A toy-model is used for describing the steps achieving the no-reversibledirection axiom in a tutorial manner: i) choice of a state space results in the balance equations on state space which are linear in the process directions, ii) a reversible process direction cannot be generated by combination of non-reversible ones, iii) process directions which are in the kernel of the balance equations do not enter the entropy production. The Coleman-Mizel formulation of the second law and the Liu relations follow immediately.
The structure of a fluid of hard Gaussian overlap particles of elongation
κ = 5, confined between two hard walls, has been calculated from
density-functional theory and Monte Carlo simulations. By using the exact
expression for the excluded volume kernel (Velasco E and Mederos L 1998 J. Chem. Phys.
109 2361) and solving the appropriate
Euler-Lagrange equation entirely numerically, we have been able to extend
our theoretical predictions into the nematic phase, which had up till now
remained relatively unexplored due to the high computational
cost. Simulation reveals a rich adsorption behaviour with increasing bulk
density, which is described semi-quantitatively by the theory without any
adjustable parameters.
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