First-principles FLAPW-GGA calculations for six possible polymorphs of ruthenium mononitride RuN indicate that the most stable structure is that of zinc blende rather than the rock salt structure recently reported for synthesized RuN samples. The elastic, electronic properties and the features of ch
โฆ LIBER โฆ
Structural, elastic, electronic, and thermodynamic properties of PrN from first principles calculations
โ Scribed by B. Kocak; Y.O. Ciftci; K. Colakoglu; E. Deligoz
- Publisher
- Elsevier Science
- Year
- 2010
- Tongue
- English
- Weight
- 743 KB
- Volume
- 405
- Category
- Article
- ISSN
- 0921-4526
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