• 文献标题:   Phonon anharmonicities in graphite and graphene
  • 文献类型:   Article
  • 作  者:   BONINI N, LAZZERI M, MARZARI N, MAURI F
  • 作者关键词:  
  • 出版物名称:   PHYSICAL REVIEW LETTERS
  • ISSN:   0031-9007
  • 通讯作者地址:   MIT
  • 被引频次:   255
  • DOI:   10.1103/PhysRevLett.99.176802
  • 出版年:   2007

▎ 摘  要

We determine from first principles the finite-temperature properties-linewidths, line shifts, and lifetimes-of the key vibrational modes that dominate inelastic losses in graphitic materials. In graphite, the phonon linewidth of the Raman-active E-2g mode is found to decrease with temperature; such anomalous behavior is driven entirely by electron-phonon interactions, and does not appear in the nearly degenerate infrared-active E-1u mode. In graphene, the phonon anharmonic lifetimes and decay channels of the A(1) mode at K dominate over E-2g at Gamma and couple strongly with acoustic phonons, highlighting how ballistic transport in carbon-based interconnects requires careful engineering of phonon decays and thermalization.