• Title of article

    Quasirelativistic multipartitioning perturbation theory calculations on electronic transitions in Au2

  • Author/Authors

    Itkin، نويسنده , , Igor and Zaitsevskii، نويسنده , , Andréi، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2003
  • Pages
    8
  • From page
    143
  • To page
    150
  • Abstract
    Quasirelativistic multipartitioning many-body perturbation theory is applied to ab initio calculations on electronic transitions in the gold dimer. Potential energy functions and spectroscopic constants for low-lying excited states and transition dipole moment functions for main radiative decay channels of experimentally observed states are reported.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2003
  • Journal title
    Chemical Physics Letters
  • Record number

    1784593