New Method Based on the UNIFACVISCO Model for the Estimation of Ionic Liquids Viscosity Using the Experimental Data Recommended by Mathematical Gnostics.
Identifikátory výsledku
Kód výsledku v IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F67985858%3A_____%2F16%3A00466492" target="_blank" >RIV/67985858:_____/16:00466492 - isvavai.cz</a>
Výsledek na webu
<a href="http://dx.doi.org/10.1021/acs.jced.6b00689" target="_blank" >http://dx.doi.org/10.1021/acs.jced.6b00689</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1021/acs.jced.6b00689" target="_blank" >10.1021/acs.jced.6b00689</a>
Alternativní jazyky
Jazyk výsledku
angličtina
Název v původním jazyce
New Method Based on the UNIFACVISCO Model for the Estimation of Ionic Liquids Viscosity Using the Experimental Data Recommended by Mathematical Gnostics.
Popis výsledku v původním jazyce
The viscosity of ionic liquids (ILs) has been modeled as a function of temperature and at atmospheric pressure using a new method based on the UNIFACVISCO method. This model extends the calculations previously reported by our group which used 154 experimental viscositydata points of 25 ionic liquids for regression of a set of binary interaction parameters and ion VogelFulcherTammann(VFT) parameters. Discrepancies in the experimental data ofthe same IL affect the quality of the correlation and thus the development of the predictive method. In this work, mathe-matical gnostics was used to analyze the experimental data from different sources and recommend one set of reliable data foreach IL. These recommended data (totally 819 data points) for 70 ILs were correlated using this model to obtain an extended set of binary interaction parameters and ion VFT parameters, with a regression accuracy of 1.4%. In addition, 966 experimental viscosity data points for 11 binary mixtures of ILs were collected from literature to establish this model. All the binary data consist of 128 training data points used for the optimization of Binary interaction parameters and 838 test data points used for the comparison of the pure evaluated values. The relative average absolute deviation (RAAD) for training and test is 2.9% and 3.9%, respectively.
Název v anglickém jazyce
New Method Based on the UNIFACVISCO Model for the Estimation of Ionic Liquids Viscosity Using the Experimental Data Recommended by Mathematical Gnostics.
Popis výsledku anglicky
The viscosity of ionic liquids (ILs) has been modeled as a function of temperature and at atmospheric pressure using a new method based on the UNIFACVISCO method. This model extends the calculations previously reported by our group which used 154 experimental viscositydata points of 25 ionic liquids for regression of a set of binary interaction parameters and ion VogelFulcherTammann(VFT) parameters. Discrepancies in the experimental data ofthe same IL affect the quality of the correlation and thus the development of the predictive method. In this work, mathe-matical gnostics was used to analyze the experimental data from different sources and recommend one set of reliable data foreach IL. These recommended data (totally 819 data points) for 70 ILs were correlated using this model to obtain an extended set of binary interaction parameters and ion VFT parameters, with a regression accuracy of 1.4%. In addition, 966 experimental viscosity data points for 11 binary mixtures of ILs were collected from literature to establish this model. All the binary data consist of 128 training data points used for the optimization of Binary interaction parameters and 838 test data points used for the comparison of the pure evaluated values. The relative average absolute deviation (RAAD) for training and test is 2.9% and 3.9%, respectively.
Klasifikace
Druh
J<sub>x</sub> - Nezařazeno - Článek v odborném periodiku (Jimp, Jsc a Jost)
CEP obor
CF - Fyzikální chemie a teoretická chemie
OECD FORD obor
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Návaznosti výsledku
Projekt
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Návaznosti
I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace
Ostatní
Rok uplatnění
2016
Kód důvěrnosti údajů
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Údaje specifické pro druh výsledku
Název periodika
Journal of Chemical and Engineering Data
ISSN
0021-9568
e-ISSN
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Svazek periodika
61
Číslo periodika v rámci svazku
111
Stát vydavatele periodika
US - Spojené státy americké
Počet stran výsledku
14
Strana od-do
3908-3921
Kód UT WoS článku
000387738400025
EID výsledku v databázi Scopus
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