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Table 1
Orbital parameters (ci, pi, ξi) obtained using CIV3 for the 3s, 3p, 3d, 
, 
and 
orbitals.
| nl | c i | p i | ξ i | nl | c i | p i | ξ i |
|
|
|||||||
| 3s | 0.2346 | 1 | 8.7637 | 3p | 0.6490 | 2 | 4.5649 |
| –1.2830 | 2 | 3.5733 | –1.20895 | 3 | 2.6642 | ||
| 1.7445 | 3 | 2.9419 | |||||
| 4s | 2.0087 | 1 | 2.8178 | ||||
| 3d | 1.0000 | 3 | 2.8158 | –10.6894 | 2 | 2.8362 | |
| 11.3052 | 3 | 3.4025 | |||||
| 4p | 4.1564 | 2 | 3.8054 | –2.5648 | 4 | 2.9963 | |
| –8.6714 | 3 | 3.7903 | |||||
| 4.9392 | 4 | 3.7895 | 4d | 1.4241 | 3 | 4.9376 | |
| –1.0892 | 4 | 3.5591 | |||||
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