Modeling copolymer systems using the perturbed-chain SAFT equation of state

J Gross, O Spuhl, F Tumakaka… - Industrial & engineering …, 2003 - ACS Publications
The perturbed-chain SAFT equation of state is extended to heterosegmented molecules and
is applied to copolymers with a well-defined (alternating) repeat-unit sequence as well as to …

Modeling of polymer phase equilibria using Perturbed-Chain SAFT

F Tumakaka, J Gross, G Sadowski - Fluid Phase Equilibria, 2002 - Elsevier
The Perturbed-Chain SAFT equation-of-state is applied to binary and ternary mixtures of
polymers, solvents and gases. Using a temperature-independent interaction parameter kij …

Thermodynamic modeling of complex systems using PC-SAFT

F Tumakaka, J Gross, G Sadowski - Fluid Phase Equilibria, 2005 - Elsevier
This contribution demonstrates the applications of the Perturbed-Chain SAFT (PC-SAFT)
equation of state to a number of different systems containing non-polar as well as …

Perturbed-chain SAFT: An equation of state based on a perturbation theory for chain molecules

J Gross, G Sadowski - Industrial & engineering chemistry …, 2001 - ACS Publications
A modified SAFT equation of state is developed by applying the perturbation theory of
Barker and Henderson to a hard-chain reference fluid. With conventional one-fluid mixing …

Application of the perturbed chain SAFT equation of state to complex polymer systems using simplified mixing rules

IA Kouskoumvekaki, N von Solms, ML Michelsen… - Fluid phase …, 2004 - Elsevier
A simplified perturbed-chain statistical associating fluid theory (PC-SAFT) equation of state
is applied to polymer systems that include a variety of non-associating (esters, cyclic …

Modeling polymer systems using the perturbed-chain statistical associating fluid theory equation of state

J Gross, G Sadowski - Industrial & engineering chemistry …, 2002 - ACS Publications
The perturbed-chain statistical associating fluid theory (PC-SAFT) equation of state is
applied to binary and ternary mixtures of polymers, solvents, and gases. The three pure …

Modeling of polar systems with the perturbed-chain SAFT equation of state. Investigation of the performance of two polar terms

A Dominik, WG Chapman, M Kleiner… - Industrial & …, 2005 - ACS Publications
The Perturbed-Chain SAFT (PC-SAFT) equation of state is applied to model phase equilibria
and the thermodynamic properties of ethers and esters. A systematic study of these two …

Application of the perturbed-chain SAFT equation of state to associating systems

J Gross, G Sadowski - Industrial & engineering chemistry …, 2002 - ACS Publications
The perturbed-chain SAFT (PC− SAFT) equation of state is applied to pure associating
components as well as to vapor− liquid and liquid− liquid equilibria of binary mixtures of …

A predictive group-contribution simplified PC-SAFT equation of state: application to polymer systems

A Tihic, GM Kontogeorgis, N Von Solms… - Industrial & …, 2008 - ACS Publications
A group-contribution (GC) method is coupled with the molecular-based perturbed-chain
statistical associating fluid theory (PC-SAFT) equation of state (EoS) to predict its …

Computational and physical performance of a modified PC-SAFT equation of state for highly asymmetric and associating mixtures

N von Solms, ML Michelsen… - Industrial & engineering …, 2003 - ACS Publications
Two modifications to perturbed-chain statistical associating fluid theory are proposed which
simplify the calculation of phase-equilibrium properties for nonassociating and associating …