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Multiple Scattering in Solids

Sofort lieferbar | Lieferzeit: Sofort lieferbar I
ISBN-13:
9781461212904
Veröffentl:
2012
Seiten:
285
Autor:
Antonios Gonis
Serie:
Graduate Texts in Contemporary Physics
eBook Typ:
PDF
eBook Format:
EPUB
Kopierschutz:
1 - PDF Watermark
Sprache:
Englisch
Beschreibung:

A description of general techniques for solving linear partial differential equations by dividing space into regions to which the equations are independently applied and then assembling a global solution from the partial ones. Intended for researchers and graduates involved in calculations of the electronic structure of materials, this will also be of interest to workers in quantum chemistry, electron microscopy, acoustics, optics, and other fields. The book begins with an intuitive approach to scattering theory and then turns to partial waves and a formal development of multiple scattering theory, with applications to the solid state. The authors then present a variational derivation of the formalism and an augmented version of the theory, concluding with a discussion of the relativistic formalism and a discussion of the Poisson equation. Appendices discuss Green's functions, spherical functions, Moller operators and the Lippmann-Schwinger equation, irregular solutions, and singularities in Green's functions.
1 Introduction.- 1.1 Basic Characteristics of MST.- 1.2 Electronic Structure Calculations.- 1.3 The Aim of This Book.- References.- 2 Intuitive Approach to MST.- 2.1 Huygens' Principle and MST.- 2.2 Time-Independent Green Functions.- References.- 3 Single-Potential Scattering.- 3.1 Partial-Wave Analysis of Single Potential Scattering.- 3.2 General Considerations.- 3.3 Spherically Symmetric Potentials.- 3.4 Nonspherical Potentials.- 3.5 Wave Function in the Moon Region.- 3.6 Effect of the Potential in the Moon Region.- 3.7 Convergence of Basis Function Expansions (*).- References.- 4 Formal Development of MST.- 4.1 Scattering Theory for a Single Potential.- 4.2 Two-Potential Scattering.- 4.3 The Equations of Multiple Scattering Theory.- 4.4 Representations.- 4.5 Muffin-Tin Potentials.- References.- 5 MST for Muffin-Tin Potentials.- 5.1 Multiple Scattering Series.- 5.2 The Green Function in MST.- 5.3 Impurities in MST.- 5.4 Coherent Potential Approximation.- 5.5 Screened MST.- 5.6 Alternative Derivation of MST.- 5.7 Korringa's Derivation.- 5.8 Relation to Muffin-Tin Orbital Theory.- 5.9 MST for E

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