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Quasi-classical trajectory (QCT) calculations are employed for the reaction F + HO(0,0)→HF + O based on the adiabatic potential energy surface (PES) of the ground 3A″triplet state. The average rotational alignment factor as a function of collision energy and the four polarization dependent generalized differential cross sections have been calculated in the center-of-mass (CM) frame, separately. The distribution P(θr) of the angle between k and j′, the distribution P(θr) of dihedral angle denoting k-k′-j′ correlation, and the angular distribution P(θr, Φr) of product rotational vectors in the form of polar plots are calculated as well. The effect of Heavy-Light-Heavy (HLH) mass combination and atom F’s relatively strong absorbability to charges on the alignment and the orientation of product molecule HF rotational angular momentum vectors j′ is revealed.
Quasi-classical trajectory (QCT) calculations are employed for the reaction F + HO (0,0) → HF + O based on the adiabatic potential energy surface (PES) of the ground 3A "triplet state. The average rotational alignment factor as a function of collision energy and the four polarization dependent generalized differential cross sections have been calculated in the center-of-mass (CM) frame, separately. The distribution P (θr) of the angle between k and j ’, the distribution P (θr) of dihedral angle denoting kk’-j’ correlation, and the angular distribution P (θr, Φr) of product rotational vectors in the form of polar plots are calculated as well. -Light-Heavy (HLH) mass combination and atom F’s relatively strong absorbability to charges on the alignment and the orientation of product molecule HF rotational angular momentum vectors j ’is revealed.