A Reference Equation of State for Heavy Water

IF 4.4 2区 工程技术 Q2 CHEMISTRY, MULTIDISCIPLINARY Journal of Physical and Chemical Reference Data Pub Date : 2018-12-01 DOI:10.1063/1.5053993
S. Herrig, M. Thol, A. Harvey, E. Lemmon
{"title":"A Reference Equation of State for Heavy Water","authors":"S. Herrig, M. Thol, A. Harvey, E. Lemmon","doi":"10.1063/1.5053993","DOIUrl":null,"url":null,"abstract":"An empirical fundamental equation of state (EOS) is presented for fluid heavy water (deuterium oxide, D2O). The equation is explicit in the reduced Helmholtz energy and allows the calculation of all thermodynamic properties over the whole fluid surface. It is valid from the melting-pressure curve up to a temperature of 825 K at pressures up to 1200 MPa. Overall, the formulation represents the most accurate measured values and almost all other available data within their experimental uncertainty. In the homogeneous liquid and vapor phase, the expanded relative uncertainties of densities calculated from the EOS are mostly 0.1% or less; liquid-phase densities at atmospheric pressure can be calculated with an uncertainty of 0.01%. The speed of sound in the liquid phase is described with a maximum uncertainty of 0.1%; the most accurate experimental sound speeds are represented within their uncertainties ranging from 0.015% to 0.02%. In a large part of the liquid region, the isobaric heat capacity is represented with an uncertainty of 1%. The uncertainty in vapor pressure is mostly within 0.05%. In the critical region, the uncertainties of calculated properties are in most cases higher than the values above, but the EOS enables a reasonable description of this region. The equation matches available data for the metastable subcooled liquid, and it extrapolates in a qualitatively correct way to extreme values of temperature and pressure. This formulation is the result of an effort to establish a new standard for the thermodynamic properties of heavy water by the International Association for the Properties of Water and Steam.An empirical fundamental equation of state (EOS) is presented for fluid heavy water (deuterium oxide, D2O). The equation is explicit in the reduced Helmholtz energy and allows the calculation of all thermodynamic properties over the whole fluid surface. It is valid from the melting-pressure curve up to a temperature of 825 K at pressures up to 1200 MPa. Overall, the formulation represents the most accurate measured values and almost all other available data within their experimental uncertainty. In the homogeneous liquid and vapor phase, the expanded relative uncertainties of densities calculated from the EOS are mostly 0.1% or less; liquid-phase densities at atmospheric pressure can be calculated with an uncertainty of 0.01%. The speed of sound in the liquid phase is described with a maximum uncertainty of 0.1%; the most accurate experimental sound speeds are represented within their uncertainties ranging from 0.015% to 0.02%. In a large part of the liquid region, the isobaric heat capacity is represente...","PeriodicalId":16783,"journal":{"name":"Journal of Physical and Chemical Reference Data","volume":" ","pages":""},"PeriodicalIF":4.4000,"publicationDate":"2018-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1063/1.5053993","citationCount":"42","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Physical and Chemical Reference Data","FirstCategoryId":"5","ListUrlMain":"https://doi.org/10.1063/1.5053993","RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 42

Abstract

An empirical fundamental equation of state (EOS) is presented for fluid heavy water (deuterium oxide, D2O). The equation is explicit in the reduced Helmholtz energy and allows the calculation of all thermodynamic properties over the whole fluid surface. It is valid from the melting-pressure curve up to a temperature of 825 K at pressures up to 1200 MPa. Overall, the formulation represents the most accurate measured values and almost all other available data within their experimental uncertainty. In the homogeneous liquid and vapor phase, the expanded relative uncertainties of densities calculated from the EOS are mostly 0.1% or less; liquid-phase densities at atmospheric pressure can be calculated with an uncertainty of 0.01%. The speed of sound in the liquid phase is described with a maximum uncertainty of 0.1%; the most accurate experimental sound speeds are represented within their uncertainties ranging from 0.015% to 0.02%. In a large part of the liquid region, the isobaric heat capacity is represented with an uncertainty of 1%. The uncertainty in vapor pressure is mostly within 0.05%. In the critical region, the uncertainties of calculated properties are in most cases higher than the values above, but the EOS enables a reasonable description of this region. The equation matches available data for the metastable subcooled liquid, and it extrapolates in a qualitatively correct way to extreme values of temperature and pressure. This formulation is the result of an effort to establish a new standard for the thermodynamic properties of heavy water by the International Association for the Properties of Water and Steam.An empirical fundamental equation of state (EOS) is presented for fluid heavy water (deuterium oxide, D2O). The equation is explicit in the reduced Helmholtz energy and allows the calculation of all thermodynamic properties over the whole fluid surface. It is valid from the melting-pressure curve up to a temperature of 825 K at pressures up to 1200 MPa. Overall, the formulation represents the most accurate measured values and almost all other available data within their experimental uncertainty. In the homogeneous liquid and vapor phase, the expanded relative uncertainties of densities calculated from the EOS are mostly 0.1% or less; liquid-phase densities at atmospheric pressure can be calculated with an uncertainty of 0.01%. The speed of sound in the liquid phase is described with a maximum uncertainty of 0.1%; the most accurate experimental sound speeds are represented within their uncertainties ranging from 0.015% to 0.02%. In a large part of the liquid region, the isobaric heat capacity is represente...
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
重水的参考状态方程
提出了流体重水(氘氧化物,D2O)的经验基本状态方程。该方程在减少的亥姆霍兹能量中是明确的,并且允许计算整个流体表面上的所有热力学性质。在高达1200MPa的压力下,从高达825K的温度的熔融压力曲线来看,这是有效的。总体而言,该公式代表了最准确的测量值,以及在其实验不确定性范围内的几乎所有其他可用数据。在均匀液相和汽相中,由EOS计算的密度的扩展相对不确定度大多为0.1%或更小;大气压下液相密度的计算不确定度为0.01%。液相声速的描述不确定度最大为0.1%;最准确的实验声速在其不确定度0.015%至0.02%的范围内表示。在大部分液体区域,等压热容的不确定度为1%。蒸汽压的不确定性大多在0.05%以内。在临界区域,计算性质的不确定性在大多数情况下高于上述值,但EOS能够对该区域进行合理描述。该方程与亚稳过冷液体的可用数据相匹配,并以定性正确的方式外推到温度和压力的极值。该公式是国际水和蒸汽性质协会努力建立重水热力学性质新标准的结果。提出了流体重水(氘氧化物,D2O)的经验基本状态方程(EOS)。该方程在减少的亥姆霍兹能量中是明确的,并且允许计算整个流体表面上的所有热力学性质。在高达1200MPa的压力下,从高达825K的温度的熔融压力曲线来看,这是有效的。总体而言,该公式代表了最准确的测量值,以及在其实验不确定性范围内的几乎所有其他可用数据。在均匀液相和汽相中,由EOS计算的密度的扩展相对不确定度大多为0.1%或更小;大气压下液相密度的计算不确定度为0.01%。液相声速的描述不确定度最大为0.1%;在0.015%-0.02%的不确定度范围内表示了最准确的实验声速。。。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
求助全文
约1分钟内获得全文 去求助
来源期刊
CiteScore
6.90
自引率
11.60%
发文量
14
审稿时长
>12 weeks
期刊介绍: The Journal of Physical and Chemical Reference Data (JPCRD) is published by AIP Publishing for the U.S. Department of Commerce National Institute of Standards and Technology (NIST). The journal provides critically evaluated physical and chemical property data, fully documented as to the original sources and the criteria used for evaluation, preferably with uncertainty analysis. Critical reviews may also be included if they document a reference database, review the data situation in a field, review reference-quality measurement techniques, or review data evaluation methods.
期刊最新文献
Critical Evaluation and Calorimetric Study of the Thermodynamic Properties of Na2CrO4, K2CrO4, Na2MoO4, K2MoO4, Na2WO4, and K2WO4 Critical Evaluation of the Thermodynamic Properties of Na2Cr2O7, K2Cr2O7, Na2Mo2O7, K2Mo2O7, Na2W2O7, and K2W2O7 Evaluation of Physicochemical Property Data in the ECHA Database IUPAC-NIST Solubility Data Series. 105. Solubility of Solid Alkanoic Acids, Alkenoic Acids, Alkanedioic Acids, and Alkenedioic Acids Dissolved in Neat Organic Solvents, Organic Solvent Mixtures, and Aqueous–Organic Solvent Mixtures. III. Alkanedioic Acids and Alkenedioic Acids Ab Initio Calculation of Fluid Properties for Precision Metrology
×
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