优等
化学
非随机双液模型
等压法
环己醇
热力学
汽液平衡
庚烷
等压线
摩尔分数
共沸物
二进制系统
二进制数
活度系数
色谱法
有机化学
物理化学
蒸馏
物理
算术
数学
核子
原子物理学
水溶液
催化作用
作者
Mengjin Zhou,Ruoyu Hu,Ze‐Lin Qiu,Meng Jiao,Zhaoyou Zhu,Yinglong Wang,Peizhe Cui,Jingwei Yang
标识
DOI:10.1021/acs.jced.3c00245
摘要
The fundamental component of the data used in chemical calculations is vapor–liquid equilibrium (VLE) information. The VLE data between several routinely used extractants and chemicals often utilized in industry still have some gaps, nevertheless. The isobaric phase equilibrium values of ethyl acetate + 1-hexanol, methanol + 1-hexanol, and n-heptane + cyclohexanol at 101.3 kPa were measured by using a modified Rose VLE still. The accuracy of experimental data was verified using two test techniques, the Van Ness and Fredenslund tests, and the final experimental data were highly correlated. The NRTL model, UNIQUAC model, and WILSON model were used to correlate the data, and binary interaction parameters between the components were derived. The three systems all meet the data requirements with respect to the root-mean-square deviation (RMSD) and average absolute deviation (AAD) of temperature being less than 0.1 and the RMSD and AAD of the vapor phase mole fraction being less than 0.01. The experimental and predicted values of all data points are in good agreement, and they all meet the requirements outlined in the process design. Additionally, it is discovered that the system under study behaves optimally throughout the whole research domain.
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