The Relativistic Linear Muffin-Tin Orbital Method Application to Au
β Scribed by V. V. Nemoshkalenko; A. E. Krasovskii; V. N. Antonov; Vl. N. Antonov; U. Fleck; H. Wonn; P. Ziesche
- Publisher
- John Wiley and Sons
- Year
- 1983
- Tongue
- English
- Weight
- 687 KB
- Volume
- 120
- Category
- Article
- ISSN
- 0370-1972
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The alloying behavior of 4d and 5d transition metals (TMs) in g-phase solid uranium (U) has been investigated using the discrete-variational DiraceFockeSlater (DV-DFS) method. We examined the d-orbital energy (Md value) of these TMs, the orbital overlap population (OOP) between the d-orbital of thes