(1s 1 3d 1 ) 1 D F 7+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1232.
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 | 3d- electron | |
| 1 | 3d | 2.689108 | .97711982 |
| 2 | 4d | 2.521293 | .02991170 |
| 3 | 4d | 5.479441 | -.00200479 |
| 4 | 5d | 2.391415 | -.00357470 |
| 5 | 5d | 14.647189 | -.00029529 |
| ORB.ENERGY,a.u. | -3.599000 | ||
| NORM | 1.000000 | < R > | 1.313051 | < R2 > | 1.970248 | < 1/R > | .888401 | < 1/R**2 > | .946912 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 8.855893 | .75723704 |
| 2 | 1s | 9.102258 | .25652589 |
| 3 | 2s | 8.912968 | -.01575880 |
| 4 | 3s | 7.215064 | -.00019508 |
| ORB.ENERGY,a.u. | -39.599000 |
| NORM | 1.000000 | < R > | .166655 | < R2 > | .037030 | < 1/R > | 9.000339 | < 1/R**2 > | 162.009124 |
Total Energy= -44.06898686 a.u.
Kinetic Energy= 44.05471149 a.u.
Potential Energy= -88.12369835 a.u.
Virial Ratio = -2.00032404