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May 17, 2026Russian Journal of Physical Chemistry A0 citations

Energy Levels of Water Isotopologs H2xO, x = 14–19

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BVB. A. Voronin

Key Points

  • This research aims to analyze the vibrational-rotational energy levels of different oxygen isotopologs of water vapor.
  • Calculated energy levels for six oxygen isotopologs of water vapor up to 25,000 cm–1
  • Performed calculations using the high-precision potential energy surface
  • Applied the DVR3D computational package.
  • Presented energy levels for H217O and H218O for the first time
  • Analyzed angular momentum J values ranging from 0 to 20

Abstract

In this study, the analysis of vibrational-rotational energy levels of six oxygen isotopologs of water vapor H214O, H215O, H216O, H217O, H218O, and H219O is presented. The energy levels are calculated for the angular momentum J values from 0 to 20 and energies up to 25 000 cm–1. The calculated energy levels of H217O and H218O for such a data configuration are presented for the first time. All calculations were performed on the basis of the high-precision potential energy surface of the molecule by Bubukina et al. (I. I. Bubukina, N. F. Zobov, O. L. Polyansky, et al., Opt. Spectrosc. 110, 160 (2011)) using the DVR3D package.

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Cite This Study

B. A. Voronin (2026) studied this question.

synapsesocial.com/papers/6a095ac47880e6d24efe0a5ahttps://doi.org/10.1134/s0036024425703674
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