基于剩余熵标度和三次状态方程的151种常见流体的粘度和导热系数模型。

IF 4.3 3区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY
ACS Omega Pub Date : 2025-02-08 eCollection Date: 2025-02-18 DOI:10.1021/acsomega.4c10815
Xiaoxian Yang
{"title":"基于剩余熵标度和三次状态方程的151种常见流体的粘度和导热系数模型。","authors":"Xiaoxian Yang","doi":"10.1021/acsomega.4c10815","DOIUrl":null,"url":null,"abstract":"<p><p>A residual entropy scaling (RES) approach combined with the cubic equation of state (EoS) was developed to calculate the viscosity and thermal conductivity of 151 common fluids. These pure fluids are all the pure fluids available in the NIST's REFPROP 10.0 database. Seven cubic EoS were studied, while only four yielded good and similar results; these are Peng-Robinson (PR), Soave-Redlich-Kwong (SRK), Patel-Teja-Valderrama (PTV), and Yang-Frotscher-Richter (YFR) EoS. The parameters of a pure fluid in this cubic EoS + RES approach were fitted using experimental data if they are available in the NIST ThermoData Engine database 10.1, otherwise, using the calculations of REFPROP 10.0. This approach is applicable in the entire temperature and pressure ranges for thermal conductivity and at pressures lower than 60 MPa for viscosity. Using this approach, the average absolute value of the relative deviation (AARD) of all of the analyzable experimental values from model calculations was approximately 3.1% and 3.6% for viscosity and thermal conductivity, respectively. This result is not too bad compared to 2.7% and 2.5% obtained by the state-of-the-art viscosity and thermal conductivity models in REFPROP 10.0. The key advantage of this approach is that it has a much simpler equation form and can be easily extended to more fluids. The developed approach has been implemented in the OilMixProp 1.0 software package, and this work will be a basis for the future development of more than 600 pure fluids.</p>","PeriodicalId":22,"journal":{"name":"ACS Omega","volume":"10 6","pages":"6124-6134"},"PeriodicalIF":4.3000,"publicationDate":"2025-02-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11840589/pdf/","citationCount":"0","resultStr":"{\"title\":\"Viscosity and Thermal Conductivity Models of 151 Common Fluids Based on Residual Entropy Scaling and Cubic Equations of State.\",\"authors\":\"Xiaoxian Yang\",\"doi\":\"10.1021/acsomega.4c10815\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p><p>A residual entropy scaling (RES) approach combined with the cubic equation of state (EoS) was developed to calculate the viscosity and thermal conductivity of 151 common fluids. These pure fluids are all the pure fluids available in the NIST's REFPROP 10.0 database. Seven cubic EoS were studied, while only four yielded good and similar results; these are Peng-Robinson (PR), Soave-Redlich-Kwong (SRK), Patel-Teja-Valderrama (PTV), and Yang-Frotscher-Richter (YFR) EoS. The parameters of a pure fluid in this cubic EoS + RES approach were fitted using experimental data if they are available in the NIST ThermoData Engine database 10.1, otherwise, using the calculations of REFPROP 10.0. This approach is applicable in the entire temperature and pressure ranges for thermal conductivity and at pressures lower than 60 MPa for viscosity. Using this approach, the average absolute value of the relative deviation (AARD) of all of the analyzable experimental values from model calculations was approximately 3.1% and 3.6% for viscosity and thermal conductivity, respectively. This result is not too bad compared to 2.7% and 2.5% obtained by the state-of-the-art viscosity and thermal conductivity models in REFPROP 10.0. The key advantage of this approach is that it has a much simpler equation form and can be easily extended to more fluids. The developed approach has been implemented in the OilMixProp 1.0 software package, and this work will be a basis for the future development of more than 600 pure fluids.</p>\",\"PeriodicalId\":22,\"journal\":{\"name\":\"ACS Omega\",\"volume\":\"10 6\",\"pages\":\"6124-6134\"},\"PeriodicalIF\":4.3000,\"publicationDate\":\"2025-02-08\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11840589/pdf/\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"ACS Omega\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://doi.org/10.1021/acsomega.4c10815\",\"RegionNum\":3,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"2025/2/18 0:00:00\",\"PubModel\":\"eCollection\",\"JCR\":\"Q2\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"ACS Omega","FirstCategoryId":"92","ListUrlMain":"https://doi.org/10.1021/acsomega.4c10815","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"2025/2/18 0:00:00","PubModel":"eCollection","JCR":"Q2","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 0

摘要

结合三次状态方程(EoS),提出了一种剩余熵标度法(RES)来计算151种常见流体的粘度和导热系数。这些纯流体是NIST REFPROP 10.0数据库中可用的所有纯流体。研究了7个立方的EoS,而只有4个产生了良好和相似的结果;这些是Peng-Robinson (PR), Soave-Redlich-Kwong (SRK), Patel-Teja-Valderrama (PTV)和Yang-Frotscher-Richter (YFR) EoS。在这种立方EoS + RES方法中,纯流体的参数如果在NIST ThermoData Engine数据库10.1中可用,则使用实验数据进行拟合,否则使用REFPROP 10.0计算。这种方法适用于导热系数的整个温度和压力范围,以及粘度低于60 MPa的压力范围。使用这种方法,所有可分析的实验值与模型计算的相对偏差(AARD)的平均绝对值分别约为3.1%和3.6%,分别用于粘度和导热系数。与REFPROP 10.0中最先进的粘度和导热系数模型所得到的2.7%和2.5%的结果相比,这一结果还算不错。这种方法的主要优点是,它有一个更简单的方程形式,可以很容易地扩展到更多的流体。所开发的方法已在OilMixProp 1.0软件包中实施,该工作将为未来开发600多种纯流体奠定基础。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Viscosity and Thermal Conductivity Models of 151 Common Fluids Based on Residual Entropy Scaling and Cubic Equations of State.

A residual entropy scaling (RES) approach combined with the cubic equation of state (EoS) was developed to calculate the viscosity and thermal conductivity of 151 common fluids. These pure fluids are all the pure fluids available in the NIST's REFPROP 10.0 database. Seven cubic EoS were studied, while only four yielded good and similar results; these are Peng-Robinson (PR), Soave-Redlich-Kwong (SRK), Patel-Teja-Valderrama (PTV), and Yang-Frotscher-Richter (YFR) EoS. The parameters of a pure fluid in this cubic EoS + RES approach were fitted using experimental data if they are available in the NIST ThermoData Engine database 10.1, otherwise, using the calculations of REFPROP 10.0. This approach is applicable in the entire temperature and pressure ranges for thermal conductivity and at pressures lower than 60 MPa for viscosity. Using this approach, the average absolute value of the relative deviation (AARD) of all of the analyzable experimental values from model calculations was approximately 3.1% and 3.6% for viscosity and thermal conductivity, respectively. This result is not too bad compared to 2.7% and 2.5% obtained by the state-of-the-art viscosity and thermal conductivity models in REFPROP 10.0. The key advantage of this approach is that it has a much simpler equation form and can be easily extended to more fluids. The developed approach has been implemented in the OilMixProp 1.0 software package, and this work will be a basis for the future development of more than 600 pure fluids.

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
ACS Omega
ACS Omega Chemical Engineering-General Chemical Engineering
CiteScore
6.60
自引率
4.90%
发文量
3945
审稿时长
2.4 months
期刊介绍: ACS Omega is an open-access global publication for scientific articles that describe new findings in chemistry and interfacing areas of science, without any perceived evaluation of immediate impact.
×
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:604180095
Book学术官方微信