Evaluation of liquid-vapour density profiles of associating fluids: A density-functional approach |
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Authors: | Małgorzata Borówko Krzystof Stępniak Stefan Sokołowski Roman Zagórski |
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Affiliation: | (1) Department for the Modelling of Physico-Chemical Processes, Maria Curie-Skłodowska University, 20031 Lublin, Poland |
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Abstract: | The structure of liquid-gas interface of associating Lennard-Jones particles is studied using the density-functional theory and the Monte Carlo simulation. The model with one bonding site per particle is considered. It is shown that the considered version of the density functional is quite successful in predicting the gas-liquid density profile. |
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