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The gas solubility of pure oxygen and of pure carbon dioxide as well as of their gaseous mixture are measured in the ternary liquid mixture cyclohexane + cyclohexanone + cyclohexanol at 313.6 K with a high‐pressure view‐cell technique using the synthetic method. The new experimental data are used to assess the capability of molecular simulation and conductor‐like screening model (COSMO)‐SAC to predict...
Molecular simulation data on the vapor–liquid equilibrium and the Henry's law constant of carbon dioxide in mixtures of cyclohexane+cyclohexanone are presented. The agreement between simulation results and the available experimental data is good. For the present predictions, new molecular models for cyclohexane and cyclohexanone are developed. The resulting molecular models for cyclohexane and cyclohexanone...
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