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New Theory of Superconductivity

В. V. Bondarev

Published Jan 1, 2017• 0 citations
Publisher

Abstract

This book contains detailed insights on the calculus of variations that studies the equilibrium density matrix for many-particle Fermi systems. There are two approximations taken into account in the book. The simplest one is the mean field approximation. The second approximation applies not only to the particle distribution pattern but also to the correlation function. The variational principle for electron distribution function among wave vectors has been denoted in the work. The method that makes using the density matrix for finding the valence electron energy in metal has been proposed. It has been proved that the Coulomb interaction of electrons in a crystal lattice results in production of the model Hamiltonian consisting of two components. One component describes attraction of electrons with the equal wave vectors inducing formation of specific electron pairs. The other component describes repulsion of electrons with the wave vectors being equal by size and opposite by direction. This component denotes the anisotropy regarding distribution of electrons among wave vectors thus indicating the superconducting substance ability. The Fermi-Dirac distribution function, as considered together with the model Hamiltonian, explains all the properties exhibited by superconductors. Thus, the effect of a magnetic field on the superconducting states is studied in the book. The book can be interesting for senior schoolchildren, students of higher educational institutions, postgraduates and teachers.

DOI
10.4236/9781618962443

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•Jan 1, 2017•0 citations
This book contains detailed insights on the calculus of variations that studies the equilibrium density matrix for many-particle Fermi systems. There are two approximations taken into account in the book. The simplest one is the mean field approximation. The second approximation applies not only to the particle distribution pattern but also to the correlation function. The variational principle for electron distribution function among wave vectors has been denoted in the work. The method that makes using the density matrix for finding the valence electron energy in metal has been proposed. It has been proved that the Coulomb interaction of electrons in a crystal lattice results in production of the model Hamiltonian consisting of two components. One component describes attraction of electrons with the equal wave vectors inducing formation of specific electron pairs. The other component describes repulsion of electrons with the wave vectors being equal by size and opposite by direction. This component denotes the anisotropy regarding distribution of electrons among wave vectors thus indicating the superconducting substance ability. The Fermi-Dirac distribution function, as considered together with the model Hamiltonian, explains all the properties exhibited by superconductors. Thus, the effect of a magnetic field on the superconducting states is studied in the book. The book can be interesting for senior schoolchildren, students of higher educational institutions, postgraduates and teachers.
A new variational method for studying the equilibrium states of an interacting particles system has been proposed. The statistical description of the system is realized by means of a density matrix. This method is used for description of conduction electrons in metals. An integral equation for the electron distribution function over wave vectors has been obtained. The solutions of this equation have been found for those cases where the single-particle Hamiltonian and the electron interaction Hamiltonian can be approximated by a quite simple expression. It is shown that the distribution function at temperatures below the critical value possesses previously unknown features which allow to explain the superconductivity of metals and presence of a gap in the energy spectrum of superconducting electrons.
Recent progress in the theory and computation of electronic structure is bringing an unprecedented level of capability for research. Many-body methods are becoming essential tools vital for quantitative calculations and understanding materials phenomena in physics, chemistry, materials science and other fields. This book provides a unified exposition of the most-used tools: many-body perturbation theory, dynamical mean field theory and quantum Monte Carlo simulations. Each topic is introduced with a less technical overview for a broad readership, followed by in-depth descriptions and mathematical formulation. Practical guidelines, illustrations and exercises are chosen to enable readers to appreciate the complementary approaches, their relationships, and the advantages and disadvantages of each method. This book is designed for graduate students and researchers who want to use and understand these advanced computational tools, get a broad overview, and acquire a basis for participating in new developments.
We consider an open quantum many-particle system in which there are dissipative processes. The evolution of this system is described by a kinetic equation for the density matrix. From the equation describing a random Markov process in this system, we obtain an equation for the single-particle statistical operator. This equation describes the evolution of a system of identical particles in a mean-field approximation. The equation for interacting particles in thermodynamic equilibrium was obtained. The distribution function of a system of interacting electrons in metals has multivalence in a certain region of wave vectors. Among many solutions one is isotropic. Other solutions have the anisotropy of the electron distribution over the wave vectors. The anisotropy arises as a result of repulsion and attraction between electrons.
Materials with strongly correlated electrons show a multitude of unconventional phenomena, such as superconductivity or magnetism, that cannot be explained in a single-particle picture and necessitate to take many-body effects into account. A route to explain the origin of these phenomena consists in constructing effective models for these materials that are then solved, often using numerical techniques. Paradigmatic models for two different classes of strongly correlated electron systems are investigated in this thesis: The Hubbard model is a paradigmatic model to describe the Mott metal-insulator transition (MIT) and the Kondo lattice model describes the low-energy physics in heavy fermion compounds. Both models are analyzed numerically using different variations of a quantum cluster technique, the variational cluster approximation (VCA). The first part focuses on the MIT, as it is investigated experimentally in quasi-two-dimensional charge-transfer salts. Its nature and associated universality class are still heavily discussed and both experiments and theoretical approaches come to different conclusions. In this thesis, the Mott transition is investigated on an anisotropic two-dimensional Hubbard model at half-filling. By using a control parameter, which induces this anisotropy, strong evidence for Mott quantum criticality is found in weakly coupled Hubbard chains. The results at zero temperature show that the second-order critical end point Tc of the interaction-driven metal-insulator transition can be tuned down to zero at strong anisotropy. Further results for the antiferromagnetic phase suggest a similar picture and motivate adding the anisotropy as a new axis in the phase diagram to account for a low-temperature critical end point of the Mott transition. The second part of this thesis focuses on unconventional phases that emerge in a paradigmatic model for heavy fermion systems, the Kondo lattice model. Using the VCA, the two-dimensional Kondo lattice model is investigated in the paramagnetic phase as well as in phases with broken symmetry. An antiferromagnetic phase at weak coupling and a phase with Kondo-singlet formation at strong coupling are analyzed. Within the antiferromagnetically ordered region, two phases with different Fermi-surface topology, which are separated by a discontinuous transition, are identified. The model is also tested for s-wave superconductivity as found recently using dynamical mean-field theory, but no indications for robust local pairing are seen within VCA. Instead, nodal d-wave superconductivity is found and analyzed in a large range of couplings and electron fillings, and its interplay with antiferromagnetic order at weak coupling is discussed. This motivates further studies on extended models that might allow for a close comparison with experiments on heavy fermion systems. Understanding the formation of unconventional phases in strongly correlated electron systems is not only of fundamental interest, but it is also essential for designing new functional materials. Although the results of approximate cluster techniques have to be handled with care, the new aspects presented in this thesis pave the way for further investigations in this direction.