• Title of article

    Compact Hylleraas-type wavefunctions for the lithium isoelectronic sequence

  • Author/Authors

    Thakkar، نويسنده , , Ajit J and Koga، نويسنده , , Toshikatsu and Tanabe، نويسنده , , Tomomi and Teruya، نويسنده , , Hirohide، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2002
  • Pages
    5
  • From page
    95
  • To page
    99
  • Abstract
    Compact Hylleraas-type wavefunctions of three types, denoted A, B and C, are constructed for the 2S ground states of the lithium atom and its isoelectronic ions Be+, B2+,…,Si11+. All the exponents and powers of the basis functions are optimized. The 20-term type B and 50-term type C wavefunctions are as accurate as several significantly larger expansions reported in the literature. The 50-term type C wavefunctions predict energies accurate to better than 3 parts in 107.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2002
  • Journal title
    Chemical Physics Letters
  • Record number

    1782428