Nonlinear optical properties of the rhombic B4-cluster
β Scribed by Reis, H.; Papadopoulos, M. G.
- Publisher
- John Wiley and Sons
- Year
- 1999
- Tongue
- English
- Weight
- 280 KB
- Volume
- 20
- Category
- Article
- ISSN
- 0192-8651
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β¦ Synopsis
of the rhombic B -cluster with D symmetry are
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The electronic structures of some transition-metal ions doping the ferroelectric oxide Ε½ BaTiO are calculated through the density functional theory framework LCAO-LSD ADF 3 . w x method on extended clusters XO Ba Ti embedded in a punctual charge set depicting 6 8 6 nq Ε½ . 3 q 4 q the crystalline en