The degrees of freedom that confer to strongly correlated systems their many intriguing properties also render them fairly intractable through typical perturbative treatments. For this reason, the mechanisms responsible for these technologically promising properties remain mostly elusive. Computational approaches have played a major role in efforts to fill this void. In particular, dynamical mean field theory (DMFT) and its cluster extension, the dynamical cluster approximation (DCA) have allowed significant progress. However, despite all the insightful results of these embedding schemes, computational constraints, such as the minus sign problem in Quantum Monte Carlo (QMC), and the exponential growth of the Hilbert space in exact diagonalization (ED) methods, still limit the length scale within which correlations can be treated exactly in the formalism. A recent advance to overcome these difficulties is the development of multiscale many body approaches whereby this challenge is addressed by introducing an intermediate length scale between the short length scale where correlations are treated exactly using a cluster solver such QMC or ED, and the long length scale where correlations are treated in a mean field manner. At this intermediate length scale correlations can be treated perturbatively. This is the essence of multiscale many-body methods. We will review various implementations of these multiscale many-body approaches, the results they have produced, and the outstanding challenges that should be addressed for further advances.
Modern extensions of density functional theory such as the density functional theory plus U and the density functional theory plus dynamical mean-field theory require choices, including selection of variable (charge vs spin density) for the density functional and specification of the correlated subspace. This paper examines these issues in the context of the "plus U" extensions of density functional theory, in which additional correlations on specified correlated orbitals are treated using a Hartree-Fock approximation. Differences between using charge-only or spin-density-dependent exchange-co…
Previous theoretical investigations of colossal magnetoresistance (CMR) materials explain this effect using a ``clustered'' state with preformed ferromagnetic islands that rapidly align their moments with increasing external magnetic fields. While qualitatively successful, explicit calculations indicate drastically different typical resistivity values in two- and three-dimensional lattices, contrary to experimental observations. This conceptual bottleneck in the phase-separated CMR scenario is resolved here considering the cooperative nature of the Mn-oxide lattice distortions. This induces po…
Starting from the (Hubbard) model of an atom, we demonstrate that the uniqueness of the mapping from the interacting to the noninteracting Green's function, $G\to G_0$, is strongly violated, by providing numerous explicit examples of different $G_0$ leading to the same physical $G$. We argue that there are indeed infinitely many such $G_0$, with numerous crossings with the physical solution. We show that this rich functional structure is directly related to the divergence of certain classes of (irreducible vertex) diagrams, with important consequences for traditional many-body physics based on…
A two-particle self-consistency is rarely part of mean-field theories. It is, however, essential for avoiding spurious critical transitions and unphysical behavior. We present a general scheme for constructing analytically controllable approximations with self-consistent equations for the two-particle vertices based on the parquet equations. We explain in detail how to reduce the full set of parquet equations not to miss quantum criticality in strong coupling. We further introduce a decoupling of convolutions of the dynamical variables in the Bethe-Salpeter equations to make them analytically …
The dual fermion method is a multiscale approach for solving lattice problems of interacting strongly correlated systems. In this paper, we present the \texttt{opendf} code, an open-source implementation of the dual fermion method applicable to fermionic single-orbital lattice models in dimensions $D=1,2,3$ and $4$. The method is built on a dynamical mean field starting point, which neglects all local correlations, and perturbatively adds spatial correlations. Our code is distributed as an open-source package under the GNU public license version 2.
The multiorbital Hubbard model is expressed in terms of quantum phase variables (``slave rotors'') conjugate to the local charge, and of auxiliary fermions, providing an economical representation of the Hilbert space of strongly correlated systems. When the phase variables are treated in a local mean-field manner, similar results to the dynamical mean-field theory are obtained, namely a Brinkman-Rice transition at commensurate fillings together with a ``preformed'' Mott gap in the single-particle density of states. The slave- rotor formalism allows to go beyond the local description and take i…
Quantum cluster approaches offer new perspectives to study the complexities of macroscopic correlated fermion systems. These approaches can be understood as generalized mean-field theories. Quantum cluster approaches are non-perturbative and are always in the thermodynamic limit. Their quality can be systematically improved, and they provide complementary information to finite size simulations. They have been studied intensively in recent years and are now well established. After a brief historical review, this article comparatively discusses the nature and advantages of these cluster techniqu…
Recently, we have elucidated the physics of electron fractionalization in strongly interacting electron systems using a $Z_2$ gauge theory formulation. Here we discuss the connection with the earlier U(1) gauge theory approaches based on the slave boson mean field theory. In particular, we identify the relationship between the holons and Spinons of the slave-boson theory and the true physical excitations of the fractionalized phases that are readily described in the $Z_2$ approach.
We introduce perturbation and coupled-cluster theories based on a cluster mean-field reference for describing the ground state of strongly-correlated spin systems. In cluster mean-field, the ground state wavefunction is written as a simple tensor product of optimized cluster states. The cluster language and the mean-field nature of the ansatz allows for a straightforward improvement which uses perturbation theory and coupled-cluster to account for inter-cluster correlations. We present benchmark calculations on the 1D chain and 2D square $J_1-J_2$ Heisenberg model, using cluster mean-field, pe…
Consistent gauge theories for the slave particle representation of the strongly correlated $t$-$J$ model
College of Science, University of Shanghai for Science and Technology（上海理工大学理学院）；Institute of Theoretical Physics, Chinese Academy of Science（中国科学院理论物理研究所）；Department of Physics, Fudan University（复旦大学物理系）；Department of Physics, Institute of Solid State Physics and Center for Computational Sciences, Sichuan Normal University（四川师范大学物理系、固体物理研究所及计算科学中心）
Recent breakthroughs in the creation of ultra-cold atomic gases in the laboratory have ushered in major changes in physical science. Many novel experiments are now possible, with an unprecedented control of interaction, geometry and purity. Quantum many-body theory is facing severe challenges in quantitatively understanding new experimental results. Here, we review some recently developed theoretical techniques that provide successful predictions for density response of a strongly correlated atomic Fermi gas. These include the strong-coupling random-phase approximation theory, high-temperature…
We show that ultra-cold atoms with synthetic spin-orbit coupling in Raman lattices can be used as versatile quantum simulators to explore the connections between correlated Chern insulators and strongly-coupled four-Fermi field theories related to the Gross-Neveu model in (2+1) dimensions. Exploiting this multidisciplinary perspective, we identify a large-$N$ quantum anomalous Hall (QAH) effect in absence of any external magnetic field, and use it to delimit regions in parameter space where these correlated topological phases appear, the boundaries of which are controlled by strongly-coupled f…
The cost of the exact solution of the many-electron problem is believed to be exponential in the number of degrees of freedom, necessitating approximations that are controlled and accurate but numerically tractable. In this paper, we show that one of these approximations, the self-energy embedding theory (SEET), is derivable from a universal functional and therefore implicitly satisfies conservation laws and thermodynamic consistency. We also show how other approximations, such as the dynamical mean field theory (DMFT) and its combinations with many-body perturbation theory, can be understood …
Microscopically conserving reduced models of many-body systems have a long, highly successful history. Established theories of this type are the random-phase approximation for Coulomb fluids and the particle-particle ladder model for nuclear matter. There are also more physically comprehensive approximations such as the induced-interaction and parquet theories. Notwithstanding their explanatory power, some theories have lacked an explicit Hamiltonian from which all significant system properties, static and dynamic, emerge canonically. This absence can complicate evaluation of the conserving su…
We construct an effective topological Landau-Ginzburg theory that describes general SU(2) incompressible quantum liquids of strongly correlated particles in two spatial dimensions. This theory characterizes the fractionalization of quasiparticle quantum numbers and statistics in relation to the topological ground-state symmetries, and generalizes the Chern-Simons, BF and hierarchical effective gauge theories to an arbitrary representation of the SU(2) symmetry group. Our main focus are fractional topological insulators with time-reversal symmetry, which are treated as generalizations of the SU…
The present paper reviews recent achievements on the ab initio determination of effective model Hamiltonians aimed at the description of strongly correlated materials. These models (Heisenberg, $t-J$, extended Hubbard, Kondo, etc) are crucial to solid state physicists for the description and understanding of the electronic remarkable properties such as magnetic orders, photo-induced magnetism, transport properties, high $t\_c$ super conductivity, etc. We will see how the association and the control of embedding techniques, fragment spectroscopy, effective or intermediate Hamiltonian theories, …
In materials with strong local Coulomb interactions, simple defects such as atomic substitutions strongly affect both macroscopic and local properties of the system. A nonmagnetic impurity, for instance, is seen to induce magnetism nearby. Even without disorder, models of such correlated systems are generally not soluble in 2 or 3 dimensions, and so few exact results are known for the properties of such impurities. Nevertheless, some simple physical ideas have emerged from experiments and approximate theories. Here, we first review what we can learn about this problem from 1D antiferromagnetic…
The Multiscale Entanglement Renormalization Ansatz (MERA) is a tensor network based variational ansatz that is capable of capturing many of the key physical properties of strongly correlated ground states such as criticality and topological order. MERA also shares many deep relationships with the AdS/CFT (gauge-gravity) correspondence by realizing a UV complete holographic duality within the tensor networks framework. Motivated by this, we have re-purposed the MERA tensor network as an analysis tool to study the real-time evolution of the 1D transverse Ising model in its low energy excited sta…
A fermionic operator circuit is a product of fermionic operators of usually different and partially overlapping support. Further elements of fermionic operator circuits (FOCs) are partial traces and partial projections. The presented framework allows for the introduction of fermionic versions of known qudit operator circuits (QUOC), important for the simulation of strongly correlated d-dimensional systems: The multiscale entanglement renormalization ansatz (MERA), tree tensor networks (TTN), projected entangled pair states (PEPS), or their infinite-size versions (iPEPS etc.). After the definit…
Strongly correlated quantum solids are characterized by an inherently granular electronic fabric, with spatial patterns that can span multiple length scales in proximity to a critical point. Here, we used a resonant magnetic X-ray scattering nanoprobe with sub-100 nm spatial resolution to directly visualize the texture of antiferromagnetic domains in NdNiO$_3$. Surprisingly, our measurements revealed a highly textured magnetic fabric, which is shown to be robust and nonvolatile even after thermal erasure across its ordering ($T_{N\acute{e}el}$) temperature. The scale-free distribution of antif…
We investigate the quantum phase diagram of t-J model on triangular lattice at 1/2 doping with various lattice sizes by using a combination of density matrix renormalization group (DMRG), variational Monte Carlo and quantum field theories. To sharply distinguish different phases, we calculated the symmetry quantum numbers of the ground state wave functions, and the results are further confirmed by studying correlation functions. Our results show there is a first order phase transition from ferromagnetism to d+id superconductivity, with the transition taking place at $J/t=0.4\pm0.2$.
The experimentally observed correlated insulating states and quantum anomalous Hall (QAH) effect in twisted bilayer graphene (TBG) have drawn significant attention. However, up to date, the specific mechanisms of these intriguing phenomena are still open questions. Using a fully unrestricted Hartree-Fock variational method, we have explained the correlated insulating states and QAH effects at various integer fillings of the flat bands in TBG. Our results indicate that states breaking flavor (valley and spin) symmetries are energetically favored at all integer fillings. In particular, the corre…
Many-body theories such as dynamical mean field theory (DMFT) have enabled the description of the electron exchange-correlation interactions that are missing in current density functional theory (DFT) calculations. However, there has been relatively little focus on the wavefunctions from these theories. We present the methodology of the newly developed Elk-TRIQS interface and how to calculate the DFT with DMFT (DFT+DMFT) wavefunctions, which can be used to calculate DFT+DMFT wavefunction dependent quantities. We illustrate this by calculating the electron localized function (ELF) in monolayer …
We study the low temperature transport characteristics of a disordered metal in the presence of electron-electron interactions. We compare Hartree-Fock and dynamical mean field theory (DMFT) calculations to investigate the scattering processes of quasiparticles off the screened disorder potential and show that both the local and non-local (coming from long-ranged Friedel oscillations) contributions to the renormalized disorder potential are suppressed in strongly renormalized Fermi liquids. Our results provide one more example of the power of DMFT to include higher order terms left out by weak…
It is shown how to construct renormalization group flows of quantum field theories in real space, as opposed to the usual Wilsonian approach in momentum space. This is achieved by generalizing the multiscale entanglement renormalization ansatz to continuum theories. The variational class of wavefunctions arising from this RG flow are translation invariant and exhibit an entropy-area law. We illustrate the construction for a free non-relativistic boson model, and argue that the full power of the construction should emerge in the case of interacting theories.
This volume provides a detailed account of bosonization. The first part of the book examines the technical aspects of bosonization including one-dimensional fermions, the Gaussian model, the structure of Hilbert space in conformal theories, Bose-Einstein condensation in two dimensions, non-Abelian bosonization, and the Ising and WZNW models. The second part presents applications of the bosonization technique to realistic models including the Tomonaga-Luttinger liquid, spin liquids in one dimension and the spin-1/2 Heisenberg chain with alternative exchange. The third part addresses the problem…
Topological order in strongly correlated systems, including quantum spin liquids, quantum Hall states in lattices and topological superconductivity is treated. Various metallic non-Fermi-liquid states are discussed, including fractionalized Fermi-liquid (FL$^*$) and phase string theories. Classification of topological states and differences between quantum and classical topology are considered.
The electronic structure, magnetic moment, and volume collapse of MnO under pressure are obtained from four different correlated band theory methods; local density approximation + Hubbard U (LDA+U), pseudopotential self-interaction correction (pseudo-SIC), the hybrid functional (combined local exchange plus Hartree-Fock exchange), and the local spin density SIC (SIC-LSD) method. Each method treats correlation among the five Mn 3d orbitals (per spin), including their hybridization with three O $2p$ orbitals in the valence bands and their changes with pressure. The focus is on comparison of the …
We analyze wave functions constructed as a sum of product of two-electron functions, or as a polynomial of geminals, to investigate their ability to represent the ground state of a strongly correlated few-body system. The known difficulty associated with variational determination of the total energy is overcome by applying a tensor decomposition method called Waring decomposition. Convergence speed of the total energy is compared for various polynomial types. The result provides information bridging between geminal product wave functions and the full-CI in the strongly correlated regime, there…
We study the energy and spatial dependence of the local density of states in a superconductor--correlated-metal--superconductor Josephson junction, where the correlated metal is a non-Fermi liquid (described by the Falicov-Kimball model). Many-body correlations are treated with dynamical mean-field theory, extended to inhomogeneous systems. While quasiclassical theories predict a minigap in the spectrum of a disordered Fermi liquid which is proximity-coupled within a mesoscopic junction, we find that increasing electron correlations destroy any minigap that might be opened in the absence of ma…
Many-body interactions in effective field theories for disordered interacting electrons are considered. It is shown that three-body and higher interaction terms are generated in perturbation theory, and some of the physical consequences of these interactions are discussed. It is shown in particular that they will in general be important for any effects governed by strong-coupling fixed points. This implies that the usual generalized nonlinear sigma-model for disordered electron systems is incomplete, and not suitable for studying strong-coupling effects.
Lattice gauge theories are a powerful language to theoretically describe a variety of strongly correlated systems, including frustrated magnets, high-$T_c$ superconductors, and topological phases. However, in many cases gauge fields couple to gapless matter degrees of freedom and such theories become notoriously difficult to analyze quantitatively. In this paper we study several examples of $\mathbb{Z}_2$ lattice gauge theories with gapless fermions at finite density, in one and two spatial dimensions, that are either exactly soluble or whose solution reduces to that of a known problem. We con…
The discovery of the multiple $H$-$T$ phase diagram of CeRh$_2$As$_2$ offers a new route to designing topological superconductors. Although weak-coupling theories explain the experimental phase diagram qualitatively, a quantitative discrepancy between them has discouraged conclusive interpretation. In this Letter, we thoroughly study the effect of Coulomb interaction and the phase diagrams of locally noncentrosymmetric superconductors. We reveal even-odd parity transition and the enhancement of the parity transition field in strongly correlated superconductors, and an issue of CeRh$_2$As$_2$ i…
The interplay of strong interaction and strong disorder, as contained in the Anderson-Hubbard model, is addressed using two non-perturbative numerical methods: the Lanczos algorithm in the grand canonical ensemble at zero temperature and Quantum Monte Carlo. We find distinctive evidence for a zero-energy anomaly which is robust upon variation of doping, disorder and interaction strength. Its similarities to, and differences from, pseudogap formation in other contexts, including perturbative treatments of interactions and disorder, classical theories of localized charges, and in the clean Hubba…
I reexamine the Nayak's criticism [Phys. Rev. Lett. 85, 178 (2000); 86, 943 (2001).] on the U(1) gauge theory approach to the strongly correlated systems. Contrary to his conclusion, the arbitrariness of the charge assignment observed by him does not contradict the possibility of a deconfinement. Should the deconfinement occur, the deconfined slave particle carries an effective fractional charge, which is independent of the arbitrary assignment but is rather determined dynamically.
The two-particle irreducible (2PI) effective action theories are employed to study the strongly fluctuating electron systems, under the formalism of the two-dimensional Hubbard model. We obtain the corresponding quantum 2PI effective action after the original classic action of the Hubbard model is bosonized. In our actual calculations, the 2PI effective action is expanded to three loops, in which the leading order (LO) and next-to-leading order (NLO) quantum fluctuations are included. Numerical calculations indicate that the NLO fluctuations should not be neglected when the Coulomb on-site rep…
Embedding theories became important approaches used for accurate calculations of both molecules and solids. In these theories, a small chosen subset of orbitals is treated with an accurate method, called an impurity solver, capable of describing higher correlation effects. Ideally, such a chosen fragment should contain multiple orbitals responsible for the chemical and physical behavior of the compound. Handing a large number of chosen orbitals presents a very significant challenge for the current generation of solvers used in the physics and chemistry community. Here, we develop a Green's fun…
We present the design of a ring exchange interaction in cold atomic gases subjected to an optical lattice using well understood tools for manipulating and controlling such gases. The strength of this interaction can be tuned independently and describes the correlated hopping of two bosons. We discuss a setup where this coupling term may allows for the realization and observation of exotic quantum phases, including a deconfined insulator described by the Coulomb phase of a three-dimensional U(1) lattice gauge theory.
