Title of article :
Three-center semi-empirical potential energy surfaces for the reactions F+H2O and F+OH
Author/Authors :
Kornweitz، نويسنده , , Haya and Persky، نويسنده , , Avigdor، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2000
Abstract :
Three-center semi-empirical LEPS potential energy surfaces were constructed for the F+HX (X=OH) and F+OH reactions. Trajectory calculations on these surfaces reproduced quite well the available experimental results with regard to rate constants and vibrational state distributions of the products. The results are presented and discussed.
Journal title :
Chemical Physics Letters
Journal title :
Chemical Physics Letters