Author/Authors :
Aoiz، نويسنده , , F.J. and Baٌares، نويسنده , , L. and Herrero، نويسنده , , V.J. and Rلbanos، نويسنده , , V.Sلez and Stark، نويسنده , , K. and Tanarro، نويسنده , , I. and Werner، نويسنده , , H.-J.، نويسنده ,
Abstract :
Reaction cross sections and rate constants for the F + HD reaction have been calculated on the recently released Stark-Werner (SW) ab initio potential energy surface (PES) using the quasiclassical trajectory (QCT) method. The results are compared to other theoretical calculations on different PESs and to experimental isotopic branching ratios. The general agreement is good. Dynamical features related to the asymmetric nature of the HD molecule are also discussed.
