Isotropic-nematic transition of hard rods immersed in random sphere matrices.

نویسندگان

  • Matthias Schmidt
  • Marjolein Dijkstra
چکیده

Using replica density functional theory and Monte Carlo computer simulations we investigate a system of annealed hard spherocylinders adsorbed in a matrix of quenched hard spheres. Theoretical predictions for the partition coefficient, defined as the ratio of density of rods in the matrix and that in a reservoir, agree well with simulation results. Theory predicts the isotropic-nematic transition to remain first order upon increasing sphere packing fraction, and to shift towards lower rod densities. This scenario is consistent with our simulation results that clearly show a jump in the nematic order parameter upon increasing the rod density at constant matrix packing fraction, corresponding to the isotropic-nematic transition, even for sphere matrix packing fractions < or approximately equal to 0.3.

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عنوان ژورنال:
  • The Journal of chemical physics

دوره 121 23  شماره 

صفحات  -

تاریخ انتشار 2004