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May 20, 20260 citations

Collisional rate coefficients for OH-H₂ at high temperatures

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ZHZ. van den HeuvelBTB. TaboneEDE. F. van Dishoeck

Key Points

  • This research aims to characterize the collisional rate coefficients for the OH molecule interacting with H_2 at high temperatures.
  • Calculations of state-to-state collision cross sections for OH with H_2 using close-coupling quantum scattering techniques.
  • Rate coefficients were determined for j levels up to 15/2 and temperatures up to 750 K.
  • Data includes comparative calculations with previous research and extrapolation methods based on energy gaps.
  • Rate coefficients for collisions with para-H2 showed lower de-excitation rates due to the absence of a quadrupole moment, decreasing at higher temperatures.
  • Scaling relations with energy gaps between upper and lower OH levels were established for higher j states.
  • Populations of low-j OH states are predominantly influenced by collisions under typical astrophysical warm gas conditions.

Abstract

OH is a cornerstone molecule in the chemistry of interstellar and circumstellar media and is ubiquitously detected in warm gas thanks to its infrared rotational lines. However, the excitation processes of OH remain poorly characterized. We provide a new set of collisional rate coefficients for OH with H₂, expanding the existing data to j levels up to j=15/2 and temperatures up to 750 K. These rate coefficients are obtained from state-to-state collision cross sections calculated by means of well-converged close-coupling quantum scattering calculations for collisions of OH with para- and ortho-H₂ with energies up to 1700 cm -1 (≃ 2450, K). We reproduce the rate coefficients computed by Kłos et al. (2017) and extend their results to higher temperatures and higher rotational levels of OH. The de-excitation rate coefficients are lower in collisions with para-H₂ (j_ H₂ = 0) due to the absence of a quadrupole moment, but this difference decreases at higher temperatures. We find that the rate coefficients follow scaling relations with the energy gap between the upper and lower levels of a given transition, which allows for extrapolation to higher OH rotational states j_ OH. As a first application, we show that under astrophysical conditions typical of warm and dense gas around nascent stars, the populations of low-j_ OH states are dominated by collisions, even when chemical pumping is included. The full set of rate coefficients is made available in the LAMDA database. OH infrared emission provides a unique probe of local conditions in astrophysical environments. These rate coefficients contribute to developing a complete excitation model of OH under warm conditions, with chemical pumping of OH through the O + H₂ reaction now being the main remaining uncertainty in such models.

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Cite This Study

Heuvel et al. (2026) studied this question.

synapsesocial.com/papers/6a0d4f19f03e14405aa9a47ehttps://doi.org/10.1051/0004-6361/202557561/pdf
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