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The European Physical Journal B

On quantum statistical variational principles

P. D�rre, H. Haug, M. Heise, Rainer J. Jelitto

Published Mar 1, 1979• 3 citations
Publisher
DOI
10.1007/bf01362785

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The density matrix of von Neumann can be used to formulate an exact variational principle for quantum statistics which embodies the principle of maximization of entropy. Using the formalism of second quantization, we can write this variational principle for fermions or bosons and can then derive from it an approximate variational procedure which yields the particle states of a system of interacting bosons or fermions as well as the distribution of particles in these states. These equations yield the generalization of the Hartree-Fock equations for nonzero temperature and the corresponding extension to bosons.
In the present paper, a generalization of the method of partial summation of the expansion of the thermodynamical potential is proposed. This generalization allows one to obtain the corresponding equations for higher-order correlation matrices, as well as to formulate the variational method for their solution. We show that correlation matrices of equilibrium quantum system satisfy a variational principle for thermodynamic potential which is functional of these matrices that provides a thermodynamic consistency of the theory. This result is similar to a variational principle for correlation functions of classical systems.