图书简介
This edited book, based on material presented at the EU Spec Training School on Multiple Scattering Codes and the following MSNano Conference, is divided into two distinct parts. The first part, subtitled ?basic knowledge?, provides the basics of the multiple scattering description in spectroscopies, enabling readers to understand the physics behind the various multiple scattering codes available for modelling spectroscopies. The second part, ?extended knowledge?, presents ?state- of-the-art? short chapters on specific subjects associated with improving of the actual description of spectroscopies within the multiple scattering formalism, such as inelastic processes, or precise examples of modelling.
Introduction to (multiple) scattering theory.-燝enerating phase-shifts and radial integrals for multiple scattering codes.-燫eal Space Full Potential Multiple Scattering Theory.-燢KR Green?s function method in reciprocal and real爏pace.-燤ultichannel Multiple Scattering Theory in R-matrix爁ormalism.-燤ultiple Scattering in Green?s Function Formalism:燬ingle-Channel and Multichannel Versions.-燤XAN and Molecular Dynamics: a new way to look to爐he XANES (X-ray Absorption Near Edge Structure)爀nergy region.-爂nxas: advances in the suite of programs for爉ultiple-scattering analysis of x-ray absorption data.-?e,2e) impact ionization processes for surface science.-燣ayer-resolved photoemission study of doped燗g-supported ultrathin MgO ?lms.-爀s2ms: interface from Electronic Structure codes to Multiple Scattering codes.-燣-edge absorption and dichroism in low symmetry 3d0燾ompounds.-燤ultichannel L-absorption calculations by analytical燾ontinuation of Green?s function into complex energy爌lane.-燘allistic Electron Emission Microscope by real space爉ultiple scattering theory.-燜ully relativistic multiple scattering calculations for爂eneral potentials.-燫elativistic e?ects and gauge invariance in photon燼bsorption and scattering.-燭owards accurate and large-scale density-functional燾alculations with the Korringa-Kohn-Rostoker method.
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