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papers

Publications (15)

physics.chem-ph2009

Thermodynamic Models for Vapor-Liquid Equilibria of Nitrogen+Oxygen+Carbon Dioxide at Low Temperatures

J. Vrabec, G. K. Kedia, U. Buchhauser +2

physics.chem-ph2009

Grand Equilibrium: vapour-liquid equilibria by a new molecular simulation method

J. Vrabec, H. Hasse

physics.chem-ph2009

Henry's Law Constants of Methane, Nitrogen, Oxygen and Carbon Dioxide in Ethanol from 273 to 498 K: Prediction from Molecular Simulation

T. Schnabel, J. Vrabec, H. Hasse

physics.chem-ph2009

Transport Properties of Anisotropic Polar Fluids: 1. Quadrupolar Interaction

G. A. Fernandez, J. Vrabec, H. Hasse

physics.chem-ph2009

A molecular simulation study of shear and bulk viscosity and thermal conductivity of simple real fluids

G. A. Fernandez, J. Vrabec, H. Hasse

physics.chem-ph2009

Comment on "An optimized potential for carbon dioxide" [J. Chem. Phys. 122, 214507 (2005)]

T. Merker, J. Vrabec, H. Hasse

physics.chem-ph2009

An optimized molecular model for ammonia

B. Eckl, J. Vrabec, H. Hasse

physics.chem-ph2009

Joule-Thomson inversion curves of mixtures by molecular simulation in comparison to advanced equations of state: natural gas as an example

J. Vrabec, A. Kumar, H. Hasse

physics.chem-ph2009

Prediction of ternary vapor-liquid equilibria for 33 systems by molecular simulation,

Y. -L. Huang, J. Vrabec, H. Hasse

physics.chem-ph2009

Transport Properties of Anisotropic Polar Fluids:2. Dipolar Interaction

G. A. Fernandez, J. Vrabec, H. Hasse

physics.chem-ph2009

Comment on "An optimized potential for carbon dioxide"

T. Merker, J. Vrabec, H. Hasse

physics.chem-ph2009

Comprehensive study of the vapour-liquid equilibria of the pure two-centre Lennard-Jones plus pointquadrupole fluid

J. Stoll, J. Vrabec, H. Hasse

physics.chem-ph2009

Unlike Lennard-Jones Parameters for Vapor-Liquid Equilibria

T. Schnabel, J. Vrabec, H. Hasse

physics.chem-ph2009

Chemical potential of quadrupolar two-centre Lennard-Jones fluids by gradual insertion

J. Vrabec, M. Kettler, H. Hasse

physics.chem-ph2009

Self diffusion and binary Maxwell-Stefan diffusion in simple fluids with the Green-Kubo method

G. A. Fernandez, J. Vrabec, H. Hasse