{"title":"铷- 129xe自旋交换光泵浦的有限元建模及优化铷源分布","authors":"Jimmy E. Ball, Jim M. Wild, Graham Norquay","doi":"10.1016/j.jmr.2025.107889","DOIUrl":null,"url":null,"abstract":"<div><div>Rubidium (Rb) vapor density (<span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span>) is a key parameter in xenon-129 polarization (<span><math><msub><mrow><mi>P</mi></mrow><mrow><mtext>Xe</mtext></mrow></msub></math></span>) build up in spin-exchange optical pumping. In practice, <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> within the cell often falls below saturation levels and is spatially heterogeneous leading to system underperformance. In this study, finite element modeling was performed to investigate the role of Rb source distribution in heterogeneous in-cell <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span>, and to optimize a Rb presaturator to achieve homogeneous <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> and reduce the flow rate dependence of <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span>. Lower than expected <span><math><msub><mrow><mi>P</mi></mrow><mrow><mtext>Xe</mtext></mrow></msub></math></span> in previous iterations of our polarizer can be attributed to sub-saturation <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> due to the small surface area of the Rb source in the main cell body and the absence of upstream Rb vapor presaturation, leading to lower than desired <span><math><msub><mrow><mi>P</mi></mrow><mrow><mtext>Xe</mtext></mrow></msub></math></span>. We found that increasing the surface area of the Rb source in the main cell body does not effectively reduce <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> heterogeneity. Instead, achieving a more uniform distribution of <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> necessitates the use of a sufficiently long presaturator at a given gas flow rate, increasing <span><math><msub><mrow><mi>P</mi></mrow><mrow><mtext>Xe</mtext></mrow></msub></math></span>. We also report discrepancy between modeled and experimentally measured laser absorption, highlighting limitations of the existing optical pumping model and suggesting directions for future model revisions and the investigation of currently unexplored areas.</div></div>","PeriodicalId":16267,"journal":{"name":"Journal of magnetic resonance","volume":"377 ","pages":"Article 107889"},"PeriodicalIF":1.9000,"publicationDate":"2025-05-30","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Finite element modeling of Rb-129Xe spin-exchange optical pumping and optimized Rb source distribution\",\"authors\":\"Jimmy E. Ball, Jim M. Wild, Graham Norquay\",\"doi\":\"10.1016/j.jmr.2025.107889\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>Rubidium (Rb) vapor density (<span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span>) is a key parameter in xenon-129 polarization (<span><math><msub><mrow><mi>P</mi></mrow><mrow><mtext>Xe</mtext></mrow></msub></math></span>) build up in spin-exchange optical pumping. In practice, <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> within the cell often falls below saturation levels and is spatially heterogeneous leading to system underperformance. In this study, finite element modeling was performed to investigate the role of Rb source distribution in heterogeneous in-cell <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span>, and to optimize a Rb presaturator to achieve homogeneous <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> and reduce the flow rate dependence of <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span>. Lower than expected <span><math><msub><mrow><mi>P</mi></mrow><mrow><mtext>Xe</mtext></mrow></msub></math></span> in previous iterations of our polarizer can be attributed to sub-saturation <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> due to the small surface area of the Rb source in the main cell body and the absence of upstream Rb vapor presaturation, leading to lower than desired <span><math><msub><mrow><mi>P</mi></mrow><mrow><mtext>Xe</mtext></mrow></msub></math></span>. We found that increasing the surface area of the Rb source in the main cell body does not effectively reduce <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> heterogeneity. Instead, achieving a more uniform distribution of <span><math><mrow><mo>[</mo><mtext>Rb</mtext><mo>]</mo></mrow></math></span> necessitates the use of a sufficiently long presaturator at a given gas flow rate, increasing <span><math><msub><mrow><mi>P</mi></mrow><mrow><mtext>Xe</mtext></mrow></msub></math></span>. We also report discrepancy between modeled and experimentally measured laser absorption, highlighting limitations of the existing optical pumping model and suggesting directions for future model revisions and the investigation of currently unexplored areas.</div></div>\",\"PeriodicalId\":16267,\"journal\":{\"name\":\"Journal of magnetic resonance\",\"volume\":\"377 \",\"pages\":\"Article 107889\"},\"PeriodicalIF\":1.9000,\"publicationDate\":\"2025-05-30\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of magnetic resonance\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S1090780725000618\",\"RegionNum\":3,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"BIOCHEMICAL RESEARCH METHODS\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of magnetic resonance","FirstCategoryId":"92","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S1090780725000618","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"BIOCHEMICAL RESEARCH METHODS","Score":null,"Total":0}
Finite element modeling of Rb-129Xe spin-exchange optical pumping and optimized Rb source distribution
Rubidium (Rb) vapor density () is a key parameter in xenon-129 polarization () build up in spin-exchange optical pumping. In practice, within the cell often falls below saturation levels and is spatially heterogeneous leading to system underperformance. In this study, finite element modeling was performed to investigate the role of Rb source distribution in heterogeneous in-cell , and to optimize a Rb presaturator to achieve homogeneous and reduce the flow rate dependence of . Lower than expected in previous iterations of our polarizer can be attributed to sub-saturation due to the small surface area of the Rb source in the main cell body and the absence of upstream Rb vapor presaturation, leading to lower than desired . We found that increasing the surface area of the Rb source in the main cell body does not effectively reduce heterogeneity. Instead, achieving a more uniform distribution of necessitates the use of a sufficiently long presaturator at a given gas flow rate, increasing . We also report discrepancy between modeled and experimentally measured laser absorption, highlighting limitations of the existing optical pumping model and suggesting directions for future model revisions and the investigation of currently unexplored areas.
期刊介绍:
The Journal of Magnetic Resonance presents original technical and scientific papers in all aspects of magnetic resonance, including nuclear magnetic resonance spectroscopy (NMR) of solids and liquids, electron spin/paramagnetic resonance (EPR), in vivo magnetic resonance imaging (MRI) and spectroscopy (MRS), nuclear quadrupole resonance (NQR) and magnetic resonance phenomena at nearly zero fields or in combination with optics. The Journal''s main aims include deepening the physical principles underlying all these spectroscopies, publishing significant theoretical and experimental results leading to spectral and spatial progress in these areas, and opening new MR-based applications in chemistry, biology and medicine. The Journal also seeks descriptions of novel apparatuses, new experimental protocols, and new procedures of data analysis and interpretation - including computational and quantum-mechanical methods - capable of advancing MR spectroscopy and imaging.