{"title":"对 7.8 µm 波段附近的 β-位特异性 N2O 同素异形体的 (1200←0200) 振荡波段进行高分辨率滚振腔环向下光谱分析","authors":"Soumyadipta Chakraborty, Ardhendu Pal, Biswajit Panda, Indrayani Patra, Manik Pradhan","doi":"10.1007/s12039-023-02232-8","DOIUrl":null,"url":null,"abstract":"<div><p>An external-cavity quantum cascade laser (EC-QCL) coupled cavity ring-down spectroscopy was employed at 7.8 µm to investigate high-resolution rovibrational spectral features associated with the P- and R-branches of the 12<sup>0</sup>0←02<sup>0</sup>0 vibrational hot band transition of the β-site-specific isotopologue of nitrous oxide, <i>i.e.,</i> <sup>15</sup>N<sup>14</sup>N<sup>16</sup>O molecule. The air-broadening phenomena of several probed rotational transitions of β-N<sub>2</sub>O were examined by calculating the pressure-broadening coefficients. We calculated significant spectroscopic parameters such as the band centre, rotational constant, and centrifugal distortion constant for this selected vibrational band. Subsequently, we elucidated the dependence of rovibrational Einstein A coefficients on the rotational quantum number (<i>J</i>) and estimated the vibrational contribution of the Einstein A coefficients. We also determined the Herman Wallis coefficients corresponding to this 12<sup>0</sup>0←02<sup>0</sup>0 vibrational band. Finally, we investigated the line-oscillator strengths of the experimentally probed rovibrational transitions to gain deeper insights into the fundamental aspects of high-resolution spectroscopy of site-specific β-N<sub>2</sub>O molecules. These new high-resolution spectroscopic features of the β-N<sub>2</sub>O isotopologue will significantly enhance our understanding of the fundamental rovibrational spectroscopy of linear polyatomic molecules.</p><h3>Graphical Abstract</h3><p>This work shows the high-resolution fundamental rovibrational spectroscopy of the 12<sup>0</sup>0←02<sup>0</sup>0 vibrational hot band of site-specific <sup>15</sup>N<sup>14</sup>N<sup>16</sup>O isotopologue of nitrous oxide using quantum cascade laser (QCL) coupled cavity ring-down spectroscopy at 7.8 µm region.</p><div><figure><div><div><picture><source><img></source></picture></div></div></figure></div></div>","PeriodicalId":616,"journal":{"name":"Journal of Chemical Sciences","volume":null,"pages":null},"PeriodicalIF":1.7000,"publicationDate":"2023-12-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"High-resolution rovibrational cavity ring-down spectroscopy of (1200←0200) vibrational band of β-site-specific N2O isotopologue near 7.8 µm region\",\"authors\":\"Soumyadipta Chakraborty, Ardhendu Pal, Biswajit Panda, Indrayani Patra, Manik Pradhan\",\"doi\":\"10.1007/s12039-023-02232-8\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>An external-cavity quantum cascade laser (EC-QCL) coupled cavity ring-down spectroscopy was employed at 7.8 µm to investigate high-resolution rovibrational spectral features associated with the P- and R-branches of the 12<sup>0</sup>0←02<sup>0</sup>0 vibrational hot band transition of the β-site-specific isotopologue of nitrous oxide, <i>i.e.,</i> <sup>15</sup>N<sup>14</sup>N<sup>16</sup>O molecule. The air-broadening phenomena of several probed rotational transitions of β-N<sub>2</sub>O were examined by calculating the pressure-broadening coefficients. We calculated significant spectroscopic parameters such as the band centre, rotational constant, and centrifugal distortion constant for this selected vibrational band. Subsequently, we elucidated the dependence of rovibrational Einstein A coefficients on the rotational quantum number (<i>J</i>) and estimated the vibrational contribution of the Einstein A coefficients. We also determined the Herman Wallis coefficients corresponding to this 12<sup>0</sup>0←02<sup>0</sup>0 vibrational band. Finally, we investigated the line-oscillator strengths of the experimentally probed rovibrational transitions to gain deeper insights into the fundamental aspects of high-resolution spectroscopy of site-specific β-N<sub>2</sub>O molecules. These new high-resolution spectroscopic features of the β-N<sub>2</sub>O isotopologue will significantly enhance our understanding of the fundamental rovibrational spectroscopy of linear polyatomic molecules.</p><h3>Graphical Abstract</h3><p>This work shows the high-resolution fundamental rovibrational spectroscopy of the 12<sup>0</sup>0←02<sup>0</sup>0 vibrational hot band of site-specific <sup>15</sup>N<sup>14</sup>N<sup>16</sup>O isotopologue of nitrous oxide using quantum cascade laser (QCL) coupled cavity ring-down spectroscopy at 7.8 µm region.</p><div><figure><div><div><picture><source><img></source></picture></div></div></figure></div></div>\",\"PeriodicalId\":616,\"journal\":{\"name\":\"Journal of Chemical Sciences\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":1.7000,\"publicationDate\":\"2023-12-09\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Chemical Sciences\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://link.springer.com/article/10.1007/s12039-023-02232-8\",\"RegionNum\":4,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Chemical Sciences","FirstCategoryId":"92","ListUrlMain":"https://link.springer.com/article/10.1007/s12039-023-02232-8","RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 0
摘要
利用波长为 7.8 µm 的外腔量子级联激光器(EC-QCL)耦合腔环向下光谱技术,研究了与一氧化二氮的 β 位特异同素异形体(即 15N14N16O 分子)的 1200←0200 振动热带跃迁的 P 支和 R 支相关的高分辨率旋转振动光谱特征。通过计算压力展宽系数,研究了 β-N2O 的几个探究旋转转变的空气展宽现象。我们计算了这一选定振带的带中心、旋转常数和离心变形常数等重要光谱参数。随后,我们阐明了旋转振动爱因斯坦 A 系数与旋转量子数 (J) 的关系,并估算了爱因斯坦 A 系数的振动贡献。我们还确定了与这一 1200←0200 振带相对应的赫尔曼-沃利斯系数。最后,我们研究了实验探测到的摇振跃迁的线振子强度,从而更深入地了解了特定位点 β-N2O 分子高分辨率光谱学的基本方面。这些新的 β-N2O 同素异形体高分辨率光谱特征将极大地增强我们对线性多原子分子基本振动光谱的理解。 图文并茂的摘要 这项工作利用量子级联激光(QCL)耦合腔环向下光谱技术在 7.8 µm 波段显示了一氧化二氮的特定位点 15N14N16O 同素异形体的 1200←0200 振动热带的高分辨率基本振动光谱。
High-resolution rovibrational cavity ring-down spectroscopy of (1200←0200) vibrational band of β-site-specific N2O isotopologue near 7.8 µm region
An external-cavity quantum cascade laser (EC-QCL) coupled cavity ring-down spectroscopy was employed at 7.8 µm to investigate high-resolution rovibrational spectral features associated with the P- and R-branches of the 1200←0200 vibrational hot band transition of the β-site-specific isotopologue of nitrous oxide, i.e.,15N14N16O molecule. The air-broadening phenomena of several probed rotational transitions of β-N2O were examined by calculating the pressure-broadening coefficients. We calculated significant spectroscopic parameters such as the band centre, rotational constant, and centrifugal distortion constant for this selected vibrational band. Subsequently, we elucidated the dependence of rovibrational Einstein A coefficients on the rotational quantum number (J) and estimated the vibrational contribution of the Einstein A coefficients. We also determined the Herman Wallis coefficients corresponding to this 1200←0200 vibrational band. Finally, we investigated the line-oscillator strengths of the experimentally probed rovibrational transitions to gain deeper insights into the fundamental aspects of high-resolution spectroscopy of site-specific β-N2O molecules. These new high-resolution spectroscopic features of the β-N2O isotopologue will significantly enhance our understanding of the fundamental rovibrational spectroscopy of linear polyatomic molecules.
Graphical Abstract
This work shows the high-resolution fundamental rovibrational spectroscopy of the 1200←0200 vibrational hot band of site-specific 15N14N16O isotopologue of nitrous oxide using quantum cascade laser (QCL) coupled cavity ring-down spectroscopy at 7.8 µm region.
期刊介绍:
Journal of Chemical Sciences is a monthly journal published by the Indian Academy of Sciences. It formed part of the original Proceedings of the Indian Academy of Sciences – Part A, started by the Nobel Laureate Prof C V Raman in 1934, that was split in 1978 into three separate journals. It was renamed as Journal of Chemical Sciences in 2004. The journal publishes original research articles and rapid communications, covering all areas of chemical sciences. A significant feature of the journal is its special issues, brought out from time to time, devoted to conference symposia/proceedings in frontier areas of the subject, held not only in India but also in other countries.