• Title of article

    Comment on `A computational study of the novel metastable compound HKrSHʹ [S.A.C. McDowell, Chem. Phys. Lett. 372 (2003) 553–556]

  • Author/Authors

    Lundell، نويسنده , , J. and Khriachtchev، نويسنده , , L. J. Pettersson، نويسنده , , M. and Rنsنnen، نويسنده , , M.، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2004
  • Pages
    2
  • From page
    228
  • To page
    229
  • Abstract
    A recent computational study published in this journal suggests that a novel metastable molecule HKrSH exists and calculations at the MP2/6-311++G(2d,2p) level indicate a barrier high enough to trap this molecule in its local stable configuration. However, the report fails to present all factors influencing its stability and these inadequacies greatly affect the conclusions on the existence and experimental characterisation of such species.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2004
  • Journal title
    Chemical Physics Letters
  • Record number

    1783885