Ab initio thermodynamic properties of point defects and O-vacancy diffusion in Mg spinels
✍ Scribed by Łodziana, Zbigniew; Piechota, Jacek
- Book ID
- 120536586
- Publisher
- The American Physical Society
- Year
- 2006
- Tongue
- English
- Weight
- 661 KB
- Volume
- 74
- Category
- Article
- ISSN
- 1098-0121
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📜 SIMILAR VOLUMES
Large-scale ab initio simulation methods have been employed to investigate the configurations and properties of defects in SiC. Atomic structures, formation energies and binding energies of small vacancy clusters have also been studied as a function of cluster size, and their relative stabilities ar
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