Density functional theory for chemical engineering: From capillarity to soft materials
J Wu - AIChE journal, 2006 - Wiley Online Library
Understanding the microscopic structure and macroscopic properties of condensed matter
from a molecular perspective is important for both traditional and modern chemical …
from a molecular perspective is important for both traditional and modern chemical …
Fundamental challenges and opportunities for preparative supercritical fluid chromatography
G Guiochon, A Tarafder - Journal of Chromatography A, 2011 - Elsevier
The use of supercritical fluids as mobile phases in chromatography was suggested nearly
fifty years ago. In spite of some major potential advantages, this mode of chromatography …
fifty years ago. In spite of some major potential advantages, this mode of chromatography …
Effect of asphaltene structure on association and aggregation using molecular dynamics
The aggregation of asphaltenes has been established for decades by numerous
experimental techniques; however, very few studies have been performed on the …
experimental techniques; however, very few studies have been performed on the …
The state of the cubic equations of state
JO Valderrama - Industrial & engineering chemistry research, 2003 - ACS Publications
The development of van der Waals cubic equations of state and their application to the
correlation and prediction of phase equilibrium properties is presented and analyzed. The …
correlation and prediction of phase equilibrium properties is presented and analyzed. The …
[HTML][HTML] Energy variational analysis of ions in water and channels: Field theory for primitive models of complex ionic fluids
Ionic solutions are mixtures of interacting anions and cations. They hardly resemble dilute
gases of uncharged noninteracting point particles described in elementary textbooks …
gases of uncharged noninteracting point particles described in elementary textbooks …
A consistency test for α-functions of cubic equations of state
This study highlights that α-functions used in cubic equations of state must be of class C 2 ie
that their first (d α/d T) and second (d 2 α/d T 2) derivatives must exist and must be …
that their first (d α/d T) and second (d 2 α/d T 2) derivatives must exist and must be …
A detailed thermodynamic analysis of [C 4 mim][BF 4]+ water as a case study to model ionic liquid aqueous solutions
Since determining experimentally a wide variety of thermophysical properties—even for a
very small portion of the already known room temperature ionic liquids (and their mixtures …
very small portion of the already known room temperature ionic liquids (and their mixtures …
A general guidebook for the theoretical prediction of physicochemical properties of chemicals for regulatory purposes
The REACH regulation (recent EU regulation for “Registration, Evaluation, Authorization,
and Restriction of Chemicals”) entered its product-recording phase after December 2008. 1 …
and Restriction of Chemicals”) entered its product-recording phase after December 2008. 1 …
Exploiting synergistic effects of intermolecular interactions to synthesize hybrid rejuvenators to revitalize aged asphalt
This paper examines the merits of using a hybrid bio-oil derived from algae and swine
manure to rejuvenate aged bitumen by restoring the bitumen properties which are degraded …
manure to rejuvenate aged bitumen by restoring the bitumen properties which are degraded …
[KSIĄŻKA][B] Advances in Thermodynamics of the van der Waals Fluid
DC Johnston - 2014 - iopscience.iop.org
The van der Waals mean-field theory of fluids was formulated by van der Waals in 1873 and
augmented by Maxwell in 1875. It is the first theory that predicts a phase transition from …
augmented by Maxwell in 1875. It is the first theory that predicts a phase transition from …