Related papers: Unique Solutions to Hartree-Fock Equations for Clo…
We compute the isotope shifts of the \emph{total} electron binding energy of neutral atoms and singly charged ions up to element $Z=120$, using relativistic Hartree-Fock method including the Breit interaction. Field shift coefficients are…
We present an alternative scheme for calculating the unrestricted Hartree-Fock equation. The scheme is based on the variational method utilizing the sophisticated basis functions that include no adjustable parameters. The validity and…
The CDW Hartree-Fock state at half filling and half electron per unit cell is examined. Firstly, an exact solution in terms of Bloch-like states is presented. Using this solution we discuss the dynamics near half filling and show the mass…
Various properties of single-particle Hartree-Fock ground-state solutions in $N\sim Z$ nuclei are investigated. The emphasis is on a role of single-particle mean-field in odd-even mass staggering. It is shown that, unlike in traditional…
We search for the uniform Hartree-Fock ground state of the two-dimensional electron gas formed in semiconductor heterostructures including the Rashba spin-orbit interaction. We identify two competing quantum phases: a ferromagnetic one with…
We present a new approach for calculating the nuclear equation of state and compressibility for finite nuclei using the density-constrained Hartree-Fock method.
This article is concerned with the derivation and the mathematical study of a new mean-field model for the description of interacting electrons in crystals with local defects. We work with a reduced Hartree-Fock model, obtained from the…
An ab initio Wannier-function-based approach to electronic ground-state calculations for crystalline solids is outlined. In the framework of the linear combination of atomic orbitals method the infinite character of the solid is rigorously…
We examine the spin asymmetry of ground states for two-dimensional, harmonically trapped two-component gases of fermionic atoms at zero temperature with weakly repulsive short range interactions. Our main result is that, in contrast to the…
We present analytical solutions to a quantum-mechanical three-body problem in three dimensions, which describes a helium-like two-electron atom. Similarly to Hooke's atom, the Coulombic electron-nucleus interaction potentials are replaced…
We calculate the Hartree-Fock energy of a density-wave in a spin polarized two-dimensional electron gas using a short-range repulsive interaction. We find that the stable ground state for a short-range potential is always either the…
We investigate the order-by-order convergence behavior of many-body perturbation theory (MBPT) as a simple and efficient tool to approximate the ground-state energy of closed-shell nuclei. To address the convergence properties directly, we…
The ground state properties of the two-electron atom with atomic number $Z\geq 2$ in the spherical vacuum cavity with general boundary conditions of "not going out" are studied. It is shown that for certain parameters of the cavity such…
For a couple of singularly perturbed Gross-Pitaevskii equations, we first prove that the single peak solutions, if they concentrate on the same point, are unique provided that the Taylor's expansion of potentials around the concentration…
A Hartree--Fock analysis of the ground-state electronic structure of the finite spherical jellium model is carried out for systems containing up to $520$ electrons in a positive background field with densities ranging from $10^{-3}$ to $1$.…
It is well-known that in bulk, the solution of the Bogoliubov-de Gennes equations is the same whether or not the Hartree-Fock term is included. Here the Hartree-Fock potential is position independent and, so, gives the same contribution to…
We prove uniqueness of ground states $Q$ in $H^{1/2}$ for pseudo-relativistic Hartree equations in three dimensions, provided that $Q$ has sufficiently small $L^2$-mass. This result shows that a uniqueness conjecture by Lieb and Yau in [CMP…
We investigate here ground state properties of atoms, in which substitute fermions -- electrons by bosons, e.g. $\pi $ - meson. We perform some calculations in the frame of modified Hartree-Fock (HF) equation. The modification takes into…
In this paper we analyze a recently proposed approach for the construction of antisymmetric functions for atomic and molecular systems. It is based on the assumption that the main problems with Hartree-Fock wavefunctions stem from their…
We prove the phase segregation phenomenon to occur in the ground state solutions of an interacting system of two self-coupled repulsive Hartree equations for large nonlinear and nonlocal interactions. A self-consistent numerical…