Resonant states of H$_3^-$ molecule and its isotopologues D$_2$H$^-$ and H$_2$D$^-$.

Using the ground potential energy surface[M. Ayouz \textit{et\, al}. J. Chem Phys \textbf{132} 194309 (2010)] of the H$_3^-$ molecule, we have determined the energies and widths of the complex resonant levels of H$_3^-$ located up to 4000~cm$^{-1}$ above the dissociation limit H$^-$+H$_2(v_d=0,j_d=0)$. Bound and resonant levels of the H$_2$D$^-$ and D$_2$H$^-$ isotopologues have been also characterized within the same energy range. The method combines the hyperspherical adiabatic approach, slow variable discretization method, and complex absorbing potential. These results represent the first step for modeling the dynamics of the associated diatom-negative ion collision at low energy involving rotational quenching of the diatom and reactive nucleus exchange via weak tunneling effect through the potential barrier of the potential energy surface.

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Source https://hal.science/hal-00810648
Author Ayouz, M., Dulieu, Olivier, Robert, J.
Maintainer CCSD
Last Updated May 11, 2026, 14:46 (UTC)
Created May 11, 2026, 14:46 (UTC)
Identifier hal-00810648
Language en
Rights https://about.hal.science/hal-authorisation-v1/
contributor Laboratoire Aimé Cotton (LAC) ; École normale supérieure - Cachan (ENS Cachan)-Université Paris-Sud - Paris 11 (UP11)-Centre National de la Recherche Scientifique (CNRS)
creator Ayouz, M.
date 2013-04-10T00:00:00
harvest_object_id eef543bd-1f58-46b0-b733-acdc95742b60
harvest_source_id 3374d638-d20b-4672-ba96-a23232d55657
harvest_source_title test moissonnage SELUNE
metadata_modified 2023-03-24T00:00:00
relation info:eu-repo/semantics/altIdentifier/arxiv/1304.2886
set_spec type:UNDEFINED