Related papers: On the Hartree-Fock Eigenvalue Problem
The Hartree-Fock based diagonalization is a computational method for the investigation of the low-energy properties of correlated electrons in disordered solids. The method is related to the quantum-chemical configuration interaction…
In this paper we study some boundary value problems for a fractional analogue of second order elliptic equation with an involution perturbation in a rectangular domain. Theorems on existence and uniqueness of a solution of the considered…
The two dimensional set of canonical relations giving rise to minimal uncertainties previously constructed from a q-deformed oscillator algebra is further investigated. We provide a representation for this algebra in terms of a flat…
We review our new method, which might be the most direct and efficient way for approaching the continuum physics from Hamiltonian lattice gauge theory. It consists of solving the eigenvalue equation with a truncation scheme preserving the…
In this paper, we propose a new trace finite element method for the {Laplace-Beltrami} eigenvalue problem. The method is proposed directly on a smooth manifold which is implicitly given by a level-set function and require high order…
We study an eigenvalue problem for the Laplacian on a compact K\"{a}hler manifold. Considering the $k$-th eigenvalue $\lambda_{k}$ as a functional on the space of K\"{a}hler metrics with fixed volume on a compact complex manifold, we…
Developing an original idea of De Giorgi, we introduce a new and purely variational approach to the Cauchy Problem for a wide class of defocusing hyperbolic equations. The main novel feature is that the solutions are obtained as limits of…
For any Lipschitz domain we construct an arbitrarily small, localized perturbation which splits the spectrum of the Laplacian into simple eigenvalues. We use for this purpose a Hadamard's formula and spectral stability results.
Model two-dimensional singular perturbed eigenvalue problem for Laplacian with frequently alternating type of boundary condition is considered. Complete two-parametrical asymptotics for the eigenelements are constructed.
By expressing the electronic wavefunction in an explicitly-correlated (Jastrow-factorised) form, a similarity-transformed effective Hamiltonian can be derived. The effective Hamiltonian is non-Hermitian and contains three-body interactions.…
We treat the eigenvalue problem posed by self-similar potentials, i.e. homogeneous functions under a particular affine transformation, by means of symmetry techniques. We find that the eigenfunctions of such problems are localized, even…
The central theme in this paper is the Hopf-Laplace equation, which represents stationary solutions with respect to the inner variation of the Dirichlet integral. Among such solutions are harmonic maps. Nevertheless, minimization of the…
In this article, we demonstrate the restricted Hartree-Fock electronic structure computation of the molecule $H_3^+$ through computational algebra. We approximate the Hartree-Fock total energy by a polynomial composed of LCAO coefficients…
The Laplace-Beltrami problem on closed surfaces embedded in three dimensions arises in many areas of physics, including molecular dynamics (surface diffusion), electromagnetics (harmonic vector fields), and fluid dynamics (vesicle…
The solution of the eigenvalue problem of the Laplacian on a general homogeneous space G/H is given. Here, G is a compact, semisimple Lie group, H is a closed subgroup of G, and the rank of H is equal to the rank of G. It is shown that the…
The energy eigenvalues of a Dirac particle for the hyperbolic-type potential field have been computed approximately. It is obtained a transcendental function of energy, $\mathcal{F}(E)$, by writing in terms of confluent Heun functions. The…
In this paper we describe a new method for analyzing the Laplacian on asymptotically hyperbolic spaces, which was introduced recently by the author. This new method in particular constructs the analytic continuation of the resolvent for…
It is well-known that any solution of the Laplace equation is a real or imaginary part of a complex holomorphic function. In this paper, in some sense, we extend this property into four order hyperbolic and elliptic type PDEs. To be more…
We study the Hartree-Fock equation and the Hartree-Fock energy functional universally used in many-electron problems. We prove that the set of all critical values of the Hartree-Fock energy functional less than a constant smaller than the…
We review recent results about the derivation and the analysis of two Hartree-Fock-type models for the polarization of vacuum. We pay particular attention to the variational construction of a self-consistent polarized vacuum, and to the…