A. Lagana et al., ACCURATE CALCULATIONS OF CROSS-SECTIONS AND RATE COEFFICIENTS OF SOMEATOM-DIATOM REACTIONS RELEVANT TO PLASMA CHEMISTRY, Plasma sources science & technology, 6(3), 1997, pp. 270-279
Theoretical approaches to the accurate dynamical calculation of cross
sections and rate coefficients of neutral atom-diatom reactions are il
lustrated. Computational steps needing to be accomplished in order to
tackle the study of some gas phase reactions are examined, By making r
eference to our work calculated properties of these reactions are disc
ussed in detail to stress when and where theory has been successful in
reproducing experimental findings and to evidence some new insights s
timulated by the theoretical investigation.