Using a molecular cluster with 71 atoms, we studied the electronic and structural properties of nitrogen vacancy, boron antisite, and oxygen in cubic boron nitride through an ab initio HartreeαFock calculation. We found that all defects introduce a deep state above the middle-energy gap. These defec
β¦ LIBER β¦
Electronic and vibrational properties of point defects in ionic crystalsby Y. Farge and M. P. Fontana
β Scribed by Shand, M. L.
- Book ID
- 114522909
- Publisher
- International Union of Crystallography
- Year
- 1981
- Weight
- 247 KB
- Volume
- 37
- Category
- Article
- ISSN
- 0567-7394
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
Electronic and structural properties of
β
R. Mota; P. Piquini; T. M. Schmidt; A. Fazzio
π
Article
π
1997
π
John Wiley and Sons
π
English
β 236 KB
π 2 views
[Fundamental Materials Research] Electro
β
Kaplan, T. A.; Mahanti, S. D.
π
Article
π
2002
π
Kluwer Academic Publishers
π
English
β 135 KB
Hartree-fock Cluster Procedure For Study Of Hyperfine Properties Of Condensed Matter Systems / T.p. Das -- Embedding Theory And Quantum Cluster Simulation Of Point Defects In Ionic Crystals / J.v. Vail -- Density-functional Full-potential Multiple-scattering Calculations For Free And Embedded Cluste
Vibrational Properties of Nanograins and
β
Stankov, S.; Yue, Y.; Miglierini, M.; Sepiol, B.; Sergueev, I.; Chumakov, A.; Hu
π
Article
π
2008
π
The American Physical Society
π
English
β 682 KB
Structural, electronic and magnetic prop
β
Y. Xie; J. M. Zhang; Y. P. Huo
π
Article
π
2011
π
Springer
π
English
β 928 KB
First-principle study of the electronic
β
D. Cao; M.-Q. Cai; C.-H. Tang; P. Yu; W.-Y. Hu; Y. Du; B.-Y. Huang; H.-Q. Deng
π
Article
π
2010
π
Springer
π
English
β 265 KB
I. Mertig, E. Mrosan, P. Ziesche. Multip
β
P. Rennert
π
Article
π
1988
π
John Wiley and Sons
π
English
β 86 KB