(1s 2 2s 2 2p 2 5d 1 ) 4 F P 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4352.
N.V.Novikov // Wave Function Value Database;
http://cdfe.sinp.msu.ru/services/wftables/
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 5d- electron | |
| 1 | 3d | 2.366227 | 1.50588394 |
| 2 | 4d | 1.992954 | -3.97829027 |
| 3 | 5d | 1.807646 | 3.21498724 |
| 4 | 3d | 6.770422 | .02985488 |
| 5 | 5d | 3.857758 | -.07159960 |
| 6 | 4d | 16.936998 | -.00028084 |
| 7 | 5d | 1.412111 | -.01104863 |
| ORB.ENERGY,a.u. | -1.677100 | ||
| NORM | .999998 | < R > | 3.691354 | < R2 > | 15.471245 | < 1/R > | .378587 | < 1/R**2 > | .302061 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.840599 | 1.14477864 |
| 2 | 3p | 6.969010 | -.16594591 |
| 3 | 2p | 14.546849 | .01918762 |
| 4 | 4p | 16.545846 | .00505910 |
| 5 | 5p | 27.445922 | -.00053271 |
| 6 | 5p | 1.477726 | .00009412 |
| 7 | 4p | 3.602628 | -.00023964 |
| 8 | 3p | 49.631177 | .00002731 |
| ORB.ENERGY,a.u. | -15.233000 | ||
| NORM | 1.000000 | < R > | .409629 | < R2 > | .203813 | < 1/R > | 3.098834 | < 1/R**2 > | 13.060442 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 11.929580 | .41148425 |
| 2 | 2s | 6.446418 | -.85480119 |
| 3 | 3s | 6.620677 | -.28069570 |
| 4 | 4s | 25.095896 | .00222578 |
| 5 | 3s | 14.143823 | .01658955 |
| 6 | 5s | 6.634590 | -.02587808 |
| ORB.ENERGY,a.u. | -14.334000 | ||
| NORM | 1.000000 | < R > | .467117 | < R2 > | .255842 | < 1/R > | 3.134429 | < 1/R**2 > | 39.890016 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.110172 | .92170784 |
| 2 | 1s | 21.589163 | .07719242 |
| 3 | 2s | 13.468758 | .01932144 |
| 4 | 3s | 16.733218 | -.01553581 |
| 5 | 5s | 35.646933 | .00099102 |
| 6 | 4s | 86.751057 | -.00003359 |
| 7 | 5s | 11.530598 | .00052517 |
| ORB.ENERGY,a.u. | -89.095000 |
| NORM | 1.000000 | < R > | .103184 | < R2 > | .014276 | < 1/R > | 14.628574 | < 1/R**2 > | 431.108008 |
Total Energy= -293.35989165 a.u.
Kinetic Energy= 293.37216289 a.u.
Potential Energy= -586.73205454 a.u.
Virial Ratio = -1.99995817