• Title of article

    Long-range coefficients for the low-lying electronic states of LiB

  • Author/Authors

    Pouchan، نويسنده , , Claude and Rérat، نويسنده , , Michel، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 1996
  • Pages
    5
  • From page
    409
  • To page
    413
  • Abstract
    Dynamic electric dipole polarizabilities of Li (2S; 2P) and B (2P) are obtained by a time dependent gauge invariant method. C6 coefficients are deduced from the fit of sum-over-states functions to the dynamic polarizabilities at imaginary frequencies, in taking the first oscillator strength and transition energy values calculated at the configuration interaction level as starting points. The dispersion coefficients for the low-lying electronic states of LiB that dissociate into Li 2S(2s1)+ B 2P(2p1) and Li2 P(2p1) + B2 P(2p1) are reported.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    1996
  • Journal title
    Chemical Physics Letters
  • Record number

    1777489