On the estimation of water pure compound parameters in association theories Artikel uri icon

Open Access

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Peer Reviewed

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Abstract

  • Determination of the appropriate number of association sites and estimation of parameters for association (SAFT-type) theories is not a trivial matter. Building further on a recently published manuscript by Clark et al. [1], this work investigates aspects in parameter estimation for water using two different association theories. Their performance for various properties as well as against the results presented by Clark et al. [1] is demonstrated.