐Beigi,Lorin X. Benedict,Steven G. Louie
标识
DOI:10.1103/physrevlett.92.077402
摘要
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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