Résumé
Phys. Rev. E 55, 657 (1997) Using a molecular dynamics computer simulation we determine the temperature
dependence of the partial structure factors for a binary Lennard-Jones system.
These structure factors are used as input data to solve numerically the
wave-vector dependent mode-coupling equations in the long time limit. Using the
so determined solutions, we compare the predictions of mode-coupling theory
(MCT) with the results of a previously done molecular dynamics computer
simulation [Phys. Rev. E 51, 4626 (1995), ibid. 52, 4134 (1995)]. From this
comparison we conclude that MCT gives a fair estimate of the critical coupling
constant, a good estimate of the exponent parameter, predicts the wave-vector
dependence of the various nonergodicity parameters very well, except for very
large wave-vectors, and gives also a very good description of the space
dependence of the various critical amplitudes. In an attempt to correct for
some of the remaining discrepancies between the theory and the results of the
simulation, we investigate two small (ad hoc) modifications of the theory. We
find that one modification gives a worse agreement between theory and
simulation, whereas the second one leads to an improved agreement.