Optical and vibrational properties of 2H-, 4H-, and 6H-AlN: First-principle calculations
β Scribed by Cheng, Y. C.; Chen, H. T.; Li, X. X.; Wu, X. L.; Zhu, J.; Li, S. H.; Chu, Paul K.
- Book ID
- 120384290
- Publisher
- American Institute of Physics
- Year
- 2009
- Tongue
- English
- Weight
- 548 KB
- Volume
- 105
- Category
- Article
- ISSN
- 0021-8979
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Local pseudopotential calculations have been performed for the ground state of disilane as well as for the lowest singlet and triplet states of disilene and silylsilylene. Comparison with all-electron calculations shows good agreement for geometries and relative stabilities.