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1.
J Chem Phys ; 122(22): 224504, 2005 Jun 08.
Artigo em Inglês | MEDLINE | ID: mdl-15974688

RESUMO

The thermodynamic properties of semiclassical hard-body fluid mixtures are studied. Explicit expressions are given for the free-energy, equation of state and virial coefficients of the classical hard convex-body fluid mixtures. The numerical results are discussed under different conditions. The agreement with the exact data is good in all cases. The first-order quantum corrections are also studied. The quantum effects depend on the condition, shape parameters L11* and L22*, and concentrations x1 and x2 in general and increase with an increase of packing fraction eta, in particular.

2.
J Chem Phys ; 122(1): 14517, 2005 Jan 01.
Artigo em Inglês | MEDLINE | ID: mdl-15638684

RESUMO

The problem of calculating the thermodynamic properties of two-dimensional semiclassical hard-body fluids is studied. Explicit expressions are given for the first-order quantum corrections to the free energy, equation of state, and virial coefficients. The numerical results are calculated for the planar hard dumbbell fluid. Significant features are the increase in quantum corrections with increasing eta and increasing L*=L/sigma(0).

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