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Annalen der Physik

Quasiparticles in transition metals with strong local correlations: band formation and collective effects

N. Grewe

Published Aug 18, 2005• 0 citations
Publisher

Abstract

Abstract Dedicated to Bernhard Mühlschlegel on the occasion of his 80th birthday We address the question, whether low lying one‐particle excitations in the Fermi‐liquid phase of highly correlated electron systems can form well defined bands of nearly stable quasiparticles, and comment on features of a universal band picture for these systems. We outline how to derive a description of instabilities to magnetic, charged ordered or superconducting phases, which bears a close analogy to Stoner theory and lends itself to an interpretation in terms of quasiparticle bands and residual interactions at low temperatures. Concepts and problems are illustrated via calculations for some standard models of solid‐state theory using modern many‐body techniques like NRG, NCA and DMFT. Differences to conventional band structure theory are pointed out. We shortly comment on the relevance of these questions to the physics of inhomogeneous systems and small particles.

DOI
10.1002/andp.200551709-1009

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Abstract Dedicated to Bernhard Mühlschlegel on the occasion of his 80th birthday We address the question, whether low lying one‐particle excitations in the Fermi‐liquid phase of highly correlated electron systems can form well defined bands of nearly stable quasiparticles, and comment on features of a universal band picture for these systems. We outline how to derive a description of instabilities to magnetic, charged ordered or superconducting phases, which bears a close analogy to Stoner theory and lends itself to an interpretation in terms of quasiparticle bands and residual interactions at low temperatures. Concepts and problems are illustrated via calculations for some standard models of solid‐state theory using modern many‐body techniques like NRG, NCA and DMFT. Differences to conventional band structure theory are pointed out. We shortly comment on the relevance of these questions to the physics of inhomogeneous systems and small particles.
Strongly correlated electron systems show a rich variety of interesting physical phenomena. However, their theoretical description poses a highly non-trivial task, and even the simplest models cannot be solved exactly. In this thesis the intricate behavior of the single impurity Anderson model (SIAM) and the Hubbard model is investigated. The main emphasis is laid on two-particle Green functions of these systems. To this end, existing approximation schemes are extended to be capable of treating susceptibilities as well. The quality and range of applicability of these approximations is discussed in detail. The physical pictures behind the phenomena encountered in these systems are introduced. A prominent many-body effect is the emergence of temperature dependent low energy quasiparticles in both models. The occurrence of such excitations is a result of the dynamical screening of local magnetic moments, a characteristic feature of the Kondo effect. It is argued, that within the presented approximations, the low temperature phase of these models can usually be described as a Fermi liquid. As a counterexample, the Hubbard model is shown to exhibit pronounced non-Fermi liquid behavior in situations, where a van Hove singularity in the non-interacting density of states is found in the vicinity of the Fermi level. The magnetic properties of the Hubbard model are discussed in view of the two archetypical pictures of magnetism: local moment magnetism and itinerant Stoner-magnetism. Critical temperatures for antiferromagnetic, ferromagnetic and incommensurate phase transitions are calculated, and the influence of the lattice structure and frustration is examined. In strongly correlated metallic situations, the complicated competition between Kondo-screening and local moment magnetism can lead to a reentrant behavior of the N\'eel temperature. A direct signature of the Kondo effect in the Hubbard model is found in the dynamic magnetic susceptibility, where a localized collective mode emerges at very low temperatures. It is connected to the breakup of a singlet formed by the local moments with their Kondo-screening cloud, and consequently the excitation energy is of the order of the low energy scale T*.
Many strongly correlated electron systems fall outside the conventional quasiparticle paradigm. Their low-energy fermionic excitations need not be adiabatically connected to the bare electrons or appear as poles of the physical electron single-particle Green's function. This thesis investigates to what extent an effective quasiparticle description can nevertheless survive, and which emergent degrees of freedom provide the appropriate low-energy structure. First, the interaction-driven evolution from a quantum spin Hall insulator to a Mott insulator is studied using the dynamical cluster approximation. Dispersive zeros of the single-particle Green's function emerge near the Mott transition and retain a nontrivial topological character. When symmetry breaking is allowed, a nontopological excitonic insulator is found to intrude between quantum spin Hall and Mott insulators. Encoding both poles and zeros within a low-energy quasiparticle Hamiltonian provides a continuous one-body description of the three phases. On the Mott side, its gap evolution supports interpreting the soft excitonic mode as a bound state of quasiparticle and quasihole excitations tied to the Green's function zeros, rather than to the widely separated Hubbard bands. Second, the intrinsic anomalous Hall conductivity of a topological metal is analyzed within a multiband extension of Landau Fermi-liquid theory. Residual interactions among quasiparticles at the Fermi surface dress the dynamic current vertex and generate corrections to the Berry-curvature contribution obtained from the quasiparticle bands alone. Our result supports recent claims that the correct expressions for topological observables include vertex corrections besides the topological invariants built just upon the Green's function. It also demonstrates that such corrections are naturally accounted for by Landau Fermi-liquid theory. Extracting the relevant ingredients for an effective description of material-relevant correlated systems requires computational tools that remain reliable at low temperatures. To this end, a deterministic strong-coupling impurity solver for dynamical mean-field theory is discussed. By providing static, dynamical, and thermodynamic observables without stochastic sampling, it offers a promising route toward multiorbital and spin-orbit coupled problems where conventional Monte Carlo methods currently struggle. Finally, the auxiliary quasiparticle framework underlying the ghost-Gutzwiller Ansatz is investigated. On a model for correlated quantum spin Hall insulators, we show that the topology of the interacting state is encoded in the auxiliary one-body Hamiltonian. The resulting band-structure reveals topological Hubbard bands whose topological character can be tuned through a finite magnetization. When applied to the single-band t-J model, the same framework yields a fractionalized Fermi liquid (FL*). In this phase, dispersive neutral spinons, with vanishing physical-electron spectral weight, coexist with conventional quasiparticles forming a small hole-like Fermi surface, thus violating Luttinger's theorem. The corresponding temperature--doping phase diagram contains a low-doping FL*, a d-wave superconducting dome, and an overdoped conventional Fermi liquid, thereby reproducing key qualitative features of cuprate phenomenology.
A model of a Fermi liquid with the fermion condensate (FC) is applied to the consideration of quasiparticle excitations in high-temperature superconductors, in their superconducting and normal states. Within our model the appearance of the fermion condensate presents a quantum phase transition that separates the regions of normal and strongly correlated electron liquids. Beyond the phase transition point the quasiparticle system is divided into two subsystems, one containing normal quasiparticles and the other---fermion condensate localized at the Fermi surface and characterized by almost dispersionless single-particle excitations. In the superconducting state the quasiparticle dispersion in systems with FC can be presented by two straight lines, characterized by effective masses MFC∗{M}_{\mathrm{FC}}^{*}MFC∗​ and ML∗,{M}_{L}^{*},ML∗​, respectively, and intersecting near the binding energy, which is of the order of the superconducting gap. This same quasiparticle picture persists in the normal state, thus manifesting itself over a wide range of temperatures as new energy scales. Arguments are presented that fermion systems with FC have features of a ``quantum protectorate'' [R. B. Laughlin and D. Pines, Proc. Natl. Acad. Sci. U.S.A. 97, 28 (2000); P. W. Anderson, cond-mat/0007185 (unpublished); cond-mat/0007287 (unpublished)].
New insights into the strongly correlated Fermi liquid state of the SU(N) infinite-U Hubbard and t-J models are presented in connection to the metallic state of unbroken symmetry of the copper oxide planes. The nature of single particle and collective excitations is analyzed and the Landau Fermi Liquid parameters are derived. The one-particle spectral function in the Hubbard valence band is obtained with both Hubbard and Gutzwiller-like features. A simple interpretation of the large incoherent background is given in terms of a superposition of quasiparticles and a collective mode describing the propagation of a bare hole in a large U system. The spin exchange interactions produce very low lying collective modes describing the propagation of staggered spin chirality which soften at incommensurate wavevectors. The quasiparticles are strongly scattered by the low lying chirality fluctuations resulting in deviations from canonical Fermi liquid behavior at low energy scales. Of the same origin, the quasiparticle self energy is found to be strongly k-dependent. It leads to corrections to the dispersion and enhancement of the quasiparticle lifetime in the hole-like region of the interacting Fermi surface. The combined effects are sufficient to produce a sign change in the Hall coefficient evaluated for parameters relevant to the copper oxide planes. We show that these models also exhibit a zero temperature fluctuation driven transition from Fermi liquid to non Fermi liquid phase without the onset of magnetic ordering below a critical doping δc=1/4N, whereby providing a microscopic mechanism for the destruction of the Fermi liquid coherence by strong longitudinal gauge fluctuations which represent the effects of the infinite-U constraint.
Abstract The low-temperature properties of a wide range of many-fermion systems spanning metals, quantum gases and liquids to nuclear matter are well understood within the framework of Landau’s theory of Fermi liquids. The low-energy physics of these systems is governed by interacting fermionic quasiparticles with momenta and energies near a Fermi surface in momentum space. Nonequilibrium properties are described by a kinetic equation for the distribution function for quasiparticles proposed by Landau. Quasiparticle interactions with other quasiparticles, phonons, or impurities lead to internal forces acting on a distribution of nonequilibrium quasiparticles, as well as collision processes that ultimately limit the transport of mass, heat, charge, and magnetization, as well as limiting the coherence times of quasiparticles. For Fermi liquids that are close to a second-order phase transition, e.g., Fermi liquids that undergo a superfluid transition, incipient Cooper pairs—long-lived fluctuations of the ordered phase—provide a new channel for scattering quasiparticles, as well as corrections to internal forces acting on the distribution of nonequilibrium quasiparticles. We develop the theory of quasiparticle transport for Fermi liquids in the vicinity of a BCS-type superfluid transition starting from Keldysh’s field theory for nonequilibrium, strongly interacting fermions. The leading corrections to Fermi-liquid theory for nonequilibrium quasiparticle transport near a Cooper instability arise from the virtual emission and absorption of incipient Cooper pairs. Our theory is applicable to quasiparticle transport in superconductors, nuclear matter, and the low-temperature phases of liquid 3He. As an implementation of the theory we calculate the pairing-fluctuation corrections to the attenuation of zero sound in liquid 3He near the superfluid transition and demonstrate quantitative agreement with experimental results.
We use the Kotliar-Ruckenstein slave-boson formalism to study the temperature dependence of paramagnetic phases of the one-band Hubbard model for a variety of band structures. We calculate the Fermi liquid quasiparticle spectral weight ZZZ and identify the temperature at which it decreases significantly to a crossover to a bad metal region. Near the Mott metal-insulator transition, this coherence temperature Tcoh{T}_{\mathrm{coh}}Tcoh​ is much lower than the Fermi temperature of the uncorrelated Fermi gas, as is observed in a broad range of strongly correlated electron materials. After a proper rescaling of temperature and interaction, we find a universal behavior that is independent of the band structure of the system. We obtain the temperature-interaction phase diagram as function of doping, and we compare the temperature dependence of the double occupancy, entropy, and charge compressibility with previous results obtained with dynamical mean-field theory. We analyze the stability of the method by calculating the charge compressibility.