The modified quasi-quantum treatment of rotationally inelastic NO(X)-He scattering

X. Zhang; C.J. Eyles; D.J. Ding; S. Stolte

doi:10.1039/c4cp01733a

The modified quasi-quantum treatment of rotationally inelastic NO(X)-He scattering

X. Zhang
, C.J. Eyles
, D.J. Ding
, S. Stolte

Research output: Contribution to Journal › Article › Academic › peer-review

Abstract

A modified quasi-quantum treatment (MQQT) of molecular scattering has been developed to account for the softness of the repulsive part of the anisotropic atom-molecule PES. A contour of the PES is chosen such that the barrier height is just large enough to reflect the incoming kinetic energy, directed anti-parallel to the hard shell normal at the site of impact. The resulting rotationally inelastic quantum state resolved DCSs and ICSs of He + NO(X) at E

Original language	English
Pages (from-to)	4067-4075
Journal	Physical Chemistry Chemical Physics - PCCP
Volume	17
Issue number	6
DOIs	https://doi.org/10.1039/c4cp01733a
Publication status	Published - 2015

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10.1039/c4cp01733a

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title = "The modified quasi-quantum treatment of rotationally inelastic NO(X)-He scattering",

abstract = "A modified quasi-quantum treatment (MQQT) of molecular scattering has been developed to account for the softness of the repulsive part of the anisotropic atom-molecule PES. A contour of the PES is chosen such that the barrier height is just large enough to reflect the incoming kinetic energy, directed anti-parallel to the hard shell normal at the site of impact. The resulting rotationally inelastic quantum state resolved DCSs and ICSs of He + NO(X) at E",

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AU - Zhang, X.

AU - Eyles, C.J.

AU - Ding, D.J.

AU - Stolte, S.

PY - 2015

Y1 - 2015

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AB - A modified quasi-quantum treatment (MQQT) of molecular scattering has been developed to account for the softness of the repulsive part of the anisotropic atom-molecule PES. A contour of the PES is chosen such that the barrier height is just large enough to reflect the incoming kinetic energy, directed anti-parallel to the hard shell normal at the site of impact. The resulting rotationally inelastic quantum state resolved DCSs and ICSs of He + NO(X) at E

U2 - 10.1039/c4cp01733a

DO - 10.1039/c4cp01733a

M3 - Article

SN - 1463-9076

VL - 17

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JO - Physical Chemistry Chemical Physics - PCCP

JF - Physical Chemistry Chemical Physics - PCCP

IS - 6

ER -

The modified quasi-quantum treatment of rotationally inelastic NO(X)-He scattering

Abstract

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