๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Structural, elastic, electronic, and thermodynamic properties of PrN from first principles calculations

โœ 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

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


Stability, structural, elastic and elect
โœ V.V. Bannikov; I.R. Shein; A.L. Ivanovskii ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 576 KB

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

Structural, electronic and thermodynamic
โœ Zuo Li; Pu Wang; Haihua Chen; Xinlu Cheng ๐Ÿ“‚ Article ๐Ÿ“… 2011 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 817 KB

The structural, electronic and thermodynamic properties of cubic Zn 3 N 2 under hydrostatic pressure up to 80 GPa are investigated using the local density approximation method with pseudopotentials of the ab initio norm-conserving full separable Troullier-Martin scheme in the frame of density functi