We explore the dynamics of the three-dimensional compressible Taylor–Green vortex from the perspective of kinetic theory by directly solving the six-dimensional Boltzmann equation. This work studies the connections between molecular-scale information encoded in the high-dimensional distribution function (e.g., molecular entropy measures) and macroscopic turbulent flow characteristics. We present high-order direct numerical simulations at Mach numbers of to and Reynolds numbers of to performed using up to degrees of freedom. The results indicate that the Kullback–Leibler divergence of the distribution function and its local equilibrium state (i.e., the relative entropy functional ) is strongly related to the macroscopic viscous dissipation rate, with the relative entropy value matching the sum of the solenoidal and dilatational dissipation rates very closely across a range of Mach and Reynolds numbers. Furthermore, we present the behavior of subgrid-scale quantities under spatial averaging/filtering operations performed directly on the particle distribution function, which shows notable similarities between the subgrid-scale dissipation and subgrid-scale relative entropy. These observations imply that information encoded in the distribution function, particularly certain measures of its deviation from equilibrium, may be useful for closure-modeling for compressible turbulence.

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