Related papers: Multi-band Gutzwiller wave functions for general o…
Multi-band Gutzwiller-correlated wave functions reconcile the contrasting concepts of itinerant band electrons versus electrons localized in partially filled atomic shells. The approximate evaluation of these variational ground states…
Multi-band Gutzwiller-correlated wave functions reconcile the contrasting concepts of itinerant band electrons versus electrons localized in partially filled atomic shells. The exact evaluation of these variational ground states in the…
We present analytic results for ground-state properties of Hubbard-type models in terms of the Gutzwiller variational wave function with non-zero values of the magnetization m. In dimension D=1 approximation-free evaluations are made…
In this work I investigate a two-band Hubbard model using the Gutzwiller wavefunction. The tight-binding part of the model was constructed to have a gapless spin-density wave state which leads to Dirac points in the bandstructure, a common…
We study the Hubbard model with bond-charge interaction (`correlated hopping') in terms of the Gutzwiller wave function. We show how to express the Gutzwiller expectation value of the bond-charge interaction in terms of the correlated…
Laughlin's construction of exact gossamer ground states is applied to normal metals. We show that for each variational parameter 0<=g<=1, the paramagnetic or ferromagnetic Gutzwiller wave function is the exact ground state of an extended…
Ferromagnetic Nickel is the most celebrated iron group metal with pronounced discrepancies between the experimental electronic properties and predictions of density functional theories. In this work, we show in detail that the recently…
We develop a diagrammatic method for the evaluation of general multi-band Gutzwiller wave functions in finite dimensions. Our approach provides a systematic improvement of the widely used Gutzwiller approximation. As a first application we…
We introduce Gutzwiller-correlated wave functions for the variational investigation of general multi-band Hubbard models. We set up a diagrammatic formalism which allows us to evaluate analytically ground-state properties in the limit of…
We analyze the ground-state properties of strongly-correlated electrons coupled with phonons by means of a generalized Gutzwiller wavefunction which includes phononic degrees of freedom. We study in detail the paramagnetic half-filled…
Strongly interacting fermionic systems host a variety of interesting quantum many-body states with exotic excitations. For instance, the interplay of strong interactions and the Pauli exclusion principle can lead to Stoner ferromagnetism,…
The recently proposed diagrammatic expansion (DE) technique for the full Gutzwiller wave function (GWF) is applied to the Anderson lattice model (ALM). This approach allows for a systematic evaluation of the expectation values with GWF in…
Electron correlations in the two-orbital Hubbard model at half-filling are investigated by combining dynamical mean field theory with the exact diagonalization method. We systematically study how the interplay of the intra- and inter-band…
We study the strong coupling limit of a two-band Hubbard Hamiltonian that also includes an inter-orbital on-site repulsive interaction $U_{ab}$. When the two bands have opposite parity and are quarter filled, we prove that the ground state…
Ground state properties of the spin$-1/2$ Falicov-Kimball model on a triangular lattice in the presence of uniform external magnetic field are explored. Both the orbital and the Zeeman field-induced effects are taken into account and in…
We use the Gutzwiller Density Functional Theory to calculate ground-state properties and bandstructures of iron in its body-centered-cubic (bcc) and hexagonal-close-packed (hcp) phases. For a Hubbard interaction $U=9\, {\rm eV}$ and…
Strongly correlated materials feature multiple electronic orbitals which are crucial to accurately understand their many-body properties, from cuprate materials to twisted bilayer graphene. In such multi-band models, quantum interference…
We propose a new mechanism which can lead to ferromagnetism in Hubbard models containing triangles with different on-site energies. It is based on an effective Hamiltonian that we derive in the strong coupling limit. Considering a…
It is believed that strong ferromagnetic orders in some solids are generated by subtle interplay between quantum many-body effects and spin-independent Coulomb interactions between electrons. Here we describe our rigorous and constructive…
Understanding the effects of electron-electron interactions in half metallic magnets (HMs), which have band structures with one gapped spin channel and one metallic channel, poses fundamental theoretical issues as well as having importance…