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利用傅里叶变换光谱法对二氧化氮的(15)N(16)O(2)同位素异构体的ν(3)带进行新的高分辨率分析。

New High-Resolution Analysis of the nu(3) Band of the (15)N(16)O(2) Isotopomer of Nitrogen Dioxide by Fourier Transform Spectroscopy.

作者信息

Orphal J, Perrin A, Flaud J, Smirnov M, Himmelmann S, Voigt S, Burrows JP

机构信息

Laboratoire de Photophysique Moléculaire, CNRS, Université Paris Sud, Bat. 350, Orsay, 91405, France

出版信息

J Mol Spectrosc. 2000 Nov;204(1):72-79. doi: 10.1006/jmsp.2000.8190.

Abstract

New high-resolution Fourier transform absorption spectra of an (15)N(16)O(2) isotopic sample of nitrogen dioxide were recorded at the University of Bremen in the 6.3-µm region. Starting from the results of a previous study [Y. Hamada, J. Mol. Struct. 242, 367-377 (1991)], a new and more extended analysis of the nu(3) band located at 1582.1039 cm(-1) has been performed. The spin-rotation energy levels were satisfactorily reproduced using a theoretical model which takes into account both the Coriolis interactions between the spin-rotation energy levels of the (001) vibrational state with those of the (020) and (100) states and the spin-rotation resonances within each of the NO(2) vibrational states. Precise vibrational energies and rotational, spin-rotation, and coupling constants were obtained in this way for the first triad of (15)N(16)O(2) interacting states {(020), (100), (001)}. Finally, a comprehensive list of line positions and line intensities of the {nu(1), 2nu(2), nu(3)} interacting bands of (15)N(16)O(2) was generated, using for the line intensities the transition moment operators which were obtained previously for the main isotopic species. Copyright 2000 Academic Press.

摘要

在不来梅大学记录了二氧化氮的(15)N(16)O(2)同位素样品在6.3-µm区域的新高分辨率傅里叶变换吸收光谱。从先前一项研究[Y. Hamada, J. Mol. Struct. 242, 367 - 377 (1991)]的结果出发,对位于1582.1039 cm(-1)处的ν(3)带进行了新的、更全面的分析。使用一个理论模型令人满意地再现了自旋-转动能级,该模型既考虑了(001)振动态与(020)和(100)态的自旋-转动能级之间的科里奥利相互作用,也考虑了每个NO(2)振动态内的自旋-转动共振。通过这种方式,首次获得了(15)N(16)O(2)相互作用态{(020), (100), (001)}三元组的精确振动能量以及转动、自旋-转动和耦合常数。最后,利用先前为主要同位素物种获得的跃迁矩算符,生成了(15)N(16)O(2)的{ν(1), 2ν(2), ν(3)}相互作用带的线位置和线强度的综合列表。版权所有2000年学术出版社。

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