Inelastic collision dynamics of oriented NO molecules with Kr atoms

Building on our previous work on NO + Ar, this paper presents a complete set of orientation measurements and quantum mechanical calculations for the NO + Kr collision system, including both spin-orbit conserving and changing collisions, and both side-on (x-axis) and end-on (z-axis) orientations. Whi...

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Main Authors: Heid, CG, Bentham, IP, Gheorghe, R, Jambrina, PG, Aoiz, FJ, Brouard, M
Format: Journal article
Language:English
Published: Taylor and Francis 2021
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author Heid, CG
Bentham, IP
Gheorghe, R
Jambrina, PG
Aoiz, FJ
Brouard, M
author_facet Heid, CG
Bentham, IP
Gheorghe, R
Jambrina, PG
Aoiz, FJ
Brouard, M
author_sort Heid, CG
collection OXFORD
description Building on our previous work on NO + Ar, this paper presents a complete set of orientation measurements and quantum mechanical calculations for the NO + Kr collision system, including both spin-orbit conserving and changing collisions, and both side-on (x-axis) and end-on (z-axis) orientations. While many of the trends observed in the oriented differential and integral scattering distributions, as well as in the spin-orbit branching fractions, are similar to the ones seen previously for NO + Ar, a direct comparison with the Ar data reveals subtle differences in the scattering dynamics, which we rationalise with the more extended attractive regions on the NO + Kr potential energy surfaces. High-impact parameter collisions that lead to low scattering angles in the spin-orbit conserving manifold are particularly sensitive to the topology in the attractive parts of the potential, whereas more impulsive, low-impact parameter trajectories, which sample the repulsive parts of the potential, produce very similar features in the oriented differential cross sections for the Ar and Kr systems, especially for spin-orbit changing collisions.
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spelling oxford-uuid:66df57da-3f7e-4309-9e3b-2f05531dcc572022-04-12T06:44:39ZInelastic collision dynamics of oriented NO molecules with Kr atomsJournal articlehttp://purl.org/coar/resource_type/c_dcae04bcuuid:66df57da-3f7e-4309-9e3b-2f05531dcc57EnglishSymplectic ElementsTaylor and Francis2021Heid, CGBentham, IPGheorghe, RJambrina, PGAoiz, FJBrouard, MBuilding on our previous work on NO + Ar, this paper presents a complete set of orientation measurements and quantum mechanical calculations for the NO + Kr collision system, including both spin-orbit conserving and changing collisions, and both side-on (x-axis) and end-on (z-axis) orientations. While many of the trends observed in the oriented differential and integral scattering distributions, as well as in the spin-orbit branching fractions, are similar to the ones seen previously for NO + Ar, a direct comparison with the Ar data reveals subtle differences in the scattering dynamics, which we rationalise with the more extended attractive regions on the NO + Kr potential energy surfaces. High-impact parameter collisions that lead to low scattering angles in the spin-orbit conserving manifold are particularly sensitive to the topology in the attractive parts of the potential, whereas more impulsive, low-impact parameter trajectories, which sample the repulsive parts of the potential, produce very similar features in the oriented differential cross sections for the Ar and Kr systems, especially for spin-orbit changing collisions.
spellingShingle Heid, CG
Bentham, IP
Gheorghe, R
Jambrina, PG
Aoiz, FJ
Brouard, M
Inelastic collision dynamics of oriented NO molecules with Kr atoms
title Inelastic collision dynamics of oriented NO molecules with Kr atoms
title_full Inelastic collision dynamics of oriented NO molecules with Kr atoms
title_fullStr Inelastic collision dynamics of oriented NO molecules with Kr atoms
title_full_unstemmed Inelastic collision dynamics of oriented NO molecules with Kr atoms
title_short Inelastic collision dynamics of oriented NO molecules with Kr atoms
title_sort inelastic collision dynamics of oriented no molecules with kr atoms
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