The paper is a review of the combined group contribution (GC)–atom connectivity index (CI)
approach for prediction of physical and thermodynamic properties of organic chemicals and …

At present, at least for engineering purposes, the most successful predictive models for
activity coefficients are those based on functional groups such as UNIFAC and its variants …

This paper provides a review of the available literature on computational schemes for
rational solvent design, with a focus on solvent extraction and crystallization (the two most …

In this work, the enthalpy of fusion and melting points of 2-(tert-butyl)-5-methylphenol
(2B5MP) and 2-(tert-butyl)-4-methylphenol (2B4MP) were measured by differential scanning …

The objective of this chapter is to give an overview of the models, methods and tools that
may be used for the estimation of liquid formulated products. First a classification of the …

In this work, we present a further development and analysis of the Original UNIFAC-CI
models for the prediction of vapor–liquid equilibrium (VLE) and solid–liquid equilibrium …

The aim of this work is to present the development of a computer aided multilevel modeling
network for the systematic design and analysis of processes employing lipid technologies …

Industrial use of lipids increased as a consequence of the rapid development in bio-based
economies. In addition to food products applications, lipids are used by many other …

Many challenges involving physical and thermodynamic properties in the production of
edible oils and biodiesel are observed, such as availability of experimental data and …

A novel approach for improving estimations of existing group contribution methods is
developed. Instead of fixed contributions, weighted contributions are optimized for each …