Related papers: Efficient Random Phase Approximation for Diradical…
The Hipparcos catalog and its Double and Multiple System Annex (DMSA) lists 4099 components with individual proper motions and coordinates on the epoch 1991.25. Many of these long-period binary stars are also present in the Gaia Data…
We present a theoretical model and numerical optimization of double Bragg diffraction, a widely used technique in atom interferometry. We derive an effective two-level-system Hamiltonian based on the Magnus expansion in the so-called…
Range-separated methods combining a short-range density functional with long-range random phase approximations RPAs with or without exchange response kernel are tested on rare-gas dimers and the S22 benchmark set of weakly interacting…
A two-phonon version of the relativistic quasiparticle time blocking approximation (RQTBA-2) represents a new class of many-body models for nuclear structure calculations based on the covariant energy density functional. As a fully…
The effects of ground-state correlations on the magnetic dipole excitations in $^{40}$Ca are studied using an extended random phase approximation (ERPA) derived from the time-dependent density-matrix theory. Comparison is made with other…
We evaluate the stopping and image forces on a charged particle moving parallel to a doped sheet of graphene by using the dielectric response formalism for graphene's $\pi$-electron bands in the random phase approximation (RPA). The forces…
We perform a self-consistent relativistic QRPA (RQRPA) calculation of $2\nu\b\b$-decay based on relativistic BCS (RBCS) mean field theory results for odd-odd intermediate nuclei $^{48}$Sc, $^{76}$As, $^{82}$Br, $^{100}$Tc, $^{128}$I, and…
We propose a practical method to solve the random-phase approximation (RPA) in the self-consistent Hartree-Fock (HF) and density-functional theory. The method is based on numerical evaluation of the residual interactions utilizing finite…
Self-consistent relativistic random-phase approximation (RPA) in the radial coordinate representation is established by using the finite amplitude method (FAM). Taking the isoscalar giant monopole resonance in spherical nuclei as example,…
To address the impact of electron correlations in the linear and non-linear response regimes of interacting many-electron systems exposed to time-dependent external fields, we study one-dimensional (1D) systems where the interacting problem…
Kohn-Sham density functional theory (DFT) is the standard method for first-principles calculations in computational chemistry and materials science. More accurate theories such as the random-phase approximation (RPA) are limited in…
The finite basis set errors for all-electron random-phase approximation (RPA) correlation energy calculations are analyzed for isolated atomic systems. We show that, within the resolution-of-identity (RI) RPA framework, the major source of…
The fully self-consistent Random Phase Approximation (RPA) is constructed within the Unitary Correlation Operator Method (UCOM), which describes the dominant interaction-induced short-range central and tensor correlations by a unitary…
For revDSD double hybrids, the G\"orling-Levy second-order perturbation theory component is an Achilles' Heel when applied to systems with significant near-degeneracy ("static") correlation. We have explored its replacement by the direct…
We have evaluated hyperfine-induced electron spin dynamics for two electrons confined to a double quantum dot. Our quantum solution accounts for decay of a singlet-triplet correlator even in the presence of a fully static nuclear spin…
Pair atomic density fitting (PADF) is a promising strategy to reduce the scaling with system size of quantum chemical methods for the calculation of the correlation energy like the direct random phase approximation (RPA) or second-order…
Most nonrelativistic electron correlation methods can be adapted to account for relativistic effects, as long as the relativistic molecular spinor integrals are available, from either a four-, two-, or one-component mean-field calculation.…
A possible mechanism of electronic phase separation in the systems with orbital ordering is analyzed. We suggest a simple model taking into account an interplay between the delocalization of charge carriers introduced by doping and the…
Motivated by the nematic electronic fluid phase in Sr_{3}Ru_{2}O_{7}, we develop a combined scheme of the renormalization-group method and the random-phase-approximation-type method, and analyze orbital susceptibilities of the…
Developing theoretical understanding of complex reactions and processes at interfaces requires using methods that go beyond semilocal density functional theory to accurately describe the interactions between solvent, reactants and…