(1s 1 4d 1 ) 1 D N 5+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1242.
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 | 4d- electron | |
| 1 | 3d | 1.736361 | 1.26077474 |
| 2 | 4d | 1.481064 | -1.92384881 |
| 3 | 4d | 2.493083 | .05316038 |
| 4 | 5d | 2.064068 | .15264868 |
| 5 | 5d | 31.433049 | .00001713 |
| 6 | 4d | 8.434515 | -.00006487 |
| ORB.ENERGY,a.u. | -1.140800 | ||
| NORM | 1.000000 | < R > | 3.501254 | < R2 > | 14.009263 | < 1/R > | .374779 | < 1/R**2 > | .224617 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 6.880689 | .75767424 |
| 2 | 1s | 7.102356 | .25599746 |
| 3 | 2s | 6.931309 | -.01556148 |
| 4 | 3s | 6.518782 | -.00026877 |
| ORB.ENERGY,a.u. | -24.110000 |
| NORM | 1.000000 | < R > | .214278 | < R2 > | .061219 | < 1/R > | 7.000147 | < 1/R**2 > | 98.003101 |
Total Energy= -25.62990694 a.u.
Kinetic Energy= 25.62470291 a.u.
Potential Energy= -51.25460985 a.u.
Virial Ratio = -2.00020309