(1s 1 4d 1 ) 1 D S 14+
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 | 3.833336 | 1.96629073 |
| 2 | 4d | 3.747069 | -2.47900928 |
| 3 | 3d | 6.038899 | -.00087402 |
| 4 | 4d | 17.826742 | -.00012188 |
| 5 | 5d | 73.955038 | .00000781 |
| ORB.ENERGY,a.u. | -7.471000 | ||
| NORM | 1.000000 | < R > | 1.400270 | < R2 > | 2.240805 | < 1/R > | .937213 | < 1/R**2 > | 1.405044 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 15.765580 | .88939918 |
| 2 | 1s | 18.406895 | .10542438 |
| 3 | 2s | 16.671888 | .01065860 |
| 4 | 3s | 16.658005 | -.00522771 |
| 5 | 4s | 25.161615 | .00000263 |
| 6 | 5s | 22.024636 | .00009586 |
| ORB.ENERGY,a.u. | -127.470000 |
| NORM | 1.000000 | < R > | .093748 | < R2 > | .011718 | < 1/R > | 16.000207 | < 1/R**2 > | 512.009962 |
Total Energy= -135.04595205 a.u.
Kinetic Energy= 135.03024810 a.u.
Potential Energy= -270.07620016 a.u.
Virial Ratio = -2.00011630