| Page |
ABSTRACT | 1 |
CONTENTS | 2, 3 |
1. INTRODUCTION | 4, 5, 6, 7 |
2. REGULAR SOLID CUBIC HARMONICS | 8, 9, 10, 11 |
2.1 One-Centre Coulomb | 12 |
2.2 Two-Centre Coulomb | 13 |
2.3 Two-Centre Exchange | 14, 15 |
2.4 Three-Centre Exchange | 16 |
3. IRREGULAR SOLID CUBIC HARMONICS | 17, 18, 19, 20 |
3.1 One-Centre Coulomb | 21 |
3.2 Two-Centre Coulomb | 22, 23 |
3.3 Two-Centre Exchange | 24 |
3.4 Three-Centre Exchange | 25, 26, 27, 28, 29 |
4. CARTESIAN MULTIPOLE MOMENTS | 30, 31 |
4.1 One-Centre Coulomb | 32 |
4.2 Two-Centre Coulomb | 33 |
4.3 Two-Centre Exchange | 34 |
4.4 Three-Centre Exchange | 35 |
5. OTHER ONE-ELECTRON OPERATORS | 36 |
5.1 The Sack Expansion | 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49 |
5.2 Displacement Perturbations | 50, 51, 52, 53, 54 |
APPENDIX A: OFF-CENTRE CONTACT TERMS | 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66 |
APPENDIX B: CARTESIAN FIELD PROPERTIES | 67, 68 |
APPENDIX C: THE a-COEFFICIENTS | 69, 70, 71, 72, 73, 74, 75, 76, 77, 78 |
APPENDIX D: ULTRAHEXADECIMAL STORAGE | 79, 80, 81, 82, 83, 84, 85, 86, 87, 88 |
ACKNOWLEDGEMENTS | 89 |
REFERENCES | 90 |