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The classical virial theorem (microcanonical derivation)

Consider a system with Hamiltonian tex2html_wrap_inline484 . Let tex2html_wrap_inline486 and tex2html_wrap_inline488 be specific components of the phase space vector. The classical virial theorem states that

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where the average is taken with respect to a microcanonical ensemble.

To prove the theorem, start with the definition of the average:

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where the fact that tex2html_wrap_inline490 has been used. Also, the N and V dependence of the partition function have been suppressed. Note that the above average can be written as

eqnarray29

However, writing

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allows the average to be expressed as

eqnarray48

The first integral in the brackets is obtained by integrating the total derivative with respect to tex2html_wrap_inline488 over the phase space variable tex2html_wrap_inline488 . This leaves an integral that must be performed over all other variables at the boundary of phase space where H=E, as indicated by the surface element tex2html_wrap_inline502 . But the integrand involves the factor H-E, so this integral will vanish. This leaves:

eqnarray61

where tex2html_wrap_inline506 is the partition function of the uniform ensemble. Recalling that

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we have

eqnarray73

which proves the theorem.

Example: tex2html_wrap_inline508 and i=j. The virial theorem says that

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Thus, at equilibrium, the kinetic energy of each particle must be kT/2. By summing both sides over all the particles, we obtain a well know result

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Mark Tuckerman
Sun Feb 4 23:25:26 EST 2001