eactive angular distributions of the benchmark F + H2(vi = 0) -> F H(vf = 3) + H reaction show unusual propensity towards small scattering angles, a subject of a long debate in the literature. We use Regge trajectories to quantify the resonance contributions to state-to-state differential cross sections. Conversion to complex energy poles allows us to attribute the effect almost exclusively to a transition state resonance, long known to exist in the F +H2 system and its isotopic variant F +HD. For our detailed analysis of angular scattering we employ the package DCS Regge, recently developed for the purpose [Comp. Phys. Comm., 2022, 277, 108370.]

A transition state resonance radically reshapes angular distributions of the F + H2 -> F H(vf = 3) + H reaction in the 62-101 meV energy range

Dario De Fazio;
2025

Abstract

eactive angular distributions of the benchmark F + H2(vi = 0) -> F H(vf = 3) + H reaction show unusual propensity towards small scattering angles, a subject of a long debate in the literature. We use Regge trajectories to quantify the resonance contributions to state-to-state differential cross sections. Conversion to complex energy poles allows us to attribute the effect almost exclusively to a transition state resonance, long known to exist in the F +H2 system and its isotopic variant F +HD. For our detailed analysis of angular scattering we employ the package DCS Regge, recently developed for the purpose [Comp. Phys. Comm., 2022, 277, 108370.]
2025
Istituto di Struttura della Materia - ISM - Sede Secondaria Montelibretti
Regge poles
resonances
F+H2
reaction mechanism
File in questo prodotto:
File Dimensione Formato  
sokolovski-et-al-2025-a-transition-state-resonance-radically-reshapes-angular-distributions-of-the-f-h2-fh(vf-3)-h.pdf

accesso aperto

Descrizione: Articolo pubblicato
Tipologia: Versione Editoriale (PDF)
Licenza: Creative commons
Dimensione 5.3 MB
Formato Adobe PDF
5.3 MB Adobe PDF Visualizza/Apri

I documenti in IRIS sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione.

Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/20.500.14243/520799
Citazioni
  • ???jsp.display-item.citation.pmc??? ND
  • Scopus 0
  • ???jsp.display-item.citation.isi??? 0
social impact