This book delivers a comprehensive account of the main features and possibilities of LCAO methods for the first principles calculations of electronic structure of periodic systems. The first part describes the basic theory underlying the LCAO methods applied to periodic systems and the use of wave-function-based, density-based (DFT) and hybrid hamiltonians. The second part deals with the applications of LCAO methods for calculations of bulk crystal properties.
| ISBN-13: | 9783540487463 |
| ISBN-10: | 3540487468 |
| Publisher: | Springer |
| Publication date: | 2007 |
| Edition description: | 2007 |
| Pages: | 574 |
| Product dimensions: | Height: 9.21258 Inches, Length: 6.14172 Inches, Weight: 2.15612092236 Pounds, Width: 1.2499975 Inches |
| Author: | Robert A. Evarestov |
| Language: | en |
| Binding: | Hardcover |
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