Employing the quasi-classical trajectory method and the potential energy surface of Panda and Sathyamurhy [Panda A N and Sathyamurthy N 2004 J. Chem. Phys. 121 9343], the effect of the reagent vibration on vector correlation of the ion-molecule reactions D- + H2 and H- + D2 is studied at a collision energy of 35.7 kcal/mol. Four generalized polarization-dependent differential cross sections (2π/σ) (dσ00/dωt), (2π/σ) (dσ20/dσ20), (27π/σ) (dσ22+/dwt), and (2π/σ)(dπ/σ) are presented in the centre-of-mass reference frame, separately. At the same time, the effects on the product angular distributions P(θr), P(~r) and P(Oφ) of the title reactions are also analysed. The calculated results show that the scattering tendencies of the product HD, the alignment and the orientation of j^1 sensitively depend on reagent molecule vibration.
The quasi-classical trajectory (QCT) is calculated to study the stereodynamics properties of the title reaction H(^2S) + NH (X^3 ∑^-, v = 0, j = 0)→ N(^4S) + H2 on the ground state ^4A″ potential energy surface (PES) constructed by Zhai and Han [2011 Jr. Chem. Phys. 135 104314]. The calculated QCT reaction probabilities and cross sections are in good agreement with the previous theoretical results. The effects of the collision energy on the k-kt distribution and the product polarization of H2 are studied in detail. It is found that the scattering direction of the product is strongly dependent on the collision energy. With the increase in the collision energy, the scattering directions of the products change from backward scattering to forward scattering. The distribution of P(Or) is strongly dependent on the collision energy below the lower collision energy (about 11.53 kcal/mol). In addition, the P((Pr) distribution dramatically changes as the collision energy increases. The calculated QCT results indicate that the collision energy plays an important role in determining the stereodynamics of the title reaction.