相关论文: Spin-constrained Hartree-Fock and the generator co…
A microscopic derivation of the classical Generalized Constant Coupling (GCC) model for geometrically frustrated magnets is presented. Starting from the classical Heisenberg Hamiltonian, the partition function for clusters with p = 2, 3, 4…
The two-site two-electron Holstein model is studied within a perturbation method based on a variational phonon basis obtained through the modified Lang-Firsov (MLF) transformation. The ground-state wave function and the energy are found out…
The ground-state phase diagrams of the three-orbital t2g Hubbard model are studied using a Hartree-Fock approximation. First, a complete set of multipolar order parameters for t2g models defined in terms of the effective total angular…
In this paper, we present details of the dual fermion (DF) method to study the non-local correction to single site DMFT. The DMFT two-particle Green's function is calculated using continuous time quantum monte carlo (CT-QMC) method. The…
The magnetic Hartree Fock ground state stability for a two-dimensional interacting electron system with Rashba-type coupling is studied by implementing the standard many body Green's function formalism. The externally applied electrical…
We investigate several spin-related phenomena in a confined two-dimensional electron gas (2DEG) using the Hartree-Fock approximation for the mutual Coulomb interaction of the electrons. The exchange term of the interaction causes a large…
We use the coupled cluster method (CCM) to study the ground-state properties and lowest-lying triplet excited state of the spin-half {\it XXZ} antiferromagnet on the square lattice. The CCM is applied to it to high orders of approximation…
We propose two different schemes for second-order perturbation theory with spin-projected Hartree-Fock. Both schemes employ the same ansatz for the first-order wave function, which is a linear combination of spin-projected configurations.…
The effect of the spin-orbit coupling on the ground state properties of the square-lattice three-band Hubbard model with a single electron per site is studied by a generalized Hartree-Fock approximation. We calculate the full phase diagram…
We employ the cluster slave-spin method to investigate systematically the ground state properties of the Hubbard model on a square lattice with doping $\delta$ and coupling strength $U$ being its parameters. In addition to a crossover…
The fermionic and bosonic sectors of the 2-site Hubbard model have been exactly solved by means of the equation of motion and Green's function formalism. The exact solution of the t-J model has been also reported to investigate the…
We adopt a broken-symmetry strategy for evaluating effective magnetic constants $J$ within the fully self-consistent GW method. To understand the degree of spin contamination present in broken-symmetry periodic solutions, we propose several…
We explore certain properties of the Hartree-Fock approximation to the ground state of the two-dimensional Hubbard model, emphasizing the fact that in the Hartree approach there is an enormous multiplicity of self-consistent solutions which…
We present numerical methods to solve the Generalized Hartree-Fock theory for fermionic systems in lattices, both in thermal equilibrium and out of equilibrium. Specifically, we show how to determine the covariance matrix corresponding to…
We explore magnetic behavior of kagome francisites Cu3Bi(SeO3)2O2X (X = Cl and Br) using first-principles calculations. To this end, we propose an approach based on the Hubbard model in the Wannier functions basis constructed on the level…
We consider quantum error-correcting subsystem codes whose gauge generators realize a translation-invariant, free-fermion-solvable spin model. In this setting, errors are suppressed by a Hamiltonian whose terms are the gauge generators of…
We study spin fluctuations in the spiral phase of the two-dimensional Hubbard model at low doping on the basis of the spin-particle-hole coherent-state path integral. In the strong correlation limit, we obtain an analytical expression of…
We investigated the electronic and magnetic structure of Sr$_{3-x}$Ca$_x$Ru$_2$O$_7$ ($0 \leq x \leq 3$) on the basis of the double-layered three-dimensional multiband Hubbard model with spin-orbit interaction. In our model, lattice…
Noncollinear magnetic states in clusters are studied by using the single-band Hubbard Hamiltonian. The unrestricted Hartree-Fock (UHF) approximation is considered without imposing any symmetry constraints neither to the size or orientation…
We construct a new mean-field theory for quantum (spin-1/2) Heisenberg antiferromagnet in one (1D) and two (2D) dimensions using a Hartree-Fock decoupling of the four-point correlation functions. We show that the solution to the…