Violation of the Equipartition Theorem for Thermally Insulated Clusters of Atoms with Different Masses

Details Violation of the Equipartition Theorem for Thermally Insulated Clusters of Atoms with Different Masses Violation of the Equipartition Theorem for Thermally Insulated Clusters of Atoms with Different Masses

2008-04-23

arxiv.org/abs/0804.3692v1

Fiz. Tverd. Tel. (St. Petersburg) 50, 1146 (2008) [Phys. Solid State 50, 1195 (2008)]

Physics

Condensed Matter

Mesoscale and Nanoscale Physics

15 pages, 2 figures

Scientific paper

10.1134/S1063783408060310

An expression is derived for calculating microcanonical-ensemble averages of the kinetic energies of atoms of different types in clusters isolated from the environment. This expression is a natural generalization of the solution to the problem of hard spheres with different masses to a system with a many-particle interatomic interaction potential. The dynamics of a C8H8 cubane is simulated numerically. The data on the numerical simulation confirm the validity of the results obtained.

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