• Title of article

    Electron-pair densities of singly charged atoms

  • Author/Authors

    Matsuyama، نويسنده , , Hisashi and Koga، نويسنده , , Toshikatsu، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 1999
  • Pages
    8
  • From page
    515
  • To page
    522
  • Abstract
    For the singly charged 53 cations from Li+ to Cs+ and 43 anions from H− to I− in their ground states, spherically averaged electron-pair intracule (relative-motion) density h(u), extracule (center-of-mass-motion) density d(R), and their moments 〈un〉 and 〈Rn〉 are examined, where u and R are the interelectronic distance and the center-of-mass radius of a pair of electrons, respectively. The intracule and extracule densities of all the 96 ions are found to be monotonically decreasing functions, as for neutral atoms. Approximate relations d(R)≅8h(2R) and 〈un〉/〈Rn〉≅2n are confirmed to be valid for the charged atoms as well.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    1999
  • Journal title
    Chemical Physics Letters
  • Record number

    1776779