Related papers: On the Hartree-Fock Eigenvalue Problem
Harmonic oscillator in noncommutative two dimensional lattice are investigated. Using the properties of non-differential calculus and its applications to quantum mechanics, we provide the eigenvalues and eigenfunctions of the corresponding…
We present here a review of the fundamental topics of Hartree-Fock theory in Quantum Chemistry. From the molecular Hamiltonian, using and discussing the Born-Oppenheimer approximation, we arrive to the Hartree and Hartree-Fock equations for…
We derive eigenfunction expansions for a fundamental solution of Laplace's equation in three-dimensional Euclidean space in 5-cyclidic coordinates. There are three such expansions in terms of internal and external 5-cyclidic harmonics of…
In our work we construct a Hamiltonian, whose eigenstates approximate the solutions of the self-consistent Hartree-Fock equations for nonrelativistic atoms and ions. Its eigenvalues are given by completely algebraic expressions and the…
This paper introduces and analyses the new grid-based tensor approach for approximate solution of the eigenvalue problem for linearized Hartree-Fock equation applied to the 3D lattice-structured and periodic systems. The set of localized…
We investigate the Hartree-Fock solutions to H2 in a minimal basis. We note the properties of the solutions and their disappearance with geometry and propose a new method, Holomorphic Hartree-Fock theory, where we modify the SCF equations…
We analyzed the Hartree-Fock approximation for an electron system. The interaction between particles is modeled by a non-Coulombian potential. We analyzed both the three-dimensional and two-dimensional systems. We obtained accurate…
We study a nonlinear, nonlocal eigenvalue problem driven by the fractional p-Laplacian with an indefinite, singular weight chosen in an optimal class. We prove the existence of an unbounded sequence of positive variational eigenvalues and…
We propose a new method to solve the Hartree-Fock-Bogoliubov equations for weakly bound nuclei whose purpose is to improve the treatment of the continuum when a finite range two-body interaction is used. We replace the traditional expansion…
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 study the nonlinear eigenvalue problem for the p-Laplacian, and more general problem constituting the Fucik spectrum. We are interested in some vanishing properties of sign changing solutions to these problems. Our method is applicable…
In this paper we introduce the magnetic Hodge Laplacian, which is a generalization of the magnetic Laplacian on functions to differential forms. We consider various spectral results, which are known for the magnetic Laplacian on functions…
This work presents an safe and efficient methodology for autonomous indoor exploration with aerial robots using Harmonic Potential Fields (HPF). The challenge of applying HPF in complex 3D environments rests on high computational load…
This paper presents a method for computing eigenvalues and eigenvectors for some types of nonlinear eigenvalue problems. The main idea is to approximate the functions involved in the eigenvalue problem by rational functions and then apply a…
We study the eigenvalue problem for the $g-$Laplacian operator in fractional order Orlicz-Sobolev spaces, where $g=G'$ and neither $G$ nor its conjugated function satisfy the $\Delta_2$ condition. Our main result is the existence of a…
The purpose of this work is to study a finite element method for finding solutions to the eigenvalue problem for the fractional Laplacian. We prove that the discrete eigenvalue problem converges to the continuous one and we show the order…
In this work we extend the theory of the classical Hardy space $H^1$ to the rational Dunkl setting. Specifically, let $\Delta$ be the Dunkl Laplacian on a Euclidean space $\mathbb{R}^N$. On the half-space $\mathbb{R}_+\times\mathbb{R}^N$,…
This paper deals with the solution of the spherically symmetric time-dependent Hartree-Fock approximation applied to nuclear giant monopole resonances in the small amplitude regime. The problem is spatially unbounded as the resonance state…
We consider here variational solutions in the Hartree-Fock approximation upon breaking time reversal and axial symmetries. When decomposed on axial harmonic oscillator functions, the corresponding single particle triaxial eigenstates as…
The eigenvalue problem of the spherically symmetric oscillator Hamiltonian is revisited in the context of canonical raising and lowering operators. The Hamiltonian is then factorized in terms of two not mutually adjoint factorizing…