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Book Categories |
0 | Prerequisites | 1 |
1 | Molecular Mechanics | 9 |
2 | The Hydrogen Molecule-ion and Potential Energy Surfaces | 25 |
3 | The Hydrogen Molecule | 36 |
4 | The Electron Density | 48 |
5 | Self Consistent Fields | 56 |
6 | Huckel Theory | 67 |
7 | Differential Overlap Models | 78 |
8 | Atomic Orbital Choice | 97 |
9 | An Ab Initio Package - GAUSSIAN92 | 111 |
10 | Electron Correlation | 134 |
11 | The X[alpha] Model | 152 |
12 | Potential Energy Surfaces | 167 |
13 | Primary Properties | 192 |
14 | Induced Properties | 210 |
15 | Half a Dozen Applications | 228 |
References | 248 | |
Index | 253 |
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