(1s 2 2s 2 2p 2 5d 1 ) 4 F N 0
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 | .266293 | 1.37553280 |
| 2 | 4d | .208687 | -4.44211229 |
| 3 | 5d | .197655 | 3.93254288 |
| 4 | 3d | 1.520149 | .01049409 |
| 5 | 4d | .153934 | -.13644756 |
| 6 | 5d | 1.103295 | .00948094 |
| 7 | 4d | 4.175626 | .00063965 |
| 8 | 5d | 15.252507 | .00002720 |
| ORB.ENERGY,a.u. | -.020265 | ||
| NORM | .999999 | < R > | 33.945286 | < R2 > | 1309.604893 | < 1/R > | .041333 | < 1/R**2 > | .003637 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 1.750371 | .72825239 |
| 2 | 2p | 2.988599 | .27681275 |
| 3 | 2p | 6.925714 | .01687912 |
| 4 | 3p | .948181 | .03380321 |
| 5 | 2p | 4.235579 | .00889419 |
| 6 | 5p | 8.347610 | .00453731 |
| 7 | 5p | 8.346706 | -.00082229 |
| 8 | 5p | 1.164017 | -.01774729 |
| ORB.ENERGY,a.u. | -1.008900 | ||
| NORM | 1.000000 | < R > | 1.243894 | < R2 > | 1.933287 | < 1/R > | 1.055835 | < 1/R**2 > | 1.580196 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 5.897136 | .28629659 |
| 2 | 2s | 2.455393 | -.83259826 |
| 3 | 3s | 1.982148 | -.26756136 |
| 4 | 4s | 8.329055 | .02232457 |
| 5 | 3s | 10.182234 | .00708750 |
| 6 | 5s | 2.839985 | -.01429584 |
| 7 | 5s | 16.440074 | .00092590 |
| 8 | 3s | .975570 | -.00045270 |
| ORB.ENERGY,a.u. | -.654320 | ||
| NORM | 1.000000 | < R > | 1.252843 | < R2 > | 1.874271 | < 1/R > | 1.140842 | < 1/R**2 > | 5.286959 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 6.229947 | .71796200 |
| 2 | 1s | 9.302552 | .22514558 |
| 3 | 1s | 2.644631 | .00479651 |
| 4 | 2s | 6.904795 | .08345079 |
| 5 | 3s | 7.780630 | -.02157632 |
| 6 | 4s | 12.685516 | .00689273 |
| 7 | 5s | 28.102408 | .00016980 |
| ORB.ENERGY,a.u. | -15.024000 |
| NORM | 1.000000 | < R > | .228084 | < R2 > | .070094 | < 1/R > | 6.656728 | < 1/R**2 > | 89.910993 |
Total Energy= -53.90836625 a.u.
Kinetic Energy= 53.90826847 a.u.
Potential Energy= -107.81663473 a.u.
Virial Ratio = -2.00000181