Electronic properties of the Au impurity in : First-principles study
โ Scribed by J.L. Han; L.Z. Sun; X.D. Qu; Y.P. Chen; J.X. Zhong
- Publisher
- Elsevier Science
- Year
- 2009
- Tongue
- English
- Weight
- 958 KB
- Volume
- 404
- Category
- Article
- ISSN
- 0921-4526
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
Electronic structures of Mg 1-x Cr x O (x = 0, 0.25, 0.5, 0.75) were investigated based on first-principles calculations using generalized gradient approximation (GGA) and GGA + U. Different magnetic and electronic properties are predicted from the calculated spin-dependent density of states near th
First-principles calculations on the electronic and magnetic properties of TlNiO 3 reveal that the antiferromagnetic structure with the insulating ground state is more stable than other possible configurations in the monoclinic structure. The band gap of the antiferromagnetic insulating ground state