Quantum-Mechanical Ab-initio Calculation of the Properties of Crystalline Materials /
A number of general-purpose, reasonably accurate and well-tested ab-initio codes for crystals are discussed in this book. The aim is to expand competence of their application in material sciences and solid-state physics. The book addresses particularly readers with a general knowledge in quantum che...
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| Format: | eBook |
| Language: | English |
| Published: |
Berlin, Heidelberg :
Springer Berlin Heidelberg,
1996.
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| Series: | Lecture notes in chemistry ;
67. |
| Subjects: | |
| Online Access: | Connect to the full text of this electronic book |
| Summary: | A number of general-purpose, reasonably accurate and well-tested ab-initio codes for crystals are discussed in this book. The aim is to expand competence of their application in material sciences and solid-state physics. The book addresses particularly readers with a general knowledge in quantum chemistry and intends to give a deeper insight into the special algorithms and computational techniques in ab-initio computer codes for crystals. Three different programs which are available to all interested potential users on request are presented. |
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| Item Description: | Electronic resource. |
| Physical Description: | 1 online resource (vii, 328 pages) |
| ISBN: | 9783642614781 (electronic bk.) 3642614787 (electronic bk.) |
| ISSN: | 0342-4901 ; |