Modelling the phase and chemical equilibria of aqueous solutions of alkanolamines and carbon dioxide using the SAFT-γ SW group contribution approach
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文摘

Group contribution equation of state used to model complex chemical and phase equilibria.

Pure and mixture behaviour of several amines and alkanolamines modelled successfully.

Model parameters enable predictions for compounds/mixtures when no data are available.

Second-order groups introduced to model proximity effects.

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