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  6. Collisional Excitation Of Hcn By Co To Refine The Modeling Of Cometary Comae

Collisional Excitation of HCN by CO to Refine the Modeling of Cometary Comae

Francesca Tonolo1, Ernesto Quintas-Sánchez2, Adrian Batista-Planas2

  • 1Univ. Rennes, CNRS, IPR (Institut de Physique de Rennes), UMR 6251, Rennes F-35000, France.

The Journal of Physical Chemistry. A
|September 9, 2025

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View abstract on PubMed

Summary
This summary is machine-generated.

We generated the first collisional rate coefficients for hydrogen cyanide (HCN) perturbed by carbon monoxide (CO) in comets. This data is crucial for modeling HCN's abundance and energy level distribution in cometary atmospheres.

Area of Science:

  • Astrophysics
  • Chemical Physics

Background:

  • Cometary atmospheres contain gases like hydrogen cyanide (HCN) and carbon monoxide (CO).
  • Understanding collisional processes is key to modeling molecular populations in these environments.

Purpose of the Study:

  • To compute the first dataset of collisional rate coefficients for HCN induced by CO.
  • To provide essential data for modeling HCN in cometary atmospheres.

Main Methods:

  • Utilized the statistical adiabatic channel model (SACM) with accurate interaction potentials.
  • Calculated state-to-state and thermalized rate coefficients for HCN-CO collisions.
  • Validated results with full quantum calculations.

Main Results:

  • Presented collisional (de)-excitation rate coefficients for HCN by CO from 5-50 K.

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  • Included state-to-state rates for lowest rotational levels of HCN and CO.
  • Provided thermalized rates considering CO rotational populations.
  • Conclusions:

    • The generated dataset is vital for accurate modeling of HCN in comets.
    • This data accounts for non-local thermodynamic equilibrium conditions in cometary atmospheres.