Freidoon Esmaelizadeh, F. Zarei, S. M. Mousavi, G. Vakili-Nezhaad
{"title":"Prediction of DES’ Vapor Pressure Using a New Corresponding State Model","authors":"Freidoon Esmaelizadeh, F. Zarei, S. M. Mousavi, G. Vakili-Nezhaad","doi":"10.22036/PCR.2020.211346.1707","DOIUrl":null,"url":null,"abstract":"Application of deep eutectic solvents in industrial chemical processes are improved over time in last decades. In this work, vapor pressures of 13 classes of DESs (DES 1-13) based on 5 salts and 7 hydrogen bond donors with various combinations of molar ratio were used between 343-393 K. The vapor pressure of the pure and aqueous solutions of DESs was calculated by different equations of state, which are based on “φ-φ” and \"γ-φ\" approachs. Additionally, Voutsas and Wagner models as corresponding-state models were modified to predict the vapor pressure of the pure and aqueous solutions of DESs. The total average absolute relative deviations of the Modified-Voutsas and Modified-Wagner models for the vapor pressure calculation of the pure and aqueous solutions of DESs were 7.03, 9.08 % and 5.47, 7.15 %, respectively. Moreover, the validity of vapor pressure calculation using the two modified models was checked with the aid of a linear equation for the average specific heat capacity of different DESs (23 classes of DESs) between 278.15-353.15 K. Results showed that the total average absolute relative deviations of the specific heat capacity of DESs using the Modified-Voutsas and Modified-Wagner models from the experimental data were 4.128 and 4.056 %, respectively.","PeriodicalId":20084,"journal":{"name":"Physical Chemistry Research","volume":null,"pages":null},"PeriodicalIF":1.4000,"publicationDate":"2020-09-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"1","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Physical Chemistry Research","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.22036/PCR.2020.211346.1707","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 1
Abstract
Application of deep eutectic solvents in industrial chemical processes are improved over time in last decades. In this work, vapor pressures of 13 classes of DESs (DES 1-13) based on 5 salts and 7 hydrogen bond donors with various combinations of molar ratio were used between 343-393 K. The vapor pressure of the pure and aqueous solutions of DESs was calculated by different equations of state, which are based on “φ-φ” and "γ-φ" approachs. Additionally, Voutsas and Wagner models as corresponding-state models were modified to predict the vapor pressure of the pure and aqueous solutions of DESs. The total average absolute relative deviations of the Modified-Voutsas and Modified-Wagner models for the vapor pressure calculation of the pure and aqueous solutions of DESs were 7.03, 9.08 % and 5.47, 7.15 %, respectively. Moreover, the validity of vapor pressure calculation using the two modified models was checked with the aid of a linear equation for the average specific heat capacity of different DESs (23 classes of DESs) between 278.15-353.15 K. Results showed that the total average absolute relative deviations of the specific heat capacity of DESs using the Modified-Voutsas and Modified-Wagner models from the experimental data were 4.128 and 4.056 %, respectively.
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