• Title of article

    Complexes of oligopyrrole dications with inorganic anions: a comparative theoretical HF/post-HF study

  • Author/Authors

    Tamm، نويسنده , , Tarmo and Tamm، نويسنده , , Jüri and Karelson، نويسنده , , Mati، نويسنده ,

  • Issue Information
    دوماهنامه با شماره پیاپی سال 2005
  • Pages
    6
  • From page
    47
  • To page
    52
  • Abstract
    The complexes of pyrrole oligomer dications with various inorganic anions were studied using a variety of computational methods ranging from semi-empirical to density functional theory (DFT) and MP2. The geometry of the complexes and the differences in co
  • Keywords
    Counter-ions , Pyrrole oligomer dications , Polypyrrole , quantum chemical calculations
  • Journal title
    Synthetic Metals
  • Serial Year
    2005
  • Journal title
    Synthetic Metals
  • Record number

    2081129

    • Link To Document
    https://search.isc.ac/dl/search/defaultta.aspx?DTC=10&DC=2081129