Related papers: A full-potential approach to the relativistic sing…
Using a scale transformation in momentum space a phase equivalent relativistic potential is generated from the nonrelativistic potential. By that transformation a practical method for the relativistic 3N scattering with realistic…
This study concerns the two-body scattering of particles in a one-dimensional periodic potential. A convenient ansatz allows for the separation of center-of-mass and relative motion, leading to a discrete Schr\"odinger equation in the…
An analysis shows that the ground state of the inhomogeneous system of interacting electrons in the static external field, which satisfies the thermodynamic limit, can be consistently described only using the Green function theory based on…
An ensemble Green's function formalism, based on the von Neumann density matrix approach, to calculate one-electron excitation spectra of a many-electron system with degenerate ground states is proposed. A set of iterative equations for the…
The electromagnetic Green's function is a crucial ingredient for the theoretical study of modern photonic quantum devices, but is often difficult or even impossible to calculate directly. We present a numerically efficient framework for…
We have implemented a three-dimensional finite element approach, based on tricubic polynomials in spherical coordinates, which solves the Schrodinger equation for scattering of a low energy electron from a molecule, approximating the…
We introduce a functional of the local spectral electron density which can be used to to compute the total energy and the local spectral function of strongly-correlated materials. We illustrate the applicability of the method by using as an…
A Green's function formalism to analyze the scattering properties in confined geometries is developed. This includes scattering from a central field inside the guide created e.g. by impurities. For atomic collisions our approach applies to…
We study the single-band Hubbard model under the action of an external magnetic field using the cumulant Green's functions method (CGFM). The starting point of the method is to diagonalize a cluster containing N correlated sites (seed) and…
Based on the Korringa-Kohn-Rostoker Green's function technique we present a computational scheme for calculating the electronic structure of layered systems with homogeneous spin-spiral magnetic state. From the self-consistent…
In the framework of the many-electron s-d exchange model and Hubbard model, self-consistent equations are derived for the one-particle retarded Green's function in the many-electron Hubbard X-operator representation. We analyze the general…
An accurate expression of the kinetic energy density of an electronic distribution in terms of the single particle reduced density matrix for atomic and molecular systems is a long-standing problem in electron structure theory. Existing…
In formal scattering theory, Green functions are obtained as solutions of a distributional equation. In this paper, we use the Sturm-Liouville theory to compute Green functions within a rigorous mathematical theory. We shall show that both…
The Schroedinger equation with an energy-dependent complex absorbing potential, associated with a scattering system, can be reduced for a special choice of the energy-dependence to a harmonic inversion problem of a discrete pseudo-time…
In this paper, we present a powerful method (Atomistic Green's Function, AGF) for calculating the effective Hamiltonian of acoustic and elastic wave-scatterers. The ability to calculate the effective Hamiltonian allows for the study of…
A completely antisymmetrized Green's function approach to the inclusive quasielastic $(e,e')$ scattering, including a realistic one-body density, is presented. The single particle Green's function is expanded in terms of the eigenfunctions…
We perform first-principle calculations of electron-nucleus scattering on $^3$He and $^3$H using the Green's function Monte Carlo method and two approaches based on the factorization of the final hadronic state: the spectral-function…
In the recent work of S. Sharma \emph{et al.}, (arxiv.org: arxiv:0912.1118), a single-electron spectrum associated with the natural orbitals was defined as the derivative of the total energy with respect to the occupation numbers at half…
Scattering of waves due to a vertical array of equally-spaced cracks on a square lattice is studied. The convenience of Floquet periodicity reduces the study to that of scattering of specific wave-mode from single crack in a waveguide. The…
We present a complete prescription for the numerical calculation of surface Green's functions and self-energies of semi-infinite quasi-onedimensional systems. Our work extends the results of Sanvito et al. [1] generating a robust algorithm…