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W. Ludwig C. Falter Symmetries in Physics Group Theory Applied to Physical Problems With 87 Figures Springer-Verlag Berlin Heidelberg New York London Paris Tokyo

Contents 1. Introduction 1 2. Elements of the Theory of Finite Groups 4 2.1 Symmetry and Group Concepts: A Basic Example 4 2.2 General Theorems on Group Theory 9 2.3 Conjugacy Classes 15 3. Discrete Symmetry Groups 18 3.1 Point Groups 18 3.1.1 Symmetry Elements 18 3.1.2 Proper Point Groups 21 3.1.3 Improper Point Groups 23 3.2 Colour Groups and Magnetic Groups 26 3.3 Double Groups 29 3.4 Lattices, the Translation Group and Space Group 33 3.4.1 Normal Space Groups 33 3.4.2 Colour and Magnetic Space Groups 38 3.4.3 Double Space Groups 39 3.5 Permutation Groups 41 3.6 Other Finite Groups 45 4. Representations of Finite Groups 47 4.1 Linear Spaces and Operators 47 4.1.1 Linear and Unitary Spaces 47 4.1.2 Linear Operators 51 4.1.3 Special Operators and Eigenvalues 54 4.2 Introduction to the Theory of Representations 57 4.2.1 Operator Representations by Matrices 57 4.2.2 Equivalent Representations and Characters 61 4.2.3 Reducible and Irreducible Representations 63 4.2.4 Orthogonality Theorems 66 4.2.5 Subduction. Reality of Representations 71 4.3 Group Algebra 73 4.3.1 The Regular Representation 73 4.3.2 Projection Operators 75

VIII Contents 4.4 Direct Products 79 4.4.1 Representations of Direct Products of Groups 79 4.4.2 The Inner Direct Product of Representations of a Group. Clebsch-Gordan Expansion 82 4.4.3 Simply Reducible Groups 84 5. Irreducible Representations of Special Groups 87 5.1 Point and Double Point Groups 87 5.2 Magnetic Point Groups. Time Reversal 91 5.3 Translation Groups 95 5.4 Permutation Groups 98 5.5 Tensor Representations 107 5.5.1 Tensor Transformations. Irreducible Tensors 107 5.5.2 Induced Representations 113 5.5.3 Irreducible Tensor Spaces 114 5.5.4 Direct Products and Their Reduction 121 6. Tensor Operators and Expectation Values 126 6.1 Tensors and Spinors 126 6.2 The Wigner-Eckart Theorem 129 6.3 Eigenvalue Problems 132 6.4 Perturbation Calculus 135 7. Molecular Spectra 139 7.1 Molecular Vibrations 139 7.1.1 Equation of Motion and Symmetry 139 7.1.2 Determination of Eigenvalues and Eigenvectors 144 7.1.3 Selection Rules 154 7.2 Electron Functions and Spectra 156 7.2.1 Symmetry in Many-Particle Systems 156 7.2.2 Symmetry-Adapted Atomic and Molecular Orbitals 159 7.2.3 The Hiickel Method and Ligand Field Theory 165 7.3 Many-Electron Problems 171 7.3.1 Permutation Symmetry 171 7.3.2 Point and Permutation Symmetry. Molecular States 175 7.3.3 The H 2 Molecule 179 8. Selection Rules and Matrix Elements 183 8.1 Selection Rules of Tensor Operators 183 8.2 The Jahn-Teller Theorem 184 8.2.1 Spinless States 184 8.2.2 Time Reversal Symmetry 186 8.3 Radiative Transitions 188 8.4 Crystal Field Theory 191 8.4.1 Crystal Field Splitting of Energy Levels 191 8.4.2 Calculation of Splitting "193 8.5 Independent Components of Material Tensors 198

Contents IX 9. Representations of Space Groups 203 9.1 Representations of Normal Space Groups 203 9.1.1 Decompositions into Cosets 203 9.1.2 Induction of the Representations of Ш 206-9.2 Allowable Irreducible Representations of the Little Group У к 208 9.2.1 Projective Representations. Representations with a Factor System for % k = %/J 208 9.2.2 Vector Representations of the Group У к = У к /Т к 215 9.2.3 Representations of Double Space Groups. Spinor Representations 218 9.3 Projection Operators and Basis Functions 221 9.4 Representations of Magnetic Space Groups 222 9.4.1 Corepresentations of Magnetic Space Groups 222 9.4.2 Time Reversal Symmetry in Л п Groups 224 10. Excitation Spectra and Selection Rules in Crystals 230 10.1 Spectra - Some General Statements 230 10.1.1 Bands and Branches 230 10.1.2 Compatibility Relations 232 10.2 Lattice Vibrations 235 10.2.1 Equation of Motion and Symmetry Properties 235 10.2.2 Vibrations of the Diamond Lattice 239 10.3 Electron Energy Bands 244 10.3.1 Symmetrization of Plane Waves 244 10.3.2 Energy Bands and Atomic Levels 250 10.4 Selection Rules for Interactions in Crystals 252 10.4.1 Determination of Reduction Coefficients 252 10.4.2 General Selection Rules 256 10.4.3 Electron-Phonon Interaction 256 10.4.4 Electron-Photon Interaction: Optical Transitions 259 10.4.5 Phonon-Photon Interaction 261 11. Lie Groups and Lie Algebras 266 11.1 General Foundations 266 11.1.1 Infinitesimal Generators and Defining Relations 266 11.1.2 Algebra and Parameter Space 273 11.1.3 Casimir Operators 277 11.2 Unitary Representations of Lie Groups 279 11.3 Clebsch-Gordan Coefficients and the Wigner-Eckart Theorem 284 11.4 The Cartan-Weyl Basis for Semisimple Lie Algebras 287 11.4.1 The Lie Group У^ (л, С) and the Lie Algebra A _ x. 287 11.4.2 The Cartan-Weyl Basis 295 12. Representations by Young Diagrams. The Method of Irreducible Tensors 311

X Contents 13. Applications of the Theory of Continuous Groups 318 13.1 Elementary Particle Spectra 318 13.1.1 General Remarks 318 13.1.2 Hadronic States 321 13.1.3 Colour States of Quarks 330 13.1.4 A Possible У* (4) Classification 333 13.2 Atomic Spectra 336 13.2.1 Russell-Saunders (LS) Coupling 336 13.2.2 jj Coupling 339 13.3 Nuclear Spectra 340 13.3.1 jj-ji Coupling 341 13.3.2 LSI Coupling 342 13.4 Dynamical Symmetries of Classical Systems 345 14. Internal Symmetries and Gauge Theories 350 14.1 Internal Symmetries of Fields 350 14.2 Gauge Transformations of the First Kind 354 14.2.1 <Ш (1) Gauge Transformations 354 14.2.2 У и (n) Gauge Transformations 356 14.3 Gauge Transformations of the Second Kind 358 14.3.1 *(1) Gauge Transformations of the Second Kind... 358 14.3.2 У<Шin) Gauge Transformations of the Second Kind.. 362 14.3.3 A Differential Geometric Discussion of the Yang-Mills Fields 369 14.4 Gauge Theories with Spontaneously Broken Symmetry 372 14.4.1 General Remarks 372 14.4.2 Spontaneous Breaking of a Gauge Symmetry of the First Kind: Goldstone Model 374 14.4.3 Spontaneous Breaking of an Abelian Gauge Symmetry of the Second Kind: Higgs-Kibble Model. 376 14.5 Non-Abelian Gauge Theories and Symmetry Breaking 379 14.5.1 The Glashow-Salam-Weinberg Model of the Electro-Weak Interaction 379 14.5.2 Symmetry Breaking in the Glashow-Salam-Weinberg Model 383 14.5.3 Grand Unified Theories: General Remarks 389 14.5.4 SWl (5) Group and Georgi-Glashow Model 391 14.5.5 Some Consequences of У<* (5) Theory 400 Appendices 406 A. Character Tables 406 B. Representations of Generators 414 C. Standard Young-Yamanouchi Representations of the Permutation Groups ^3-0> 5 417 D. Continuous Groups 419

Contents XI E. Stars of к and Symmetry of Special A-Vectors 421 F. Noether's Theorem 422 G. Space-Time Symmetry 424 G.l Canonical Transformations and Algebra 424 G.2 The Galilei Group and Classical Mechanics 428 G.3 Lorentz and Poincare Groups 430 G.4 The Physical Quantities 435 H. Goldstone's Theorem 437 I. List of Symbols and Abbreviations 440 References 445 Additional References 451 Subject Index 453