• Title of article

    Theoretical studies on nonlinear optical properties of organometallic conjugated systems III: second hyperpolarizabilities of Mn(I)-carbene systems

  • Author/Authors

    Shigemoto، نويسنده , , I. and Nakano، نويسنده , , M. and Yamada، نويسنده , , S. and Kiribayashi، نويسنده , , S. and Yamanaka، نويسنده , , S. and Yamaguchi، نويسنده , , K.، نويسنده ,

  • Issue Information
    دوماهنامه با شماره پیاپی سال 1997
  • Pages
    2
  • From page
    2241
  • To page
    2242
  • Abstract
    Various ab initio electron-correlation methods are applied to calculate second hyperpolarizabilities (γs) of MnCH+, MnCH2+ and MnCH3+. These systems showed significant dependences on the electron correlations. MnCH3+, which have a single MnC bond, exhibited the larger γ than MnCH+ and MnCH2+, which have weak π bonds.
  • Keywords
    Ab initio quantum chemical methods and calculations , Transition metals , Hyperpolarizabilities
  • Journal title
    Synthetic Metals
  • Serial Year
    1997
  • Journal title
    Synthetic Metals
  • Record number

    2071361

    • Link To Document
    https://search.isc.ac/dl/search/defaultta.aspx?DTC=10&DC=2071361