arXiv subjects

P. A. Igoshev

Publications and source records attributed to P. A. Igoshev.

25 records · Page 2Linked to original sources

arXiv2015

Magnetic exchange in $α$-iron from the ab initio calculations in the paramagnetic phase

Applying the local density approximation (LDA) and dynamical mean field theory (DMFT) to paramagnetic $α$-iron, we revisit a problem of theoretical description of its magnetic properties. The analysis of local magnetic susceptibility shows that at sufficiently low temperatures $T<1500K$, both, $e_{g}$ and $t_{2g}$ states equally contribute to the formation of the effective magnetic moment with spin S=1. The self-energy of t_{2g} states shows sizable deviations from Fermi-liquid form, which accompanies earlier found non-quasiparticle form of e_{g} states. By considering the non-uniform magnetic susceptibility we find that the non-quasiparticle form of $e_{g}$ states is crucial for obtaining ferromagnetic instability in $α$-iron. The main contribution to the exchange interaction, renormalized by the effects of electron interaction, comes from the hybridization between $t_{2g}$ and $e_{g}$ states. We furthermore suggest the effective spin-fermion model for $α$-iron, which allows us to estimate the exchange interaction from paramagnetic phase, which is in agreement with previous calculations in the ordered state within the LDA approaches.

cond-mat.str-el↗

arXiv2013

Magnetic fluctuations and effective magnetic moments in γ-iron due to electronic structure peculiarities

Applying the local density and dynamical mean field approximations to paramagnetic γ-iron we revisit the problem of theoretical description of magnetic properties in a wide temperature range. We show that contrary to α-iron, the frequency dependence of the electronic self-energy has a quasiparticle form for both, t_{2g} and e_g states. In the temperature range T=1200-1500 K, where γ-iron exist in nature, this substance can be nevertheless characterized by temperature-dependent effective local moments, which yield relatively narrow peaks in the real part of the local magnetic susceptibility. At the same time, at low temperatures γ-iron (which is realized in precipitates) is better described in terms of itinerant picture. In particular, the nesting features of the Fermi surfaces yield maximum of the static magnetic susceptibility at the incommensurate wave vector q_{max} belonging the direction q_X-q_W (q_X=(2π/a)(1,0,0),q_W=(2π/a)(1,1/2,0), a is a lattice parameter) in agreement with the experimental data. This state is found however to compete closely with the states characterized by magnetic wave vectors along the directions q_X-q_L-q_K, where q_L=(2π/a)(1/2,1/2,1/2), q_K=(2π/a)(3/4,3/4,0). From the analysis of the uniform magnetic susceptibility we find that contrary to α-iron, the Curie-Weiss law is not fulfilled in a broad temperature range, although the inverse susceptibility is nearly linear in the moderate-temperature region (1200-1500 K). The non-linearity of the inverse uniform magnetic susceptibility in a broader temperature range is due to the density of states peak located close to the Fermi level. The effective exchange integrals in the paramagnetic phase are estimated on the base of momentum dependent susceptibility.

cond-mat.str-el↗

arXiv2012

Magnetic fluctuations and itinerant ferromagnetism in two-dimensional systems with van Hove singularities

We use the quasistatic approach to analyze the criterion of ferromagnetism for two-dimensional (2D) systems with the Fermi level near Van Hove singularities (VHS) of the electronic spectrum. It is shown that the spectrum of spin excitations (paramagnons) is positively defined when the interaction I between electrons and paramagnons, which corresponds to the Hubbard on-site repulsion U, is sufficiently large. The critical interactions I_c and U_c remain finite at Van Hove filling and exceed considerably their values obtained from the Stoner criterion due to incommensurate spin fluctuations which are important near the ferromagnetic quantum phase transition. Combining the quasistatic approximation and the equation-of -motion method for the Green functions we obtain the results for the electronic self-energy to first order in the inverse number of spin components.

cond-mat.str-el↗

arXiv2011

Ferromagnetism, spiral magnetic structures and phase separation in the two-dimensional Hubbard model

The quasistatic approximation and equation-of-motion decoupling for the electron Green's functions are applied to trace the effect of electronic dispersion and electron correlations on the ferromagnetism of two-dimensional itinerant-electron systems. It is found that next-nearest-neighbor hopping t' is of crucial importance for ferromagnetism formation yielding the magnetic phase diagram which is strongly asymmetric with respect to half-filling. At small t' in the vicinity of half-filling the ferromagnetic phase region is restricted by the spin-density wave instability, and far from half-filling by one-particle (spin-polaron) instability. At t' close to t/2 ferromagnetism is stabilized at moderate Hubbard U due to substantial curvature of the Fermi surface which passes in the vicinity of the van Hove singularity points. The results obtained are of possible importance for high-T_c compounds and layered ruthenates.

cond-mat.str-el↗

arXiv2010

Magnetic fluctuations and self--energy effects in two--dimensional itinerant systems with van Hove singularity of electronic spectrum

We investigate a competition of tendencies towards ferromagnetic and incommensurate order in two-dimensional fermionic systems within functional renormalization group technique using temperature as a scale parameter. We assume that the Fermi surface (FS) is substantially curved, lies in the vicinity of van Hove singularity points and perform an account of the self-energy corrections. It is shown that the character of magnetic fluctuations is strongly asymmetric with respect to the Fermi level position relatively to van Hove singularity (VHS). For the Fermi level above VHS we find at low temperatures dominant incommensurate magnetic fluctuations, while below VHS level we find indications for ferromagnetic ground state. In agreement with the Mermin-Wagner theorem, at finite temperatures and in small magnetic fields we obtain rather small magnetization, which appears to be a power-law function of magnetic field. It is found that the FS curvature is slightly increased by correlation effects, and the renormalized bandwidth decreases at sufficiently low temperatures.

cond-mat.str-el↗

arXiv2009

Incommensurate magnetic order and phase separation in the two-dimensional Hubbard model with nearest and next-nearest neighbor hopping

We consider the ground state magnetic phase diagram of the two-dimensional Hubbard model with nearest and next-nearest neighbor hopping in terms of electronic density and interaction. We treat commensurate ferro- and antiferromagnetic, as well as incommensurate (spiral) magnetic phases. The first-order magnetic transitions with changing chemical potential, resulting in a phase separation (PS) in terms of density, are found between ferromagnetic, antiferromagnetic and spiral magnetic phases. We argue that the account of PS has a dramatic influence on the phase diagram in the vicinity of half-filling. The results imply possible interpretation of the unusual behavior of magnetic properties of one-layer cuprates in terms of PS between collinear and spiral magnetic phases. The relation of the results obtained to the magnetic properties of ruthenates is also discussed.

cond-mat.str-el↗

arXiv2008

Spin fluctuations and ferromagnetic order in two-dimensional itinerant systems with Van Hove singularities

The quasistatic approach is used to analyze the criterion of ferromagnetism for two-dimensional (2D) systems with the Fermi level near Van Hove (VH) singularities of the electron spectrum. It is shown that the spectrum of spin excitations (paramagnons) is positively defined when the interaction between electrons and paramagnons, determined by the Hubbard on-site repulsion U, is sufficiently large. Due to incommensurate spin fluctuations near the ferromagnetic quantum phase transition, the critical interaction Uc remains finite at VH filling and exceeds considerably its value obtained from the Stoner criterion. A comparison with the functional renormalization group results and mean-field approximation which yields a phase separation is also performed.

cond-mat.str-el↗