Comment on "Projective Quantum Monte Carlo Method for the Anderson Impurity Model and its Application to Dynamical Mean Field Theory"
A comment about importance of Anderson's orthogonality catastrophe for projective Quantum Monte Carlo methods.
arXiv subjects
Publications and source records attributed to M. I. Katsnelson.
A comment about importance of Anderson's orthogonality catastrophe for projective Quantum Monte Carlo methods.
There are known two distinct types of the integer quantum Hall effect. One is the conventional quantum Hall effect, characteristic of two-dimensional semiconductor systems, and the other is its relativistic counterpart recently observed in graphene, where charge carriers mimic Dirac fermions characterized by Berry's phase pi, which results in a shifted positions of Hall plateaus. Here we report a third type of the integer quantum Hall effect. Charge carriers in bilayer graphene have a parabolic energy spectrum but are chiral and exhibit Berry's phase 2pi affecting their quantum dynamics. The Landau quantization of these fermions results in plateaus in Hall conductivity at standard integer positions but the last (zero-level) plateau is missing. The zero-level anomaly is accompanied by metallic conductivity in the limit of low concentrations and high magnetic fields, in stark contrast to the conventional, insulating behavior in this regime. The revealed chiral fermions have no known analogues and present an intriguing case for quantum-mechanical studies.
Using Feynman path integral technique estimations of the ground state energy have been found for a conduction electron interacting with order parameter fluctuations near quantum critical points. In some cases only \textit{singular} perturbation theory in the coupling constant emerges for the electron ground state energy. It is shown that an autolocalized state (quantum fluctuon) can be formed and its characteristics have been calculated depending on critical exponents for both weak and strong coupling regimes. The concept of fluctuon is considered also for the classical critical point (at finite temperatures) and the difference between quantum and classical cases has been investigated. It is shown that, whereas the quantum fluctuon energy is connected with a true boundary of the energy spectrum, for classical fluctuon it is just a saddle-point solution for the chemical potential in the exponential density of states fluctuation tail.
Electron-electron correlations affect the band gap of half-metallic ferromagnets by introducing non-quasiparticle states just above the Fermi level. In contrast to the spin-orbit coupling, a large asymmetric non-quasiparticle spectral weight is present in the minority-spin channel, leading to a peculiar finite-temperature spin depolarization effects. Using recently developed first-principle dynamical mean field theory, we investigate these effects for the half-metallic ferrimagnetic Heusler compound FeMnSb. We discuss depolarization effects in terms of strength of local Coulomb interaction $U$ and temperature in FeMnSb. We propose Ni$_{1-x}$Fe$_{x}$MnSb alloys as a perspective materials to be used in spin-valve structures and for experimental search of non-quasiparticle states in half-metallic materials.
Using numerical renormalization group method the temperature dependences of the magnetic susceptibility $χ(T)$ and specific heat $C(T)$ are obtained in the single-impurity Anderson model with inclusion of the $d-f$ Coulomb interaction. It is shown that the exciton effects owing to this interaction can change considerably the dependence $C(T)$ in comparison with the standard Anderson model at not too low temperatures, whereas the dependence $χ(T)$ remains universal. The renormalization of the effective hybridization parameter and $f$-level position, which is connected with the $d-f$ interaction, is calculated, a satisfactory agreement with the Hartree-Fock approximation being derived.
The role of the many-body (spin-polaronic) effects in the scanning tunneling spectroscopy of half-metallic ferromagnets (HMF) is considered. It is shown that the non-quasiparticle (NQP) states exist in the majority or minority spin gap in the presence of arbitrary external potential and, in particular, at the surfaces and interfaces. Energy dependence of the NQP density of states is obtained in various models of HMF, an important role of the hybridization nature of the energy gap being demonstrated. The corresponding temperature dependence of spin polarization is calculated. It is shown that the NQP states result in a sharp bias dependence of the tunneling conductance near zero bias. Asymmetry of the NQP states with respect to the Fermi energy provides an opportunity to separate phonon and magnon peaks in the inelastic spectroscopy by STM.
We show that a spontaneous bending of single layer bolaamphiphiles results from the frustration due to the competition between core-core and tail-solvent interactions. We find that spherical vesicles are stable under rather general assumptions on these interactions described within the Flory-Huggins theory. We consider also the deformation of the vesicles in an external magnetic field that has been recently experimentally observed.
Ab-initio relativistic dynamical mean-field theory is applied to resolve the long-standing controversy between theory and experiment in the "simple" face-centered cubic phase of plutonium called delta-Pu. In agreement with experiment, neither static nor dynamical magnetic moments are predicted. In addition, the quasiparticle density of states reproduces not only the peak close to the Fermi level, which explains the large coefficient of electronic specific heat, but also main 5f features observed in photoelectron spectroscopy.
We report on results of the first realistic electronic structure calculations of the Pu-based PuCoGa5 superconductor based on the dynamical mean field theory. We find that dynamical correlations due to the local Coulomb interaction between Pu f-electrons lead to substantial modification of the electronic structure with a narrow peak being formed in vicinity of the Fermi energy, in agreement with the experimental photoemission spectra, and in contrast with the recent calculations within the LDA+U method, where only static electronic correlations have been included. Both Pu and Co contribute in equal footing to the narrow peak on the density of states at the Fermi level, the Co partial density of states being prominently affected by electronic correlations on the Pu sites. The k-resolved spectral density is calculated and the theoretical spectral function resolved extended Van Hove singularity near the Fermi energy. This singularity may lead to enchancement of the magnetic susceptebility and favour d-wave superconductivity.
Nature of the magnetic hysteresis for thin films is studied by the Monte-Carlo simulations. It is shown that a reconstruction of the magnetization pattern with external field occurs via the creation of vortex-antivortex pairs of a special kind at the boundaries of stripe domains. It is demonstrated that the symmetry of order parameter is of primary importance for this problem, in particular, the in-plane magnetic anisotropy is necessary for the hysteresis.
Electronic properties of materials are commonly described by quasiparticles that behave as non-relativistic electrons with a finite mass and obey the Schroedinger equation. Here we report a condensed matter system where electron transport is essentially governed by the Dirac equation and charge carriers mimic relativistic particles with zero mass and an effective "speed of light" c* ~10^6m/s. Our studies of graphene - a single atomic layer of carbon - have revealed a variety of unusual phenomena characteristic of two-dimensional (2D) Dirac fermions. In particular, we have observed that a) the integer quantum Hall effect in graphene is anomalous in that it occurs at half-integer filling factors; b) graphene's conductivity never falls below a minimum value corresponding to the conductance quantum e^2/h, even when carrier concentrations tend to zero; c) the cyclotron mass m of massless carriers with energy E in graphene is described by equation E =mc*^2; and d) Shubnikov-de Haas oscillations in graphene exhibit a phase shift of pi due to Berry's phase.
The pure Fano-effect in angle-integrated valence-band photo-emission of ferromagnets has been observed for the first time. A contribution of the intrinsic spin polarization to the spin polarization of the photo-electrons has been avoided by an appropriate choice of the experimental parameters. The theoretical description of the resulting spectra reveals a complete analogy to the Fano-effect observed before for paramagnetic transition metals. While the theoretical photo-current and spin difference spectra are found in good quantitative agreement with experiment in the case of Fe and Co only a qualitative agreement could be achieved in the case of Ni by calculations on the basis of plain local spin density approximation (LSDA). Agreement with experimental data could be improved in this case in a very substantial way by a treatment of correlation effects on the basis of dynamical mean field theory (DMFT).
We consider electron self-trapping due to its interaction with order-parameter fluuctuations at the second-order phase-transition or critical point (for example, at the Curie temperature in magnetic or ferroelectric semiconductors). Using Feynman path integral approach the autolocalization energy and the size of the self-trapped state (fluctuon) are estimated. It is shown that the fluctuon states are connected with the Lifshitz tail of the electron density-of-states, the parameters of this tail being determined by the critical exponents.
We demonstrate that decoherence of many-spin systems can drastically differ from decoherence of single-spin systems. The difference originates at the most basic level, being determined by parity of the central system, i.e. by whether the system comprises even or odd number of spin-1/2 entities. Therefore, it is very likely that similar distinction between the central spin systems of even and odd parity is important in many other situations. Our consideration clarifies the physical origin of the unusual two-step decoherence found previously in the two-spin systems.
We analyze the quantum entanglement at the equilibrium in a class of exactly solvable one-dimensional spin models at finite temperatures and identify a region where the quantum fluctuations determine the behavior of the system. We probe the response of the system in this region by studying the spin dynamics after projective measurement of one local spin which leads to the appearance of the ``decoherence wave''. We investigate time-dependent spin correlation functions, the entanglement dynamics, and the fidelity of the quantum information transfer after the measurement.
We consider the real-time dynamics of the Kondo system after the local probe of the charge state of the magnetic impurity. Using the exactly solvable infinite-degeneracy Anderson model we find explicitly the evolution of the impurity charge after the measurement.
Spectra of one-electron and collective excitations in narrow-band ferromagnets with unquenched orbital moments are calculated in various theoretical models. The interaction of spin and orbital excitations with conduction electrons results in the damping of the former which, however, turns out to be rather small; therefore, apart from usual spin waves, well-defined orbitons can exist. Non-quasiparticle states occur in the electron energy spectrum near the Fermi energy due to this interaction. The criteria of stability of the saturated spin and orbital ferromagnetic ordering are considered. Possible effects of orbital ordering in magnetite and in colossal magnetoresistance manganites are discussed.
The Green's functions that determine x-ray spectra are calculated in the s-d exchange model of a saturated conducting ferromagnet in the presence of the core hole. A possibility to observe non-quasiparticle (NQP) states in the core level (x-ray absorption, emission and photoelectron) spectroscopy is demonstrated. It is shown that NQP contributions to resonant x-ray scattering spectra can be considerably enhanced by core hole effects in comparison with those to the density of states.