Intrinsic product polarization and branch ratio in theS(1D, 3P)+HD reaction on three electronic states

doi:10.1088/1674-1056/25/9/093401

Abstract

The intrinsic product polarization and intramolecular isotope effect of the S(¹D, ³P)+HD reaction have been investigated on both the lowest singlet state (1A') and the triplet state (3A' and 3A'') potential energy surfaces by using quasi-classical trajectory and quantum mechanical methods. The calculations indicate that intramolecular isotope effects are different on the three electronic states. The stereodynamics study shows that the P(θ_r) distributions, P(φ_r) distributions, and polarization-dependent differential cross sections (PDDCSs) (00) are sensitive to mass factor and the product angular momentum vectors are not only aligned but also oriented.

Keywords: quasi-classical trajectory quantum mechanics product polarization branch ratio

Received: 03 December 2015
Revised: 10 May 2016
Accepted manuscript online:

PACS:	34.20.-b	(Interatomic and intermolecular potentials and forces, potential energy surfaces for collisions)
	03.65.-w	(Quantum mechanics)
	34.50.Pi
	82.20.Tr	(Kinetic isotope effects including muonium)

Corresponding Authors: Lin Li
E-mail: daris_li@163.com

Cite this article:

Lin Li(李琳), Shunle Dong(董顺乐) Intrinsic product polarization and branch ratio in theS(¹D, ³P)+HD reaction on three electronic states 2016 Chin. Phys. B 25 093401

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Intrinsic product polarization and branch ratio in theS(1D, 3P)+HD reaction on three electronic states

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Intrinsic product polarization and branch ratio in theS(¹D, ³P)+HD reaction on three electronic states