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Author:   Ilja Turek ,  Václav Drchal ,  Josef Kudrnovský ,  Mojmír Sob
Publisher:   Springer
Imprint:   Springer
Edition:   1997 ed.
Dimensions:   Width: 15.50cm , Height: 1.90cm , Length: 23.50cm
Weight:   1.430kg
ISBN:  

9780792397984

ISBN 10:   0792397983
Pages:   317
Publication Date:   31 December 1996
Audience:   College/higher education ,  Professional and scholarly ,  General/trade ,  Postgraduate, Research & Scholarly ,  Professional & Vocational
Format:   Hardback
Publisher's Status:   Active
Availability:   In Print  
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Table of Contents

1 Introduction.- 1.1 Electronic Structure of Solids.- 1.2 Systems with Reduced Symmetry.- 1.3 Tight-Binding Approximation.- 1.4 Resolvents and Green Functions.- References.- 2 Linear Muffin-Tin Orbital (LMTO) Method.- 2.1 Secular Equation.- 2.2 Variational Principle.- References.- 3 Green Function Method.- 3.1 Green Functions in Solids.- 3.2 Tight-Binding LMTO Method.- 3.3 Relation to the KKR Method.- 3.4 Green Functions in Layered Systems.- 3.5 Calculation of Observables.- References.- 4 Coherent Potential Approximation (CPA).- 4.1 Configurational Average of Green Function.- 4.2 Single-Site Approximation.- 4.3 Calculation of Observables.- 4.4 Properties and Limitations of the CPA.- References.- 5 Selfconsistency Within Atomic Sphere Approximation.- 5.1 Charge Selfconsistency.- 5.2 Electrostatic (Madelung) Fields.- 5.3 Total Energy.- References.- 6 Relativistic Theory.- 6.1 Relativistic TB-LMTO Method: Non-Magnetic Case.- 6.2 Relativistic TB-LMTO Method: Spin-Polarized Case.- References.- 7 Bulk Systems, Overlayers and Surfaces.- 7.1 Bulk Elemental Metals.- 7.2 Bulk Transition-Metal Alloys.- 7.3 Clean Surfaces and Overlayers.- 7.4 Random Overlayers.- 7.5 Surfaces of Random Alloys.- References.- 8 Magnetic Properties.- 8.1 Ferromagnetic Bulk Alloys.- 8.2 Magnetism of Surfaces and Interfaces.- 8.3 Disordered Local Moments.- References.- 9 Effective Interatomic Interactions in Alloys.- 9.1 Ising Model for Alloys.- 9.2 Generalized Perturbation Method.- 9.3 Bulk Systems.- 9.4 Surfaces.- 9.5 Concluding Remarks.- References.- 10 Numerical Implementation.- 10.1 Tight-Binding Structure Constants.- 10.2 Radial Schrödinger and Dirac Equations.- 10.3 Complex Contour Energy Integration.- 10.4 Analytic Continuation.- 10.5 Brillouin Zone Integration.- 10.6 Surface Green Functions.-10.7 Coherent Potential Approximation.- 10.8 Local Spin Density Approximation.- References.

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