First-principles investigations of ordering in binary alloys
The aim of the thesis is to study ordering in binary alloys on the basis of first-principles or {\it ab-initio} techniques employing density functional theory (DFT). The ordering phenomena of materials are of crucial importance for technological applications. The results of the thesis are intended t...
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| Format: | Doctoral Thesis |
| Language: | English |
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KTH, Flerskalig materialmodellering
2013
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| Online Access: | http://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-129313 http://nbn-resolving.de/urn:isbn:978-91-7501-880-5 |