Experimental and theoretical investigation on N2 pressure-induced coefficients of the lowest rotational transitions of HCN
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arXiv
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| Auteurs principaux: | , , , , , , |
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| Format: | Preprint |
| Publié: |
2025
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| _version_ | 1866916749067157504 |
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| author | Tonolo, Francesca Jóźwiak, Hubert Bizzocchi, Luca Melosso, Mattia Wcisło, Piotr Lique, François Puzzarini, Cristina |
| author_facet | Tonolo, Francesca Jóźwiak, Hubert Bizzocchi, Luca Melosso, Mattia Wcisło, Piotr Lique, François Puzzarini, Cristina |
| contents | We present the first experimental determination of room-temperature N2 pressure broadening, speed dependent broadening, and pressure shift coefficients of the three lowest rotational lines of HCN. The experimental results served to assess the accuracy of a low-cost yet accurate computational strategy, which relies on a simplified characterization of the HCN-N2 interaction potential, and employs a novel approximate method of solving the quantum scattering problem. Building on the validation of this computational approach, the dataset was extended to higher rotational transitions, up to J(HCN)=5-4. For these transitions, we provide the temperature dependence of the pressure broadening coefficient, its speed dependence parameter, and the Dicke narrowing parameter. This new dataset can support and refine the modeling of HCN in both the terrestrial and Titan's atmospheres. This work constitutes an important step towards populating spectroscopic databases with accurate HCN line-shape parameters. |
| format | Preprint |
| id |
arxiv_https___arxiv_org_abs_2505_13560 |
| institution | arXiv |
| publishDate | 2025 |
| record_format | arxiv |
| spellingShingle | Experimental and theoretical investigation on N2 pressure-induced coefficients of the lowest rotational transitions of HCN Tonolo, Francesca Jóźwiak, Hubert Bizzocchi, Luca Melosso, Mattia Wcisło, Piotr Lique, François Puzzarini, Cristina Chemical Physics Earth and Planetary Astrophysics We present the first experimental determination of room-temperature N2 pressure broadening, speed dependent broadening, and pressure shift coefficients of the three lowest rotational lines of HCN. The experimental results served to assess the accuracy of a low-cost yet accurate computational strategy, which relies on a simplified characterization of the HCN-N2 interaction potential, and employs a novel approximate method of solving the quantum scattering problem. Building on the validation of this computational approach, the dataset was extended to higher rotational transitions, up to J(HCN)=5-4. For these transitions, we provide the temperature dependence of the pressure broadening coefficient, its speed dependence parameter, and the Dicke narrowing parameter. This new dataset can support and refine the modeling of HCN in both the terrestrial and Titan's atmospheres. This work constitutes an important step towards populating spectroscopic databases with accurate HCN line-shape parameters. |
| title | Experimental and theoretical investigation on N2 pressure-induced coefficients of the lowest rotational transitions of HCN |
| topic | Chemical Physics Earth and Planetary Astrophysics |
| url | https://arxiv.org/abs/2505.13560 |