Modeling of aqueous electrolyte solutions with perturbed-chain statistical associated fluid theory

LF Cameretti, G Sadowski… - Industrial & engineering …, 2005 - ACS Publications
The vapor pressures and liquid densities of single-salt electrolyte solutions containing NaCl,
LiCl, KCl, NaBr, LiBr, KBr, NaI, LiI, KI, Li2SO4, Na2SO4, and K2SO4 were modeled with an …

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 …

Artificial multiple criticality and phase equilibria: an investigation of the PC-SAFT approach

L Yelash, M Müller, W Paul, K Binder - Physical Chemistry Chemical …, 2005 - pubs.rsc.org
The perturbed-chain statistical associating fluid theory (PC-SAFT) is studied for a wide range
of temperature, T, pressure, p, and (effective) chain length, m, to establish the generic phase …

Prediction and correlation of high-pressure gas solubility in polymers with simplified PC-SAFT

N von Solms, ML Michelsen… - Industrial & engineering …, 2005 - ACS Publications
Using simplified PC-SAFT we have modeled gas solubilities at high temperatures and
pressures for the gases methane and carbon dioxide in each of the three polymers high …

A global investigation of phase equilibria using the perturbed-chain statistical-associating-fluid-theory approach

L Yelash, M Müller, W Paul, K Binder - The Journal of chemical physics, 2005 - pubs.aip.org
The recently developed perturbed-chain statistical-associating-fluid theory (PC-SAFT) is
investigated for a wide range of model parameters including the parameter m representing …

Interfacial properties of polystyrene in contact with carbon dioxide

S Enders, H Kahl, J Winkelmann - Fluid phase equilibria, 2005 - Elsevier
The Cahn–Hilliard theory was combined with equations of state (the original statistical
associating fluid theory, the perturbed-chain statistical associating fluid theory or the …

Thermodynamic model for branched polyolefins using the PC-SAFT equation of state

A Dominik, WG Chapman - Macromolecules, 2005 - ACS Publications
This article presents a simple thermodynamic model for branched polyolefin systems in the
framework of the PC-SAFT equation of state. The physical properties of the polymeric …

Modeling safety aspects of styrene polymerization processes

KD Hungenberg, U Nieken, K Zöllner… - Industrial & …, 2005 - ACS Publications
Various kinetic models for thermally initiated polymerization of styrene are compared
concerning their description of isothermal batch and continuous polymerization as well as …

High-Pressure Phase Behavior of the System PCHC−CHO−CO2 for the Development of a Solvent-Free Alternative toward Polycarbonate Production

MA Van Schilt, RM Wering… - Industrial & …, 2005 - ACS Publications
Thermodynamic phase equilibrium data relevant to the copolymerization of carbon dioxide
(CO2) and cyclohexene oxide (CHO) are reported in this paper. In this system, the need for …

Predictive property models for use in design of controlled release of pesticides

N Muro-Suné, R Gani, G Bell, I Shirley - Fluid phase equilibria, 2005 - Elsevier
A model capable of predicting the release of an Active Ingredient (AI) from a specific device
would be very useful in the field of pesticide controlled release technology for design …