• Title of article

    Theoretical study of the third-order nonlinear optical susceptibilities for the β-phase crystal of p-NPNN

  • Author/Authors

    Yamada، نويسنده , , Satoru and Nakano، نويسنده , , Masayoshi and Shigemoto، نويسنده , , Isamu and Kiribayashi، نويسنده , , Shinji and Yamaguchi، نويسنده , , Kizashi، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 1997
  • Pages
    7
  • From page
    438
  • To page
    444
  • Abstract
    The third-order nonlinear optical susceptibilities for the β-phase crystal of para-nitrophenyl nitronyl nitroxide (p-NPNN), which is an open-shell system with nitroxide radicals, are investigated by the oriented gas model. The second hyperpolarizabilities of p-NPNN are calculated by using the INDO coupled Hartree-Fock method. The largest component of the susceptibilities for the crystal is predicted to be negative as well as that of the second hyperpolarizabilities of p-NPNN.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    1997
  • Journal title
    Chemical Physics Letters
  • Record number

    1780102