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首页> 外文期刊>Optics and Spectroscopy >On an inconsistency between experimental and non-empirical data on the lifetimes of electronic-vibrational-rotational states of the H-2, HD, and D-2 molecules
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On an inconsistency between experimental and non-empirical data on the lifetimes of electronic-vibrational-rotational states of the H-2, HD, and D-2 molecules

机译:关于H-2,HD和D-2分子的电子振动旋转状态寿命的实验数据和非经验数据之间的不一致

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摘要

A comparative analysis is carried out for all published to date experimental and non-empirical data on radiative lifetime of electronic-vibrational-rotational (EVR) levels for the three most common isotopologues of the hydrogen molecule. It is found that 792 available experimental values are extremely fragmentary. The majority of EVR levels have been studied only in one work. The available data give no clear notion about dependences of the radiative lifetime on the vibrational and rotational quantum numbers and complicates comparison of the results obtained by means of different methods and/or in different works. Comparison with non-empirical results is hampered by the absence of computational results for 24, 30, and 90% experimentally studied EVR levels of H-2, D-2, and HD, respectively. It is shown that, for a significant number EVR levels (46, 68, and 80%, respectively, for H-2, D-2, and HD), which have been studied both experimentally and theoretically, there is a direct contradiction between experimental and computational results on the radiative lifetime. More accurate and independent experimental measurements of the radiative lifetimes and more accurate non-empirical calculations with the use of nonadiabatic models are needed to resolve the revealed contradictions.
机译:对于氢分子的三种最常见的同位素异构体,对电子振动-旋转(EVR)水平的辐射寿命进行了迄今为止所有已发布的实验和非经验数据的比较分析。发现792个可用的实验值非常零碎。大多数EVR级别仅在一项工作中进行了研究。现有数据没有给出关于辐射寿命对振动和旋转量子数的依赖性的明确概念,并且使通过不同方法和/或在不同工作中获得的结果的比较复杂。由于缺乏分别针对H-2,D-2和HD进行实验研究的EVR水平的24%,30%和90%的计算结果,因此无法与非经验结果进行比较。结果表明,对于大量的EVR水平(H-2,D-2和HD分别为46%,68%和80%),这已经在实验和理论上进行了研究,两者之间存在直接矛盾。辐射寿命的实验和计算结果。需要更精确和独立的辐射寿命实验测量值,以及使用非绝热模型进行更精确的非经验计算,才能解决所揭示的矛盾。

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