实现稳定同位素数据的兼容性:回顾相关概念、参考材料的最新进展和当前挑战。

IF 16.4 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Accounts of Chemical Research Pub Date : 2024-06-01 Epub Date: 2024-06-12 DOI:10.1080/10256016.2024.2355194
Sergey Assonov
{"title":"实现稳定同位素数据的兼容性:回顾相关概念、参考材料的最新进展和当前挑战。","authors":"Sergey Assonov","doi":"10.1080/10256016.2024.2355194","DOIUrl":null,"url":null,"abstract":"<p><p>Comparing and combining stable isotope datasets from different laboratories and different years is essential for many research areas, such as isotope hydrology, greenhouse gas observations, food studies, isotope forensics, palaeo-reconstructions, etc. Data compatibility (i.e. the ability to combine data) is related to the data quality. The prerequisite for data comparability is data normalization to a common stable isotope scale (often referred to as calibration) based on reliable reference materials (RMs) with accurately assigned values and uncertainties. Still, that does not guarantee the data compatibility (mutual agreement). Albeit metrological concepts related to data compatibility and measurement uncertainty have been developed and applied to analytical chemistry in general, these concepts have not yet been fully applied to stable isotope research. This can affect daily calibrations, analytical data and, therefore, data compatibility. In addition, IRMS users often prepare different laboratory standards themselves. Thereafter, users should then understand the contemporary concepts used for assigning RM value and uncertainty, as well as the limitations and potential problems associated with RMs. The history of RMs, preparation reports and also some problems in the past provide lessons to be learned. These include the <i>δ</i><sup>13</sup>C drift of LSVEC (the second anchor on the <i>δ</i><sup>13</sup>C scale before 2017), revisions to the value assignment principles, the introduction of replacements for LSVEC, related disputes and the potential underestimation of uncertainties for secondary RMs. The review describes metrological concepts related to isotopic scales, RMs and calibration hierarchies and data compatibility. The main RMs and their uncertainties are reviewed through the lens of metrology concepts. Additional focus is given to the VPDB scale for <i>δ</i><sup>13</sup>C and issues of scale discontinuity, which can significantly reduce data compatibility in <i>δ</i><sup>13</sup>C. The given examples of value and uncertainty assignment for RMs should be viewed as an example of value and uncertainty calculation in daily practice.</p>","PeriodicalId":1,"journal":{"name":"Accounts of Chemical Research","volume":null,"pages":null},"PeriodicalIF":16.4000,"publicationDate":"2024-06-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Towards the compatibility of stable isotope data: review of related concepts, recent progress with reference materials and current challenges.\",\"authors\":\"Sergey Assonov\",\"doi\":\"10.1080/10256016.2024.2355194\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p><p>Comparing and combining stable isotope datasets from different laboratories and different years is essential for many research areas, such as isotope hydrology, greenhouse gas observations, food studies, isotope forensics, palaeo-reconstructions, etc. Data compatibility (i.e. the ability to combine data) is related to the data quality. The prerequisite for data comparability is data normalization to a common stable isotope scale (often referred to as calibration) based on reliable reference materials (RMs) with accurately assigned values and uncertainties. Still, that does not guarantee the data compatibility (mutual agreement). Albeit metrological concepts related to data compatibility and measurement uncertainty have been developed and applied to analytical chemistry in general, these concepts have not yet been fully applied to stable isotope research. This can affect daily calibrations, analytical data and, therefore, data compatibility. In addition, IRMS users often prepare different laboratory standards themselves. Thereafter, users should then understand the contemporary concepts used for assigning RM value and uncertainty, as well as the limitations and potential problems associated with RMs. The history of RMs, preparation reports and also some problems in the past provide lessons to be learned. These include the <i>δ</i><sup>13</sup>C drift of LSVEC (the second anchor on the <i>δ</i><sup>13</sup>C scale before 2017), revisions to the value assignment principles, the introduction of replacements for LSVEC, related disputes and the potential underestimation of uncertainties for secondary RMs. The review describes metrological concepts related to isotopic scales, RMs and calibration hierarchies and data compatibility. The main RMs and their uncertainties are reviewed through the lens of metrology concepts. Additional focus is given to the VPDB scale for <i>δ</i><sup>13</sup>C and issues of scale discontinuity, which can significantly reduce data compatibility in <i>δ</i><sup>13</sup>C. The given examples of value and uncertainty assignment for RMs should be viewed as an example of value and uncertainty calculation in daily practice.</p>\",\"PeriodicalId\":1,\"journal\":{\"name\":\"Accounts of Chemical Research\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":16.4000,\"publicationDate\":\"2024-06-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Accounts of Chemical Research\",\"FirstCategoryId\":\"93\",\"ListUrlMain\":\"https://doi.org/10.1080/10256016.2024.2355194\",\"RegionNum\":1,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"2024/6/12 0:00:00\",\"PubModel\":\"Epub\",\"JCR\":\"Q1\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Accounts of Chemical Research","FirstCategoryId":"93","ListUrlMain":"https://doi.org/10.1080/10256016.2024.2355194","RegionNum":1,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"2024/6/12 0:00:00","PubModel":"Epub","JCR":"Q1","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 0

摘要

比较和合并来自不同实验室和不同年份的稳定同位素数据集对许多研究领域都至关重要,如同位素水文学、温室气体观测、食品研究、同位素法医学、古重建等。数据兼容性(即合并数据的能力)与数据质量有关。数据可比性的先决条件是根据可靠的参考材料(RMs)和准确分配的数值和不确定性,将数据归一化为通用的稳定同位素标度(通常称为校准)。但这并不能保证数据的兼容性(相互一致)。尽管与数据兼容性和测量不确定性有关的计量学概念已被开发并应用于一般分析化学,但这些概念尚未完全应用于稳定同位素研究。这可能会影响日常校准和分析数据,从而影响数据兼容性。此外,IRMS 用户通常会自行制备不同的实验室标准。之后,用户应了解用于分配 RM 值和不确定性的现代概念,以及与 RM 相关的限制和潜在问题。清除量的历史、制备报告以及过去存在的一些问题都是值得吸取的教训。这些问题包括 LSVEC 的 δ13C 漂移(2017 年之前 δ13C 量表上的第二个锚)、定值原则的修订、LSVEC 替代品的引入、相关争议以及次级 RM 的不确定性可能被低估。综述介绍了与同位素尺度、RMs 和校准等级以及数据兼容性相关的计量学概念。通过计量学概念的视角,对主要清除量及其不确定性进行了审查。此外,还重点讨论了δ13C 的 VPDB 标度和标度不连续性问题,这可能会大大降低δ13C 的数据兼容性。所给出的 RM 值和不确定性分配示例应被视为日常实践中值和不确定性计算的示例。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
查看原文
分享 分享
微信好友 朋友圈 QQ好友 复制链接
本刊更多论文
Towards the compatibility of stable isotope data: review of related concepts, recent progress with reference materials and current challenges.

Comparing and combining stable isotope datasets from different laboratories and different years is essential for many research areas, such as isotope hydrology, greenhouse gas observations, food studies, isotope forensics, palaeo-reconstructions, etc. Data compatibility (i.e. the ability to combine data) is related to the data quality. The prerequisite for data comparability is data normalization to a common stable isotope scale (often referred to as calibration) based on reliable reference materials (RMs) with accurately assigned values and uncertainties. Still, that does not guarantee the data compatibility (mutual agreement). Albeit metrological concepts related to data compatibility and measurement uncertainty have been developed and applied to analytical chemistry in general, these concepts have not yet been fully applied to stable isotope research. This can affect daily calibrations, analytical data and, therefore, data compatibility. In addition, IRMS users often prepare different laboratory standards themselves. Thereafter, users should then understand the contemporary concepts used for assigning RM value and uncertainty, as well as the limitations and potential problems associated with RMs. The history of RMs, preparation reports and also some problems in the past provide lessons to be learned. These include the δ13C drift of LSVEC (the second anchor on the δ13C scale before 2017), revisions to the value assignment principles, the introduction of replacements for LSVEC, related disputes and the potential underestimation of uncertainties for secondary RMs. The review describes metrological concepts related to isotopic scales, RMs and calibration hierarchies and data compatibility. The main RMs and their uncertainties are reviewed through the lens of metrology concepts. Additional focus is given to the VPDB scale for δ13C and issues of scale discontinuity, which can significantly reduce data compatibility in δ13C. The given examples of value and uncertainty assignment for RMs should be viewed as an example of value and uncertainty calculation in daily practice.

求助全文
通过发布文献求助,成功后即可免费获取论文全文。 去求助
来源期刊
Accounts of Chemical Research
Accounts of Chemical Research 化学-化学综合
CiteScore
31.40
自引率
1.10%
发文量
312
审稿时长
2 months
期刊介绍: Accounts of Chemical Research presents short, concise and critical articles offering easy-to-read overviews of basic research and applications in all areas of chemistry and biochemistry. These short reviews focus on research from the author’s own laboratory and are designed to teach the reader about a research project. In addition, Accounts of Chemical Research publishes commentaries that give an informed opinion on a current research problem. Special Issues online are devoted to a single topic of unusual activity and significance. Accounts of Chemical Research replaces the traditional article abstract with an article "Conspectus." These entries synopsize the research affording the reader a closer look at the content and significance of an article. Through this provision of a more detailed description of the article contents, the Conspectus enhances the article's discoverability by search engines and the exposure for the research.
期刊最新文献
Mentorship in academic musculoskeletal radiology: perspectives from a junior faculty member. Underlying synovial sarcoma undiagnosed for more than 20 years in a patient with regional pain: a case report. Sacrococcygeal chordoma with spontaneous regression due to a large hemorrhagic component. Associations of cumulative voriconazole dose, treatment duration, and alkaline phosphatase with voriconazole-induced periostitis. Can the presence of SLAP-5 lesions be predicted by using the critical shoulder angle in traumatic anterior shoulder instability?
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
现在去查看 取消
×
提示
确定
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
已复制链接
已复制链接
快去分享给好友吧!
我知道了
×
扫码分享
扫码分享
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 联系我们:info@booksci.cn
Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。
Copyright © 2023 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1