A Fluctuation Equation of State for Prediction of High-Pressure Densities of Ionic Liquids

Abstract During this work, we demonstrate, for the first time, that the volumetric properties of pure ionic liquids could be truly predicted as a function of temperature from 219 K to 473 K and pressure up to 300 MPa. This has been achieved by using only density and isothermal compressibility data a...

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Autores principales: Mirosław Chorążewski, Eugene B. Postnikov, Bernadeta Jasiok, Yuriy V. Nedyalkov, Johan Jacquemin
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Publicado: Nature Portfolio 2017
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Acceso en línea:https://doaj.org/article/2fef739932124994a6fb6a584ebdb91b
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spelling oai:doaj.org-article:2fef739932124994a6fb6a584ebdb91b2021-12-02T11:52:15ZA Fluctuation Equation of State for Prediction of High-Pressure Densities of Ionic Liquids10.1038/s41598-017-06225-92045-2322https://doaj.org/article/2fef739932124994a6fb6a584ebdb91b2017-07-01T00:00:00Zhttps://doi.org/10.1038/s41598-017-06225-9https://doaj.org/toc/2045-2322Abstract During this work, we demonstrate, for the first time, that the volumetric properties of pure ionic liquids could be truly predicted as a function of temperature from 219 K to 473 K and pressure up to 300 MPa. This has been achieved by using only density and isothermal compressibility data at atmospheric pressure through the Fluctuation Theory-based Tait-like Equation of State (FT-EoS). The experimental density data of 80 different ionic liquids, described in the literature by several research groups as a function of temperature and pressure, was then used to provide comparisons. Excellent predictive capability of FT-EoS was observed with an overall relative absolute average deviation close to 0.14% for the 15,298 data points examined during this work.Mirosław ChorążewskiEugene B. PostnikovBernadeta JasiokYuriy V. NedyalkovJohan JacqueminNature PortfolioarticleMedicineRScienceQENScientific Reports, Vol 7, Iss 1, Pp 1-9 (2017)
institution DOAJ
collection DOAJ
language EN
topic Medicine
R
Science
Q
spellingShingle Medicine
R
Science
Q
Mirosław Chorążewski
Eugene B. Postnikov
Bernadeta Jasiok
Yuriy V. Nedyalkov
Johan Jacquemin
A Fluctuation Equation of State for Prediction of High-Pressure Densities of Ionic Liquids
description Abstract During this work, we demonstrate, for the first time, that the volumetric properties of pure ionic liquids could be truly predicted as a function of temperature from 219 K to 473 K and pressure up to 300 MPa. This has been achieved by using only density and isothermal compressibility data at atmospheric pressure through the Fluctuation Theory-based Tait-like Equation of State (FT-EoS). The experimental density data of 80 different ionic liquids, described in the literature by several research groups as a function of temperature and pressure, was then used to provide comparisons. Excellent predictive capability of FT-EoS was observed with an overall relative absolute average deviation close to 0.14% for the 15,298 data points examined during this work.
format article
author Mirosław Chorążewski
Eugene B. Postnikov
Bernadeta Jasiok
Yuriy V. Nedyalkov
Johan Jacquemin
author_facet Mirosław Chorążewski
Eugene B. Postnikov
Bernadeta Jasiok
Yuriy V. Nedyalkov
Johan Jacquemin
author_sort Mirosław Chorążewski
title A Fluctuation Equation of State for Prediction of High-Pressure Densities of Ionic Liquids
title_short A Fluctuation Equation of State for Prediction of High-Pressure Densities of Ionic Liquids
title_full A Fluctuation Equation of State for Prediction of High-Pressure Densities of Ionic Liquids
title_fullStr A Fluctuation Equation of State for Prediction of High-Pressure Densities of Ionic Liquids
title_full_unstemmed A Fluctuation Equation of State for Prediction of High-Pressure Densities of Ionic Liquids
title_sort fluctuation equation of state for prediction of high-pressure densities of ionic liquids
publisher Nature Portfolio
publishDate 2017
url https://doaj.org/article/2fef739932124994a6fb6a584ebdb91b
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