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Thermodynamics and ANN models for predication of the equilibrium CO2 solubility in aqueous 3-dimethylamino-1-propanol solution

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Abstract In this work, the CO 2 equilibrium solubility of 3-dimethylamino-1-propanol (3DMA1P) is presented over the concentration range of 1–3 mol/L, the temperature range of 298–333 K, and the CO 2 partial… Click to show full abstract

Abstract In this work, the CO 2 equilibrium solubility of 3-dimethylamino-1-propanol (3DMA1P) is presented over the concentration range of 1–3 mol/L, the temperature range of 298–333 K, and the CO 2 partial pressure of 3–101 kPa. Several thermodynamic models (i.e. Kent-Eisenberg model, Austgen model, Hu-Chakma model, Liu et al. model) were used to correlate and predict the CO 2 equilibrium solubility of 3DMA1P solution. It was found that the Liu et al. model could be considered to be an appropriate model to predict the CO 2 equilibrium solubility in 3DMA1P solutions with an absolute average deviation (ADD) of 9.4%. In addition, the ANNs models (BPNN and RBFNN model) were developed and used to correlate the CO 2 equilibrium solubility of 3DMA1P. It was found that the ANNs models could predict the experimental values very well with excellent ADDs of 3.0% for the BPNN model and 4.4% for the RBFNN model, respectively. In addition, a comparison of thermodynamic models and ANN models was presented in terms of prediction of CO 2 solubility in 3DMA1P solution.

Keywords: thermodynamics; model; solution; solubility; equilibrium solubility

Journal Title: International Journal of Greenhouse Gas Control
Year Published: 2017

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