Resonances in inelastic collisions of Ne + D2 in the cold energy regime

S S. Pérez-Hernando (Departamento de Química Física, Universidad Complutense 1 , Madrid 28040,) M Manuel Lara (Departamento de Química Física Aplicada Módulo 14, Universidad Autonoma 2 , Madrid 28049,) B Bikramaditya Mandal (Department of Chemistry and Biochemistry, University of Nevada 1 , Las Vegas, Nevada 89154,) C Cristina Sanz-Sanz (Departamento de Química Física Aplicada Módulo 14, Universidad Autonoma 2 , Madrid 28049,) P Pablo G. Jambrina (Departamento de Química Física, University of Salamanca 3 , Salamanca 37008,) N Naduvalath Balakrishnan (Department of Chemistry and Biochemistry, University of Nevada 2 , Las Vegas, Nevada 89154,) F F. Javier Aoiz (Departamento de Química Física, Universidad Complutense 1 , Madrid 28040,)

Abstract

Scattering resonances are quantum phenomena arising from the decay of metastable collision complexes trapped by a centrifugal barrier or supported by a closed channel that is coupled to a scattering state. As such, resonances can provide significant insights into the scattering process and serve as a sensitive probe of the interaction potential. In this article, we present a detailed analysis of a cluster of shape resonances associated with the orbital angular momentum L = 5 in the j = 2 → j′ = 0 rotational transition in Ne + D2 collisions for vibrational levels v = 0, 1, and 4. The energies and lifetimes of the resonances arising from different values of the total angular momentum quantum number J were analyzed through numerical fitting of the scattering matrix and employing a one-dimensional model based on an effective potential. We further investigated the sensitivity of the resonances to changes in the alignment of the D2 internuclear axis with respect to the initial relative velocity. Our results show that resonances can be exquisitely controlled by carefully selecting the initial alignment of the D2 molecule. In particular, not only the intensity of the resonance can be modulated but also the shape of the overall resonance profile can be altered, depending on the stereodynamical preferences of the individual resonances that contribute to the cluster.

Article Details

Volume / Issue Vol. 163, Issue 22
Published December 14, 2025
ISSN 0021-9606
Publisher American Institute of Physics

Journal Info

The Journal of Chemical Physics

American Institute of Physics

ISSN: 0021-9606 Physical Sciences

Authors (7)

S

S. Pérez-Hernando

Departamento de Química Física, Universidad Complutense 1 , Madrid 28040,

M

Manuel Lara

Departamento de Química Física Aplicada Módulo 14, Universidad Autonoma 2 , Madrid 28049,

B

Bikramaditya Mandal

Department of Chemistry and Biochemistry, University of Nevada 1 , Las Vegas, Nevada 89154,

C

Cristina Sanz-Sanz

Departamento de Química Física Aplicada Módulo 14, Universidad Autonoma 2 , Madrid 28049,

P

Pablo G. Jambrina

Departamento de Química Física, University of Salamanca 3 , Salamanca 37008,

N

Naduvalath Balakrishnan

Department of Chemistry and Biochemistry, University of Nevada 2 , Las Vegas, Nevada 89154,

F

F. Javier Aoiz

Departamento de Química Física, Universidad Complutense 1 , Madrid 28040,