{"title":"阿伦尼乌斯速率表达式联合概率分布的快速不确定性量化方法和采样技术：应用于 H2/CO 动力机制的案例研究","authors":"Krunal Panchal, Vaisakh Vasudevan, Sivaram Ambikasaran, Krithika Narayanaswamy","doi":"10.1080/13647830.2024.2326413","DOIUrl":null,"url":null,"abstract":"This work proposes a fast, novel, mathematically robust, and elegant unconstrained Method of Uncertainty Quantification (MUQ) for the temperature-dependent Arrhenius rate constant using Cholesky De...","PeriodicalId":1,"journal":{"name":"Accounts of Chemical Research","volume":null,"pages":null},"PeriodicalIF":16.4000,"publicationDate":"2024-03-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"A fast uncertainty quantification methodology and sampling technique for joint probability distribution of the Arrhenius rate expression: a case study applied to H2/CO kinetic mechanism\",\"authors\":\"Krunal Panchal, Vaisakh Vasudevan, Sivaram Ambikasaran, Krithika Narayanaswamy\",\"doi\":\"10.1080/13647830.2024.2326413\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"This work proposes a fast, novel, mathematically robust, and elegant unconstrained Method of Uncertainty Quantification (MUQ) for the temperature-dependent Arrhenius rate constant using Cholesky De...\",\"PeriodicalId\":1,\"journal\":{\"name\":\"Accounts of Chemical Research\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":16.4000,\"publicationDate\":\"2024-03-12\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Accounts of Chemical Research\",\"FirstCategoryId\":\"5\",\"ListUrlMain\":\"https://doi.org/10.1080/13647830.2024.2326413\",\"RegionNum\":1,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Accounts of Chemical Research","FirstCategoryId":"5","ListUrlMain":"https://doi.org/10.1080/13647830.2024.2326413","RegionNum":1,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
A fast uncertainty quantification methodology and sampling technique for joint probability distribution of the Arrhenius rate expression: a case study applied to H2/CO kinetic mechanism
This work proposes a fast, novel, mathematically robust, and elegant unconstrained Method of Uncertainty Quantification (MUQ) for the temperature-dependent Arrhenius rate constant using Cholesky De...
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.
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