화학공학소재연구정보센터

Fluid Phase Equilibria

Fluid Phase Equilibria, Vol.217, No.1 Entire volume, number list
ISSN: 0378-3812 (Print) 

In this Issue (10 articles)

1 - 10 The first industrial fluid properties simulation challenge
Case F, Chaka A, Friend DG, Frurip D, Golab J, Johnson R, Moore J, Mountain RD, Olson J, Schiller M, Storer J
11 - 15 Establishing benchmarks for the first industrial fluids simulation challenge
Friend DG, Frurip DJ, Magee JW, Olson JD
17 - 17 Fluid properties simulation challenge - Recommendation for problem I(a): vapor-liquid equilibria for dimethyl ether(1)+propylene(2)
Olson JD, Frurip DJ
53 - 57 Prediction of vapor liquid equilibria using COSMOtherm
Klamt A, Eckert F
59 - 76 Prediction of fluid densities using automatically derived VDW parameters
Sun H
77 - 87 Fluid density predictions using the COMPASS force field
Rigby D
89 - 95 Osmotic molecular dynamics simulation of vapor-liquid equilibria for propylene plus dimethyl ether and nitroethane plus propylene glycol monomethyl ether mixtures
Pollock TR, Crozier P, Rowley RL
97 - 104 Density, local composition and diffusivity of aqueous choline chloride solutions: a molecular dynamics study
Morrow TI, Maginn EJ
105 - 110 Industrial property prediction using Towhee and LAMMPS
Martin MG, Thompson AP
111 - 118 AUA model NEMD and EMD simulations of the shear viscosity of alkane and alcohol systems
Zhang HZ, Ely JF