A Reference Equation of State with an Associating Term for the Thermodynamic Properties of Ammonia

Fluid ammonia is highly associated because of strong intermolecular hydrogen bonding. This causes different behavior of thermophysical properties from nonpolar fluids, as reflected, for example, in the heat capacity. In this work, a new equation of state explicit in the Helmholtz energy with indepen...

Ausführliche Beschreibung

Gespeichert in:
Bibliographische Detailangaben
Veröffentlicht in:Journal of physical and chemical reference data 2023-03, Vol.52 (1)
Hauptverfasser: Bell, Ian H., Harvey, Allan H., Lemmon, Eric W.
Format: Artikel
Sprache:eng
Schlagworte:
Online-Zugang:Volltext
Tags: Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
container_end_page
container_issue 1
container_start_page
container_title Journal of physical and chemical reference data
container_volume 52
creator Bell, Ian H.
Harvey, Allan H.
Lemmon, Eric W.
description Fluid ammonia is highly associated because of strong intermolecular hydrogen bonding. This causes different behavior of thermophysical properties from nonpolar fluids, as reflected, for example, in the heat capacity. In this work, a new equation of state explicit in the Helmholtz energy with independent variables of temperature and density was developed, which includes a new associating term. Its uncertainties in density, vapor pressure, saturated liquid and vapor densities, and caloric properties were estimated by comparisons with experimental data. The new equation of state is valid from the triple-point temperature (195.49 K) to 725 K at pressures up to 1000 MPa and densities up to 53.13 mol dm−3. Physically correct behavior within the region of validity and at extremely high temperatures and pressures, and at temperatures far below the triple-point temperature, was obtained by applying constraints on various properties. The unique physical behavior of ammonia shown in some thermodynamic properties is described in detail, which will provide a preliminary template for developing equations of state for other associating fluids.
doi_str_mv 10.1063/5.0128269
format Article
fullrecord <record><control><sourceid>proquest_cross</sourceid><recordid>TN_cdi_crossref_primary_10_1063_5_0128269</recordid><sourceformat>XML</sourceformat><sourcesystem>PC</sourcesystem><sourcerecordid>2778656894</sourcerecordid><originalsourceid>FETCH-LOGICAL-c292t-e90859760249c082afb6d7967ffaa9f1768fbd8dd43e6f8bfa1a6b0593433f543</originalsourceid><addsrcrecordid>eNp9kM1KAzEURoMoWKsL3yDgSmFqkpn8LYfSqlBQtK5DZiaxKU7SJinSt3dqu3Z1-biH73IPALcYTTBi5SOdIEwEYfIMjDAlsuCioudghFDFC8KEvARXKa0RQlwIMgJNDd-NNdH41sDZdqezCx4GCz-yzgb-uLyC2sM6pdC6Yem_4NLEHtoQYV4ZuFwNKXR7r3vXwrcYNiZmZ9Khou774J2-BhdWfydzc5pj8DmfLafPxeL16WVaL4qWSJILI5GgkjNEKtkiQbRtWMcl49ZqLS3mTNimE11XlYZZ0ViNNWsQlWVVlpZW5RjcHXs3MWx3JmW1Drvoh5OKcC4YHb4_UPdHqo0hpWis2kTX67hXGKmDQkXVSeHAPhzZ1Lr8Z-Yf-BfQO3Bk</addsrcrecordid><sourcetype>Aggregation Database</sourcetype><iscdi>true</iscdi><recordtype>article</recordtype><pqid>2778656894</pqid></control><display><type>article</type><title>A Reference Equation of State with an Associating Term for the Thermodynamic Properties of Ammonia</title><source>AIP Journals Complete</source><source>Elektronische Zeitschriftenbibliothek - Frei zugängliche E-Journals</source><source>Free Full-Text Journals in Chemistry</source><creator>Bell, Ian H. ; Harvey, Allan H. ; Lemmon, Eric W.</creator><creatorcontrib>Bell, Ian H. ; Harvey, Allan H. ; Lemmon, Eric W.</creatorcontrib><description>Fluid ammonia is highly associated because of strong intermolecular hydrogen bonding. This causes different behavior of thermophysical properties from nonpolar fluids, as reflected, for example, in the heat capacity. In this work, a new equation of state explicit in the Helmholtz energy with independent variables of temperature and density was developed, which includes a new associating term. Its uncertainties in density, vapor pressure, saturated liquid and vapor densities, and caloric properties were estimated by comparisons with experimental data. The new equation of state is valid from the triple-point temperature (195.49 K) to 725 K at pressures up to 1000 MPa and densities up to 53.13 mol dm−3. Physically correct behavior within the region of validity and at extremely high temperatures and pressures, and at temperatures far below the triple-point temperature, was obtained by applying constraints on various properties. The unique physical behavior of ammonia shown in some thermodynamic properties is described in detail, which will provide a preliminary template for developing equations of state for other associating fluids.</description><identifier>ISSN: 0047-2689</identifier><identifier>EISSN: 1529-7845</identifier><identifier>DOI: 10.1063/5.0128269</identifier><identifier>CODEN: JPCRBU</identifier><language>eng</language><publisher>New York: American Institute of Physics</publisher><subject>Ammonia ; High temperature ; Hydrogen ; Temperature ; Thermodynamics ; Vapor pressure</subject><ispartof>Journal of physical and chemical reference data, 2023-03, Vol.52 (1)</ispartof><rights>U.S. Secretary of Commerce</rights><rights>Copyright American Institute of Physics Mar 2023</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c292t-e90859760249c082afb6d7967ffaa9f1768fbd8dd43e6f8bfa1a6b0593433f543</citedby><cites>FETCH-LOGICAL-c292t-e90859760249c082afb6d7967ffaa9f1768fbd8dd43e6f8bfa1a6b0593433f543</cites><orcidid>0000-0002-0974-0203 ; 0000-0003-1123-4307 ; 0000-0002-0072-2332 ; 0000-0001-5831-5556 ; 0000-0003-1091-9080</orcidid></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktohtml>$$Uhttps://pubs.aip.org/jpr/article-lookup/doi/10.1063/5.0128269$$EHTML$$P50$$Gscitation$$H</linktohtml><link.rule.ids>314,776,780,790,4498,27901,27902,76126</link.rule.ids></links><search><creatorcontrib>Bell, Ian H.</creatorcontrib><creatorcontrib>Harvey, Allan H.</creatorcontrib><creatorcontrib>Lemmon, Eric W.</creatorcontrib><title>A Reference Equation of State with an Associating Term for the Thermodynamic Properties of Ammonia</title><title>Journal of physical and chemical reference data</title><description>Fluid ammonia is highly associated because of strong intermolecular hydrogen bonding. This causes different behavior of thermophysical properties from nonpolar fluids, as reflected, for example, in the heat capacity. In this work, a new equation of state explicit in the Helmholtz energy with independent variables of temperature and density was developed, which includes a new associating term. Its uncertainties in density, vapor pressure, saturated liquid and vapor densities, and caloric properties were estimated by comparisons with experimental data. The new equation of state is valid from the triple-point temperature (195.49 K) to 725 K at pressures up to 1000 MPa and densities up to 53.13 mol dm−3. Physically correct behavior within the region of validity and at extremely high temperatures and pressures, and at temperatures far below the triple-point temperature, was obtained by applying constraints on various properties. The unique physical behavior of ammonia shown in some thermodynamic properties is described in detail, which will provide a preliminary template for developing equations of state for other associating fluids.</description><subject>Ammonia</subject><subject>High temperature</subject><subject>Hydrogen</subject><subject>Temperature</subject><subject>Thermodynamics</subject><subject>Vapor pressure</subject><issn>0047-2689</issn><issn>1529-7845</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2023</creationdate><recordtype>article</recordtype><recordid>eNp9kM1KAzEURoMoWKsL3yDgSmFqkpn8LYfSqlBQtK5DZiaxKU7SJinSt3dqu3Z1-biH73IPALcYTTBi5SOdIEwEYfIMjDAlsuCioudghFDFC8KEvARXKa0RQlwIMgJNDd-NNdH41sDZdqezCx4GCz-yzgb-uLyC2sM6pdC6Yem_4NLEHtoQYV4ZuFwNKXR7r3vXwrcYNiZmZ9Khou774J2-BhdWfydzc5pj8DmfLafPxeL16WVaL4qWSJILI5GgkjNEKtkiQbRtWMcl49ZqLS3mTNimE11XlYZZ0ViNNWsQlWVVlpZW5RjcHXs3MWx3JmW1Drvoh5OKcC4YHb4_UPdHqo0hpWis2kTX67hXGKmDQkXVSeHAPhzZ1Lr8Z-Yf-BfQO3Bk</recordid><startdate>20230301</startdate><enddate>20230301</enddate><creator>Bell, Ian H.</creator><creator>Harvey, Allan H.</creator><creator>Lemmon, Eric W.</creator><general>American Institute of Physics</general><scope>AAYXX</scope><scope>CITATION</scope><orcidid>https://orcid.org/0000-0002-0974-0203</orcidid><orcidid>https://orcid.org/0000-0003-1123-4307</orcidid><orcidid>https://orcid.org/0000-0002-0072-2332</orcidid><orcidid>https://orcid.org/0000-0001-5831-5556</orcidid><orcidid>https://orcid.org/0000-0003-1091-9080</orcidid></search><sort><creationdate>20230301</creationdate><title>A Reference Equation of State with an Associating Term for the Thermodynamic Properties of Ammonia</title><author>Bell, Ian H. ; Harvey, Allan H. ; Lemmon, Eric W.</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c292t-e90859760249c082afb6d7967ffaa9f1768fbd8dd43e6f8bfa1a6b0593433f543</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2023</creationdate><topic>Ammonia</topic><topic>High temperature</topic><topic>Hydrogen</topic><topic>Temperature</topic><topic>Thermodynamics</topic><topic>Vapor pressure</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Bell, Ian H.</creatorcontrib><creatorcontrib>Harvey, Allan H.</creatorcontrib><creatorcontrib>Lemmon, Eric W.</creatorcontrib><collection>CrossRef</collection><jtitle>Journal of physical and chemical reference data</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Bell, Ian H.</au><au>Harvey, Allan H.</au><au>Lemmon, Eric W.</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>A Reference Equation of State with an Associating Term for the Thermodynamic Properties of Ammonia</atitle><jtitle>Journal of physical and chemical reference data</jtitle><date>2023-03-01</date><risdate>2023</risdate><volume>52</volume><issue>1</issue><issn>0047-2689</issn><eissn>1529-7845</eissn><coden>JPCRBU</coden><abstract>Fluid ammonia is highly associated because of strong intermolecular hydrogen bonding. This causes different behavior of thermophysical properties from nonpolar fluids, as reflected, for example, in the heat capacity. In this work, a new equation of state explicit in the Helmholtz energy with independent variables of temperature and density was developed, which includes a new associating term. Its uncertainties in density, vapor pressure, saturated liquid and vapor densities, and caloric properties were estimated by comparisons with experimental data. The new equation of state is valid from the triple-point temperature (195.49 K) to 725 K at pressures up to 1000 MPa and densities up to 53.13 mol dm−3. Physically correct behavior within the region of validity and at extremely high temperatures and pressures, and at temperatures far below the triple-point temperature, was obtained by applying constraints on various properties. The unique physical behavior of ammonia shown in some thermodynamic properties is described in detail, which will provide a preliminary template for developing equations of state for other associating fluids.</abstract><cop>New York</cop><pub>American Institute of Physics</pub><doi>10.1063/5.0128269</doi><tpages>28</tpages><orcidid>https://orcid.org/0000-0002-0974-0203</orcidid><orcidid>https://orcid.org/0000-0003-1123-4307</orcidid><orcidid>https://orcid.org/0000-0002-0072-2332</orcidid><orcidid>https://orcid.org/0000-0001-5831-5556</orcidid><orcidid>https://orcid.org/0000-0003-1091-9080</orcidid></addata></record>
fulltext fulltext
identifier ISSN: 0047-2689
ispartof Journal of physical and chemical reference data, 2023-03, Vol.52 (1)
issn 0047-2689
1529-7845
language eng
recordid cdi_crossref_primary_10_1063_5_0128269
source AIP Journals Complete; Elektronische Zeitschriftenbibliothek - Frei zugängliche E-Journals; Free Full-Text Journals in Chemistry
subjects Ammonia
High temperature
Hydrogen
Temperature
Thermodynamics
Vapor pressure
title A Reference Equation of State with an Associating Term for the Thermodynamic Properties of Ammonia
url https://sfx.bib-bvb.de/sfx_tum?ctx_ver=Z39.88-2004&ctx_enc=info:ofi/enc:UTF-8&ctx_tim=2025-02-06T04%3A06%3A21IST&url_ver=Z39.88-2004&url_ctx_fmt=infofi/fmt:kev:mtx:ctx&rfr_id=info:sid/primo.exlibrisgroup.com:primo3-Article-proquest_cross&rft_val_fmt=info:ofi/fmt:kev:mtx:journal&rft.genre=article&rft.atitle=A%20Reference%20Equation%20of%20State%20with%20an%20Associating%20Term%20for%20the%20Thermodynamic%20Properties%20of%20Ammonia&rft.jtitle=Journal%20of%20physical%20and%20chemical%20reference%20data&rft.au=Bell,%20Ian%20H.&rft.date=2023-03-01&rft.volume=52&rft.issue=1&rft.issn=0047-2689&rft.eissn=1529-7845&rft.coden=JPCRBU&rft_id=info:doi/10.1063/5.0128269&rft_dat=%3Cproquest_cross%3E2778656894%3C/proquest_cross%3E%3Curl%3E%3C/url%3E&disable_directlink=true&sfx.directlink=off&sfx.report_link=0&rft_id=info:oai/&rft_pqid=2778656894&rft_id=info:pmid/&rfr_iscdi=true