𝔖 Bobbio Scriptorium
✦   LIBER   ✦

First principles study of the electronic structures of erbium silicides with non-frozen 4f treatment

✍ Scribed by C. L. Ma; S. Picozzi; X. Wang; Z. Q. Yang


Book ID
111622384
Publisher
Springer
Year
2007
Tongue
English
Weight
471 KB
Volume
59
Category
Article
ISSN
1434-6036

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First-principles study on electronic str
✍ Ze-Xu, Shao ;Qi-Ren, Zhang ;Ting-Yu, Liu ;Jian-Yu, Chen πŸ“‚ Article πŸ“… 2007 πŸ› John Wiley and Sons 🌐 English βš– 242 KB

## Abstract The electronic structures of CaWO~4~ crystals with interstitial oxygen atoms are studied within the framework of the fully relativistic self‐consistent Dirac–Slater theory, using a numerically discrete variation (DV‐XΞ±) method. It is concluded by the calculation that interstitial oxygen