更新HITEMP中的二氧化碳行列表

IF 2.3 3区 物理与天体物理 Q2 OPTICS Journal of Quantitative Spectroscopy & Radiative Transfer Pub Date : 2024-12-24 DOI:10.1016/j.jqsrt.2024.109324
Robert J. Hargreaves, Iouli E. Gordon, Xinchuan Huang, Geoffrey C. Toon, Laurence S. Rothman
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引用次数: 0

摘要

提出了HITEMP光谱数据库中最新的二氧化碳谱线表。该谱线列表涵盖0-17697 cm−1 (>565 nm)光谱范围,基于AI-3000K 12C16O2、13C16O2、16O12C18O和16O12C17O的半经验谱线列表(Huang et al., 2023),结合HITRAN2020数据、额外的同位素以及本工作中描述的进一步改进。为了使线路列表在实际应用中更加实用,原始AI-3000K线路列表中超过360亿个单独的过渡被分为“强”和“弱”。“强”的过渡被直接改编,而弱的过渡则被组合成所谓的“有效”的线条。后者可以准确地解释潜在的弱AI-3000K转换的强度贡献,同时将数据库减少两个数量级以上(至~ 3.26亿)。此外,还对压力展宽参数进行了修订,以提高在高温下的适用性。该线列表已添加到HITEMP,适用于模拟温度高达3000k的二氧化碳光谱。
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Updating the carbon dioxide line list in HITEMP
An updated carbon dioxide line list for the HITEMP spectroscopic database is presented. This line list covers the 0–17697 cm−1 (>565 nm) spectral range and is built upon the AI-3000K semi-empirical line list for 12C16O2, 13C16O2, 16O12C18O, and 16O12C17O (Huang et al., 2023), combined with HITRAN2020 data, additional isotopologues, and further improvements described in this work. In order to make the line list practical for applications, over 36 billion individual transitions of the original AI-3000K line list have been separated into “strong” and “weak”. “Strong” transitions were adapted directly, while the weak transitions were then combined into so-called “effective” lines. The latter can accurately account for the intensity contribution of underlying weak AI-3000K transitions while reducing the database by over two orders of magnitude (to 326 million). In addition, pressure broadening parameters have been revised for this work to improve applicability at high temperatures. The line list has been added to HITEMP and is suitable for modeling the spectrum of carbon dioxide at temperatures up to 3000 K.
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来源期刊
CiteScore
5.30
自引率
21.70%
发文量
273
审稿时长
58 days
期刊介绍: Papers with the following subject areas are suitable for publication in the Journal of Quantitative Spectroscopy and Radiative Transfer: - Theoretical and experimental aspects of the spectra of atoms, molecules, ions, and plasmas. - Spectral lineshape studies including models and computational algorithms. - Atmospheric spectroscopy. - Theoretical and experimental aspects of light scattering. - Application of light scattering in particle characterization and remote sensing. - Application of light scattering in biological sciences and medicine. - Radiative transfer in absorbing, emitting, and scattering media. - Radiative transfer in stochastic media.
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