• Title of article

    On decomposition of interaction-induced electric properties of HF dimer

  • Author/Authors

    Skwara، نويسنده , , Bart?omiej and Kaczmarek، نويسنده , , Anna Waksmundzka-Gora، نويسنده , , Robert W. and Bartkowiak، نويسنده , , Wojciech، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2008
  • Pages
    4
  • From page
    203
  • To page
    206
  • Abstract
    Interaction energy in the linear HF dimer is calculated by means of the variational–perturbational scheme. Interaction-induced electric properties: dipole moment, polarizability and first-order hyperpolarizability are decomposed into the terms of physical meaning as the corresponding derivatives of the interaction energy components. The distance dependence of the particular contributions to the interaction energy as well as to the electric properties is reported.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2008
  • Journal title
    Chemical Physics Letters
  • Record number

    1924691