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arXiv:1007.4387

Spin-Dependent Correlations of Fermi Liquids at Nonzero Temperatures within Correlated Density-Matrix Approach

Mohammed Serhan

Published Jul 26, 2010• 0 citations
arXivHTMLPDF

Abstract

Correlated density matrix theory is generalized to investigate equilibrium properties of normal Fermi Liquids such as 3He and nuclear matter at nonzero temperatures. The results also generalize the Fermi-hypernetted-chain technique that is familiar from studies of the ground state of correlated fermions. By employing the concept of renormalized bosons and fermions the formal results are cast in a form that permits the direct evaluation of the statistical properties of the correlated liquid such as the entropy and the specific heat at constant volume among other quantities.

DOI
10.48550/arxiv.1007.4387

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Correlated density matrix theory is generalized to investigate equilibrium properties of normal Fermi Liquids such as 3He and nuclear matter at nonzero temperatures. The results also generalize the Fermi-hypernetted-chain technique that is familiar from studies of the ground state of correlated fermions. By employing the concept of renormalized bosons and fermions the formal results are cast in a form that permits the direct evaluation of the statistical properties of the correlated liquid such as the entropy and the specific heat at constant volume among other quantities.
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"A theory is developed to allow the systematic calculation of the properties of quantum fluids given the microscopic two-body potential. Physical arguments are used to construct a correlation operator that approximately transforms the states of a non-interacting system into the corresponding states of the interacting-system. The theory can be regarded as a microscopic realization of Landau's assumption of a one-to-one correspondence between the non-interacting and interacting states. It is variational since the correlation operator is determined by minimizing E(p) the expectation value of the ground-state energy. We first give a survey of various other many-body theories including the simpler Jastrow variational method. Differential equations are derived to calculate the correlation operator and the related Jastrow correlation"" function. A comparison of results in several Bose systems with various methods is given. The Fermi hypernetted chain integral equations are generalized to allow the calculation of E(p) in Fermi systems, using the correlation operator wave function. The method is applied to liquid 3He and the v2-model of nuclear matter. In 3He the correlation operator gives results in much closer agreement with experiment than that with the Jastrow wave function. A new set of hypernetted chain equations are then derived to allow the calculation of the excited st;ate energies in Bose systems. The theory is then applied to the calculation of the single quasi-particle excitation spectrum of liquid 4He. The spectrum is found to be a stringent test on the form of the correlation operator, deficiencies in the correlation operator giving corresponding errors in the spectrum. Good results are obtained for the density dependence of the roton energy. A variational principle for the free energy is used to generalize the correlation operator technique to finite temperatures. Results are given for the finite temperature properties of the v8-model of nuclear matter."
The methods employed in the previous papers of this series for the ground-state energy of a normal Fermion system are extended to finite temperatures. The basic assumption is that the density matrix of the actual system in thermodynamic equilibrium can be derived by adiabatic transformation from the density matrix of system of noninteracting particles at the same temperature, volume, and chemical potential. However, the spectrum of the noninteracting system must be dependent on the intensive parameters. The self-consistency of the scheme is exhibited by demonstrating that the effective potential characterizing this system can be related to the self-energy operator of the actual system. Two equivalent versions of the theory are derived. In one of these the basic equations are precisely those of the Landau theory of Fermi liquids with the difference, however, that all quantities are given explicitly from first principles.
We summarize recent theoretical results of our group concerning the electronic states of the strongly correlated fermions at nonzero temperature. The state of almost localized fermions is discussed within a mean-field approach for auxiliary bosons, both in the narrow-band (Section 2) and in the hybridized band (Section 3) cases. This state represents a metallic state of correlated fermion systems (such as V{sub 2}O{sub 3}) below the Mott-Hubbard localization threshold. The Fermi liquid state does not describe properly the properties of narrow band electrons in the large Hubbard -- U limit beyond the localization threshold. Therefore, in Section 4 and 5 we introduce a phenomenological concept of statistical spin liquid which describes principal features of a crossover from a high-temperature superconductor to the Mott insulator for a two-dimensional system. It also reproduces the main features of the phase diagram for La{sub 2-x}Sr{sub x}CuO{sub 4} system, which is modelled by a planar structure.
The finite-temperature properties of Bose quantum fluids are studied by applying a variational density-matrix approach. Our ansatz for the density matrix is similar to that introduced by Campbell, K\"urten, Ristig, and Senger [Phys. Rev. 30, 3728 (1984)] but has been generalized to include three-body correlations. An expression for the finite-temperature elementary-excitation energy, \ensuremath{\epsilon}(k), is derived from an ansatz for the variational entropy. At zero temperature \ensuremath{\epsilon}(k) reduces to the same expression obtained by Brillouin-Wigner perturbation theory. The hypernetted-chain (HNC) equations provide the relations between the n-particle distribution functions and the correlation functions. A substantial set of elementary diagrams have been included to minimize the loss of precision associated with the HNC approximation. We report values for the static structure function, radial distribution function, excitation energies, particle-hole interaction, Helmholtz free energy, entropy, and isothermal sound velocity. We present a detailed study of the spectra, three-body correlations, and elementary diagram dependence of the thermodynamic spinodal curve. For relevant densities, we find that three-body correlations tend to increase the liquid-gas critical temperature Tc{\mathit{T}}_{\mathit{c}}Tc​ while adding elementary diagrams tends to reduce Tc{\mathit{T}}_{\mathit{c}}Tc​. Including multiphonon terms in the spectrum produces several features in the variational entropy that were not observed at the Feynman level of excitations. Entropy isotherms show a rather abrupt transition from a low-density regime, where multiphonon contributions are insignificant, to a high-density regime where the isotherms are strongly influenced by multiphonon scattering processes.
We study the temperature dependence of various spatial correlation functions of normal fluid and liquid 4He^{4}\text{H}\text{e}4He along an isochoric line of particle number density $\ensuremath{\varrho}=0.02185\text{ }{\text{\AA{}}}^{\ensuremath{-}3}$. The formal and numerical investigation employs correlated density-matrix theory as currently developed. The formalism permits a clear analysis of particle exchange (statistical) effects and so-called direct-direct quantum effects that appear only in a many-body system of interacting particles. At supercritical temperatures $T\ensuremath{\ge}12\text{ }\text{K}$ the helium fluid can be characterized as a perfect quantum Boltzmann system. In such a fluid, quantum statistical correlations are absent and the particle exchange follows classical Boltzmann statistics despite direct-direct quantum effects being present. At temperatures below 12 K, statistical quantum correlations begin to appear and are largest at the Bose-Einstein transition temperature TBE=2.17 K{T}_{\text{BE}}=2.17\text{ }\text{K}TBE​=2.17 K. However, these correlations are considerably smaller than the statistical exchange correlations existing in a free Bose gas of bosons with helium mass. We present analytical and numerical results on the radial distribution function, the exchange correlation function, the phase-phase correlation function, the one-body reduced density matrix, and gross thermal quantities such as specific heat and total exchange energy. The role of particle exchange in determining their quantum properties is analyzed and discussed in detail.