Convolution square root of band-limited symmetrical functions and its application to small-angle scattering data

Abstract

A method for the deconvolution of the convolution square of a symmetrical function with a limited range of definition is presented. The solution function is approximated by a number of equidistant step functions. This allows the analytical computation of the integrals of overlap in one-dimensional (lamellar) symmetry, in two-dimensional (cylindrical) symmetry and in three-dimensional (spherical) symmetry. A special iterative linearized weighted-least-squares technique solves the non-linear convolution square-root problem without any a priori information on the solution. As an application, the electron or scattering length density ρ(r) from the distance distribution function p(r) of small-angle scattering is computed as well as the propagation of the statistical error from the input. The influence of imperfect realization of the symmetry conditions is discussed. Numerical instabilities that appear under certain conditions can easily be removed by a stabilization procedure.