Published October 2007 | Version v1
Journal article

X 2e: A general quantitative approach to the calculation of (e,2e) and related processes

  • 1. Department of Physics, Old Dominion University, Norfolk, VA 23529-0116 (United States)
  • 2. IBM Almaden Research Center, 650 Harry Road, San Jose, CA 95120-6099 (United States)

Description

We present a new variational approach for calculating (e,2e) and (γ,2e)processes. We consider the general theory for the electron-impact ionization of atomic hydrogen and we deduce a formula for the scattering amplitude in terms of a surface integral over a five-dimensional hypersurface. We consider configuration space to be divided into three regions separated by five-dimensional hypersurfaces. We calculate the R-matrix on the surface of the innermost hypersurface using a variationally determined two-electron R-operator, a linear operator that relates function values to normal derivatives on the innermost bounding hypersurface inside which the function satisfies the Schroedinger equation. We then use the Light Walker propagation technique, modified by the symmetry condition at rs=rf, to propagate our variationally determined R-matrix through a large volume until we reach the boundary of our second hypersurface. We calculate the S-matrix on this hypersurface and use it to remove the incoming flux and deduce the outgoing wave which is matched to one that has been brought in from some asymptotically large distance. It is shown that it is possible to reduce the five-dimensional integral over the hypersurface to a single numerical integration, times a finite sum over angular terms, thus facilitating the evaluation of the scattering amplitude. The method we propose is computationally efficient. Results will be presented for a number of simple test cases

Availability note (English)

Available from http://dx.doi.org/10.1016/j.elspec.2007.02.019

Additional details

Identifiers

DOI
10.1016/j.elspec.2007.02.019;
PII
S0368-2048(07)00097-7;

Publishing Information

Journal Title
Journal of Electron Spectroscopy and Related Phenomena
Journal Volume
161
Journal Issue
1-3
Journal Page Range
p. 67-72
ISSN
0368-2048
CODEN
JESRAW

Conference

Title
International conference on many particle spectroscopy of atoms, molecules, clusters and surfaces
Dates
22-24 Jun 2006
Place
Rome (Italy)

INIS

Country of Publication
Netherlands
Country of Input or Organization
International Atomic Energy Agency (IAEA)
INIS RN
39089727
Subject category
S74: ATOMIC AND MOLECULAR PHYSICS;
Resource subtype / Literary indicator
Conference
Descriptors DEI
ELECTRONS; HYDROGEN; INTEGRALS; IONIZATION; R MATRIX; S MATRIX; SCATTERING AMPLITUDES; SCHROEDINGER EQUATION; SURFACES; VARIATIONAL METHODS; VISIBLE RADIATION
Descriptors DEC
AMPLITUDES; CALCULATION METHODS; DIFFERENTIAL EQUATIONS; ELECTROMAGNETIC RADIATION; ELEMENTARY PARTICLES; ELEMENTS; EQUATIONS; FERMIONS; LEPTONS; MATRICES; NONMETALS; PARTIAL DIFFERENTIAL EQUATIONS; RADIATIONS; WAVE EQUATIONS

Optional Information

Copyright
Copyright (c) 2007 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved.