Physics – Chemical Physics
Scientific paper
2009-06-17
Fluid Phase Equilibria 249: 120-130 (2006)
Physics
Chemical Physics
Scientific paper
Equilibrium molecular dynamics simulation and the Green-Kubo formalism were used to calculate self-diffusion coefficient, shear viscosity,and thermal conductivity for 30 different quadrupolar two-center Lennard-Jones fluids along the bubble line and in the homogeneous liquid. It was systematically investigated how anisotropy, i.e. elongation, and quadrupole momentum influence the transport properties. The reduced elongation L* was varied from 0 to 0.8 and the reduced squared quadrupole momentum Q*2 from 0 to 4, i.e. in the entire range in which parameters for real fluids are expected. The statistical uncertainty of the reported data varies with transport property, for self-diffusion coefficient data the error bars are typically lower than 3 %, for shear viscosity and thermal conductivity they are about 8 and 12 %, respectively.
Fernandez G. A.
Hasse Hans
Vrabec Jadran
No associations
LandOfFree
Transport Properties of Anisotropic Polar Fluids: 1. Quadrupolar Interaction does not yet have a rating. At this time, there are no reviews or comments for this scientific paper.
If you have personal experience with Transport Properties of Anisotropic Polar Fluids: 1. Quadrupolar Interaction, we encourage you to share that experience with our LandOfFree.com community. Your opinion is very important and Transport Properties of Anisotropic Polar Fluids: 1. Quadrupolar Interaction will most certainly appreciate the feedback.
Profile ID: LFWR-SCP-O-223123