• Title of article

    Computing polarizabilities without a Hamiltonian matrix

  • Author/Authors

    Britta Wlotzka، نويسنده , , Alexander and Carrington Jr.، نويسنده , , Tucker، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2012
  • Pages
    4
  • From page
    96
  • To page
    99
  • Abstract
    Using techniques of numerical linear algebra it is possible to calculate polarizabilities and hyperpolarizabilities without computing or storing a Hamiltonian matrix. This is done by exploiting the structure of the basis to evaluate matrix–vector products. The ideas are tested on a one dimensional Hubbard model.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2012
  • Journal title
    Chemical Physics Letters
  • Record number

    1932631