{"title":"Pure rotational spectroscopic measurements on a uranium-containing polyatomic compound: SUO2","authors":"Joshua E. Isert , G.S. Grubbs II , S.A. Cooke","doi":"10.1016/j.cplett.2024.141726","DOIUrl":null,"url":null,"abstract":"<div><div>Ground-state rotational constants were determined from the rotational spectra of two isotopologues (S-32 and S-34) of SUO<span><math><msub><mrow></mrow><mrow><mn>2</mn></mrow></msub></math></span>. For <sup>32</sup>SUO<span><math><msub><mrow></mrow><mrow><mn>2</mn></mrow></msub></math></span> it was determined that <span><math><mrow><msub><mrow><mi>A</mi></mrow><mrow><mn>0</mn></mrow></msub><mo>=</mo></mrow></math></span> 5150.34(17) MHz, <span><math><mrow><msub><mrow><mi>B</mi></mrow><mrow><mn>0</mn></mrow></msub><mo>=</mo></mrow></math></span> 2950.302(12) MHz, and <span><math><mrow><msub><mrow><mi>C</mi></mrow><mrow><mn>0</mn></mrow></msub><mo>=</mo></mrow></math></span> 1872.933(13) MHz. The SUO<span><math><msub><mrow></mrow><mrow><mn>2</mn></mrow></msub></math></span> molecules were produced using a laser ablation nozzle inside of a chirped pulse Fourier transform microwave spectrometer operating between 8 GHz and 18 GHz. The obtained rotational constants and Kraitchman substitution coordinates for sulfur are in very good agreement with those obtained from quantum chemical calculations.</div></div>","PeriodicalId":273,"journal":{"name":"Chemical Physics Letters","volume":"858 ","pages":"Article 141726"},"PeriodicalIF":2.8000,"publicationDate":"2024-11-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Chemical Physics Letters","FirstCategoryId":"92","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0009261424006687","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
引用次数: 0
Abstract
Ground-state rotational constants were determined from the rotational spectra of two isotopologues (S-32 and S-34) of SUO. For 32SUO it was determined that 5150.34(17) MHz, 2950.302(12) MHz, and 1872.933(13) MHz. The SUO molecules were produced using a laser ablation nozzle inside of a chirped pulse Fourier transform microwave spectrometer operating between 8 GHz and 18 GHz. The obtained rotational constants and Kraitchman substitution coordinates for sulfur are in very good agreement with those obtained from quantum chemical calculations.
期刊介绍:
Chemical Physics Letters has an open access mirror journal, Chemical Physics Letters: X, sharing the same aims and scope, editorial team, submission system and rigorous peer review.
Chemical Physics Letters publishes brief reports on molecules, interfaces, condensed phases, nanomaterials and nanostructures, polymers, biomolecular systems, and energy conversion and storage.
Criteria for publication are quality, urgency and impact. Further, experimental results reported in the journal have direct relevance for theory, and theoretical developments or non-routine computations relate directly to experiment. Manuscripts must satisfy these criteria and should not be minor extensions of previous work.