• Title of article

    Magnetic field dependence of nuclear magnetic shielding in closed-shell atomic systems

  • Author/Authors

    Vaara، نويسنده , , Juha and Manninen، نويسنده , , Pekka and Lounila، نويسنده , , Juhani، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2003
  • Pages
    8
  • From page
    750
  • To page
    757
  • Abstract
    We present a response theory formulation for the dependence of nuclear magnetic shielding on the external magnetic field B0 in closed-shell atomic systems. The dependence appears in even powers of B0, and we include terms up to the sixth power of the field. Calculations are carried out for the field-dependence coefficient τ for noble gas atoms as well as halogen and alkali metal ions, based on a nonrelativistic reference state, using self-consistent field (SCF) and correlated multiconfigurational SCF linear and nonlinear response methods.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2003
  • Journal title
    Chemical Physics Letters
  • Record number

    1784138