Abstract

Methods have been developed for the computer simulation of ternary contributions to the dipole autocorrelation function for systems consisting of three interacting particles. These methods were used to study ternary contributions in rare gas mixtures, in mixtures of quadrupolar molecules with rare gas molecules and in pure rare gases. Very similar methods were also used to calculate the binary correlation function for a mixture of quadrupolar molecules with rare gas molecules when the anisotropy in the interaction potential is taken explicitly into account.

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