(1s 1 5d 1 ) 3 D Na 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3252.
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 | 1.999904 | 3.55248718 |
| 2 | 4d | 2.000201 | -8.87083806 |
| 3 | 5d | 2.001097 | 6.00900800 |
| 4 | 3d | 8.690497 | .00090663 |
| 5 | 5d | 14.188008 | -.00032825 |
| 6 | 4d | 1.485858 | .00451409 |
| ORB.ENERGY,a.u. | -2.098700 | ||
| NORM | .999997 | < R > | 3.448449 | < R2 > | 13.488774 | < 1/R > | .400348 | < 1/R**2 > | .321016 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.739769 | .88921395 |
| 2 | 1s | 13.406439 | .10563709 |
| 3 | 2s | 13.797450 | .01063625 |
| 4 | 3s | 10.473005 | -.00554387 |
| 5 | 4s | 26.983628 | .00004363 |
| 6 | 5s | 10.873604 | .00044189 |
| ORB.ENERGY,a.u. | -60.179000 |
| NORM | 1.000000 | < R > | .136369 | < R2 > | .024796 | < 1/R > | 10.999756 | < 1/R**2 > | 241.992000 |
Total Energy= -62.50548345 a.u.
Kinetic Energy= 62.50078197 a.u.
Potential Energy= -125.00626542 a.u.
Virial Ratio = -2.00007522