相关论文: Self-Consistent Separable RPA For Density- and Cur…

We consider several spin-unrestricted random-phase approximation (RPA) variants for calculating correlation energies, with and without range separation, and test them on datasets of atomization energies and reaction barrier heights. We show…

The self-force acting on a (scalar or electric) charge held in place outside a massive body contains information about the body's composition, and can therefore be used as a probe of internal structure. We explore this theme by computing…

We compute the energy functional of a three-level Lipkin model via a Legrendre transform and compare exact numerical results with analytical solutions obtained from the random phase approximation (RPA). Except for the region of the phase…

The Gaussian expansion method (GEM) is extensively applied to the calculations in the random-phase approximation (RPA). We adopt the mass-independent basis-set that has been tested in the mean-field calculations. By comparing the RPA…

We report an improved implementation for evaluating the analytical gradients of the random phase approximation (RPA) electron-correlation energy based on atomic orbitals and the localized resolution of identity scheme. The more efficient…

The random phase approximation (RPA) is exact for the exchange energy of a many-electron ground state, but RPA makes the correlation energy too negative by about 0.5 eV/electron. That large short-range error, which tends to cancel out of…

The random-phase approximation to the ground state correlation energy (RPA) in combination with exact exchange (EX) has brought Kohn-Sham (KS) density functional theory one step closer towards a universal, "general purpose first principles…

We develop a new formulation of the continuum quasiparticle random phase approximation (QRPA) in which the residual interaction is derived directly from the Skyrme energy functional, keeping all the velocity dependent terms of the Skyrme…

We have developed and implemented a self-consistent density functional method using standard norm-conserving pseudopotentials and a flexible, numerical LCAO basis set, which includes multiple-zeta and polarization orbitals. Exchange and…

A popular and efficient discretization of evolutions involving the singular $p$-Laplace operator is based on a factorization of the differential operator into a linear part which is treated implicitly and a regularized singular factor which…

Recurrence quantification analysis (RQA) is a widely used tool for studying complex dynamical systems, but its standard implementation requires computationally expensive calculations of recurrence plots (RPs) and line length histograms.…

A systematic approach for the construction of a density functional for van der Waals interactions that also accounts for saturation effects is described, i.e. one that is applicable at short distances. A very efficient method to calculate…

A few years ago, Kurzweil and Hazak developed the Configurationally Resolved Super-Transition-Arrays (CRSTA) method for the computation of hot-plasma radiative opacity. Their approach, based on a temporal integration, is an important…

By combining the two-particle-irreducible (2PI) effective action common in non-equilibrium quantum field theory with the classical Martin-Siggia-Rose formalism, self-consistent equations of motion for the first and second cumulants of…

In this paper we develop a theoretical framework which allows us to study excitations of the nucleon. Assuming an effective two-body interaction as a model for low-energy QCD, we derive a relativistic TDHF equation for a many-body system of…

This study investigates nuclear responses to two-body external fields, interpreted as double-phonon excitations, within the subtracted second random-phase approximation (SSRPA) for 16O. To clarify the underlying characteristics of these…

Pinched flow fractionation is shown to be an efficient and selective way to quickly separate particles by size in a very polydisperse semi-concentrated suspension. In an effort to optimize the method, we discuss the quantitative influence…

Recently the damping of the collective charge (and spin) modes of interacting fermions in one spatial dimension was studied. It results from the nonlinear correction to the energy dispersion in the vicinity of the Fermi points. To…

We express the optimization of entanglement witnesses for arbitrary bipartite states in terms of a class of convex optimization problems known as Robust Semidefinite Programs (RSDP). We propose, using well known properties of RSDP, several…

Based on the path integral representation of the partition function of a many body system with separable two body interaction we propose a systematic extension of the perturbed static path approximation (PSPA) to lower temperatures.…