预测离子液体蒸气压的经验关系式

Mahboube Salehi Najafabadi, Ebrahim Nemati Lay
{"title":"预测离子液体蒸气压的经验关系式","authors":"Mahboube Salehi Najafabadi,&nbsp;Ebrahim Nemati Lay","doi":"10.1016/j.jil.2022.100035","DOIUrl":null,"url":null,"abstract":"<div><p>The accuracy of vapor pressure calculations is essential because it is used as a basis to estimate the thermal and equilibrium properties in energy industries. In this research work, a new empirical model for predicting the vapor pressure of ionic liquids is presented. The model was derived from 383 experimental data points of the vapor pressure of 32 different ionic liquids, as a function of temperature, critical pressure, critical temperature, acentric factor, critical compressibility factor, the number of carbons of the second alkyl group of the cation, mass connectivity index and molecular weight. The computational parameters have been determined using extended group contribution methods. The accuracy of the new model has been calculated by the absolute relative deviation percent (AARD%) of 6.82. The comparison between the current study and previous studies indicates that the proposed method provides more accurate results compared to other methods.</p></div>","PeriodicalId":100794,"journal":{"name":"Journal of Ionic Liquids","volume":null,"pages":null},"PeriodicalIF":0.0000,"publicationDate":"2022-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2772422022000192/pdfft?md5=944f21a7f4d64d4b020014059d1f8212&pid=1-s2.0-S2772422022000192-main.pdf","citationCount":"3","resultStr":"{\"title\":\"An empirical correlation for predicting vapor pressure of ionic liquids\",\"authors\":\"Mahboube Salehi Najafabadi,&nbsp;Ebrahim Nemati Lay\",\"doi\":\"10.1016/j.jil.2022.100035\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>The accuracy of vapor pressure calculations is essential because it is used as a basis to estimate the thermal and equilibrium properties in energy industries. In this research work, a new empirical model for predicting the vapor pressure of ionic liquids is presented. The model was derived from 383 experimental data points of the vapor pressure of 32 different ionic liquids, as a function of temperature, critical pressure, critical temperature, acentric factor, critical compressibility factor, the number of carbons of the second alkyl group of the cation, mass connectivity index and molecular weight. The computational parameters have been determined using extended group contribution methods. The accuracy of the new model has been calculated by the absolute relative deviation percent (AARD%) of 6.82. The comparison between the current study and previous studies indicates that the proposed method provides more accurate results compared to other methods.</p></div>\",\"PeriodicalId\":100794,\"journal\":{\"name\":\"Journal of Ionic Liquids\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2022-12-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://www.sciencedirect.com/science/article/pii/S2772422022000192/pdfft?md5=944f21a7f4d64d4b020014059d1f8212&pid=1-s2.0-S2772422022000192-main.pdf\",\"citationCount\":\"3\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Ionic Liquids\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S2772422022000192\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Ionic Liquids","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S2772422022000192","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 3

摘要

蒸汽压计算的准确性是至关重要的,因为它被用作估计能源工业的热和平衡性质的基础。本文提出了一种新的预测离子液体蒸气压的经验模型。该模型基于32种不同离子液体的383个实验数据点,以温度、临界压力、临界温度、无中心因子、临界压缩因子、阳离子第二烷基的碳数、质量连通指数和分子量为函数,建立了该模型。采用扩展群贡献法确定了计算参数。新模型的绝对相对偏差率(AARD%)为6.82,计算出新模型的精度。本研究与以往研究的对比表明,与其他方法相比,本文提出的方法提供了更准确的结果。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
An empirical correlation for predicting vapor pressure of ionic liquids

The accuracy of vapor pressure calculations is essential because it is used as a basis to estimate the thermal and equilibrium properties in energy industries. In this research work, a new empirical model for predicting the vapor pressure of ionic liquids is presented. The model was derived from 383 experimental data points of the vapor pressure of 32 different ionic liquids, as a function of temperature, critical pressure, critical temperature, acentric factor, critical compressibility factor, the number of carbons of the second alkyl group of the cation, mass connectivity index and molecular weight. The computational parameters have been determined using extended group contribution methods. The accuracy of the new model has been calculated by the absolute relative deviation percent (AARD%) of 6.82. The comparison between the current study and previous studies indicates that the proposed method provides more accurate results compared to other methods.

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
CiteScore
3.70
自引率
0.00%
发文量
0
×
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
确定
请完成安全验证×
copy
已复制链接
快去分享给好友吧!
我知道了
右上角分享
点击右上角分享
0
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 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术官方微信