Nearside-farside, local angular momentum and resummation theories: Useful tools for understanding the dynamics of complex-mode reactions
Source abstract
Abstract
A valuable tool for understanding the dynamics of direct reactions is Nearside-Farside (NF) scattering theory. It makes a decomposition of the (resummed) partial wave series for the scattering amplitude, both for the differential cross section (DCS) and the Local Angular Momentum (LAM). This paper makes the first combined application of these techniques to complex-mode reactions. We ask if NF theory is a useful tool for their identification, in particular, can it distinguish complex-mode from direct-mode reactions? We also ask whether NF theory can identify NF interference oscillations in the full DCSs of complex-mode reactions. Our investigation exploits the fact that accurate quantum scattering matrix elements have recently become available for complex-mode reactions. We first apply NF theory to two simple models for the scattering amplitude of a complex-mode reaction: One involves a single Legendre polynomial; the other involves a single Legendre function of the first kind, whose form is suggested by complex angular momentum theory. We then study, at fixed translational energies, four state-to-state complex-mode reactions. They are: S(1D) + HD → SH + D, S(1D) + DH → SD + H, N(2D) +H2 → NH + H, and H+ + D2 → HD + D+. We compare the NF results for the DCSs and LAMs with those for a state-to-state direct reaction, namely, F + H2 → FH + H. We demonstrate that NF theory is a valuable tool for identifying and analyzing the dynamics of complex-mode reactions.
Source: crossref · Quality: baseline
Research context
OpenAlex topics: Advanced Chemical Physics Studies · Spectroscopy and Quantum Chemical Studies · Quantum, superfluid, helium dynamics
SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.
Affiliations
The University of Queensland 1 Centre for Computational Molecular Science, Australian Institute for Bioengineering and Nanotechnology, , Brisbane, QLD 4072, Australia
The University of Manchester 2 School of Chemistry, , Manchester M13 9PL, England
Funding
Engineering and Physical Sciences Research Council · Leverhulme Trust · University of Queensland · Australian Research Council
References (65)
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