Dissociative Recombination of NeH+ with Low-Energy Electrons: A Multichannel Quantum Defect Theory Approach Including Non-Adiabatic Couplings

ORAL

Abstract

We present a theoretical study of the dissociative recombination (DR) of NeH+ with low-energy electrons, using Multichannel Quantum Defect Theory (MQDT). In contrast to typical DR processes driven by Rydberg-valence interactions, our approach focuses on the non-adiabatic couplings between molecular states. This study addresses a significant gap in the available theoretical data at low energies (<2 eV), where no detailed quantum calculations have been performed. The resulting cross-sections exhibit good agreement with experimental results, providing new insights into the DR process. Our findings have some implications for fusion edge plasmas and may also be relevant for astrochemistry.

*This work was supported by the Fédération de Recherche Fusion par Confinement Magnétique, the PEPR project "Plasma-N-Act" (ANR), the Région Normandie, LabEx EMC3, and the Institute for Energy, Propulsion, and Environment (FR-IEPE). We acknowledge financial support from the National Research, Development and Innovation Fund of Hungary (FK 132989) and HPC/AI resources from [CINES/IDRIS/TGCC].

Publication: R. Hassaine, J. Z. Mezei, D. Talbi, J. Tennyson, and I. F. Schneider, "Dissociative recombination of NeH+ with low-energy electrons: Multichannel quantum defect theory including non-adiabatic couplings,"
https://doi.org/10.48550/arXiv.2509.05859

Presenters

  • Riyad Hassaine

    • Purdue University

Authors

  • Riyad Hassaine

    • Purdue University
  • Janos Zsolt Mezei

    • Institute for Nuclear Research, Debrecen, Hungary
  • D. Talbi

    • LUPM
  • Jonathan Tennyson

    • University College London
  • Ioan F Schneider

    • LOMC-UMR6294, Université Le Havre Normandie