Ab initio Studies on Exchange Interactions in Metals and Correlated Oxides
A report is given on the implementation of a frozen magnon technique in the FLAPW code FLEUR, showing that the procedure reduced computational costs compared with a previously implemented method, while delivering accurate results. Furthermore a generalisation was made of the well known one lattice f...
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| Format: | Doctoral Thesis |
| Language: | English |
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Uppsala universitet, Materialteori
2015
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| Online Access: | http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-246766 http://nbn-resolving.de/urn:isbn:978-91-554-9190-1 |