相关论文: On the limitations of cRPA downfolding
The Hartree-Fock approximation to the many-fermion problem can break exact symmetries, and in some cases by changing a parameter in the interaction one can drive the Hartree-Fock minimum from a symmetry-breaking state to a…
We present a new method to obtain interaction part of a model Hamiltonian from the result of the first-principles calculation. The effective interaction contained in the model is determined based on the random phase approximation (RPA). In…
Renormalization group methods are used to study the low-energy behavior of the unscreened Coulomb interaction in a one-dimensional electron system. By applying a GW approximation, a strong wavefunction renormalization is found in the model,…
We present a real-space method for computing the random phase approximation (RPA) correlation energy within Kohn-Sham density functional theory, leveraging the low-rank nature of the frequency-dependent density response operator. In…
The one-dimensional Hubbard model with different on-site interactions is investigated by renormalization group technique. In the case of a 1/4-filled band the dynamical nonequivalence of sites leads to the appearance of Umklapp processes in…
The Hubbard model is the simplest model that is believed to exhibit superconductivity arising from purely repulsive interactions, and has been extensively applied to explore a variety of unconventional superconducting systems. Here we study…
We analyze the one-dimensional (1D) and the two-dimensional (2D) repulsive Hubbard models (HM) for densities slightly away from half-filling through the behavior of two central quantities of a system: the uniform charge and spin…
Within the infinite series of ring (or bubble) diagram approximation for the electronic self-energy as appropriate for the long-range Coulomb interaction, we calculate the density-dependent T=0 Fermi liquid quasiparticle effective mass…
The particle-particle random phase approximation (pp-RPA) has been shown to be capable of describing double, Rydberg, and charge transfer excitations, for which the conventional time-dependent density functional theory (TDDFT) might not be…
This work investigates a d-p Hubbard model by the n-pole approximation in the hole-doped regime. In particular, the spectral function $A(\omega,\vec{k})$ is analyzed varying the filling, the local Coulomb interaction and the $d-p$…
The perturbation expansion for a general class of many-fermion systems with a non-nested, non-spherical Fermi surface is renormalized to all orders. In the limit as the infrared cutoff is removed, the counterterms converge to a finite limit…
We develop and test efficient approximations to estimate ground state correlations associated with low- and zero-energy modes. The scheme is an extension of the generator-coordinate-method (GCM) within Gaussian overlap approximation (GOA).…
We present a first-principles method for deriving effective low-energy models of electrons in solids having entangled band structure. The procedure starts with dividing the Hilbert space into two subspaces, the low-energy part ("$d$…
We explore different variants of the random phase approximation (RPA) to the correlation energy derived from closed-shell ring-diagram approximations to coupled cluster doubles theory. We implement these variants in range-separated…
The random phase approximation (RPA) for the correlation energy functional of density functional theory has recently attracted renewed interest. Formulated in terms of the Kohn-Sham (KS) orbitals and eigenvalues, it promises to resolve some…
This work provides the first combined analysis of low-energy p$\Lambda$ scattering, considering both cross section and correlation data. The obtained results establish the most stringent constraints to date on the two-body p$\Lambda$…
In this work, we address the question of calculating the local effective Coulomb interaction matrix in materials with strong electronic Coulomb interactions from first principles. To this purpose, we implement the constrained random phase…
The RPA long range correlations are known to play a significant role in understanding the depletion of single particle-hole states observed in (e, e') and (e, e'p) measurements. Here the Random Phase Approximation (RPA) theory, implemented…
Effects of randomness on interacting fermionic systems in one dimension are investigated by quantum Monte-Carlo techniques. At first, interacting spinless fermions are studied whose ground state shows charge ordering. Quantum phase…
Kernel methods are powerful learning methodologies that allow to perform non-linear data analysis. Despite their popularity, they suffer from poor scalability in big data scenarios. Various approximation methods, including random feature…