1915 cm−1附近NO跃迁的光谱研究:高温线参数和不确定度量化

IF 4.6 2区 化学 Q1 SPECTROSCOPY
Denghao Zhu , Sumit Agarwal , Bo Shu , Ravi Fernandes , Zhechao Qu
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引用次数: 0

摘要

本研究利用激光吸收光谱对两个一氧化氮(NO)吸收跃迁(R11.5 Ω1/2在1914.99 cm−1和R11.5 Ω3/2在1915.76 cm−1)进行了全面的光谱研究。通过采用两个互补的实验系统,即用于线强度测量的连续流动气体池和用于温度依赖系数表征的激波管设备,我们获得了出色的测量精度,线强度不确定度低至0.95%,同时将可访问的温度范围扩展到1742 K。该研究系统地表征了四种缓冲气体(Ar, N2, He, CO2)中压力展宽系数的温度依赖性,揭示了不同的气体特异性行为,特别是NO与氦气之间的弱相互作用。一项严格的计量分析表明,NO定量精度有了实质性的提高,扫描波长和固定波长LAS的不确定度分别降低了12.4倍和3.5倍。不确定度映射和动态不确定度评价方法的发展进一步提高了瞬态条件下测量的可靠性。在这项工作中提出的综合数据集和方法创新解决了高温NO光谱的关键空白,并在能源,环境和工业应用中实现更准确的分子诊断。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Spectroscopic investigation of NO transitions near 1915 cm−1: high-temperature line parameters and uncertainty quantification

Spectroscopic investigation of NO transitions near 1915 cm−1: high-temperature line parameters and uncertainty quantification
This study presents a comprehensive spectroscopic investigation of two nitric oxide (NO) absorption transitions (R11.5 Ω1/2 at 1914.99 cm−1 and R11.5 Ω3/2 at 1915.76 cm−1) using laser absorption spectroscopy. By employing two complementary experimental systems, namely a continuous flow gas cell for line intensity measurements and a shock tube facility for temperature dependence coefficient characterization, we attained exceptional measurement accuracy with line intensity uncertainties as low as 0.95 % while extending the accessible temperature range to 1742 K. The study systematically characterizes temperature dependence of pressure broadening coefficients in four buffer gases (Ar, N2, He, CO2), revealing distinct gas-specific behaviors, particularly the weak interaction between NO and helium. A rigorous metrological analysis demonstrated substantial improvements in NO quantification accuracy, achieving 12.4-fold and 3.5-fold uncertainty reductions for scanned-wavelength and fixed-wavelength LAS, respectively. The development of uncertainty mapping and dynamic uncertainty evaluation methodologies further enhanced measurement reliability under transient conditions. The comprehensive dataset and methodological innovations presented in this work address critical gaps in high temperature NO spectroscopy and enable more accurate molecular diagnostics in energy, environmental, and industrial applications.
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来源期刊
CiteScore
8.40
自引率
11.40%
发文量
1364
审稿时长
40 days
期刊介绍: Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy (SAA) is an interdisciplinary journal which spans from basic to applied aspects of optical spectroscopy in chemistry, medicine, biology, and materials science. The journal publishes original scientific papers that feature high-quality spectroscopic data and analysis. From the broad range of optical spectroscopies, the emphasis is on electronic, vibrational or rotational spectra of molecules, rather than on spectroscopy based on magnetic moments. Criteria for publication in SAA are novelty, uniqueness, and outstanding quality. Routine applications of spectroscopic techniques and computational methods are not appropriate. Topics of particular interest of Spectrochimica Acta Part A include, but are not limited to: Spectroscopy and dynamics of bioanalytical, biomedical, environmental, and atmospheric sciences, Novel experimental techniques or instrumentation for molecular spectroscopy, Novel theoretical and computational methods, Novel applications in photochemistry and photobiology, Novel interpretational approaches as well as advances in data analysis based on electronic or vibrational spectroscopy.
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