(1s 1 4d 1 ) 1 D F 7+
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 | 2.326055 | 1.23970015 |
| 2 | 4d | 1.971340 | -1.89696678 |
| 3 | 4d | 3.360857 | .05170616 |
| 4 | 5d | 2.776995 | .14911077 |
| 5 | 5d | 41.565468 | .00001547 |
| 6 | 5d | 1.241172 | .00048824 |
| ORB.ENERGY,a.u. | -2.043600 | ||
| NORM | .999999 | < R > | 2.625792 | < R2 > | 7.879387 | < 1/R > | .499753 | < 1/R**2 > | .399437 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 8.855676 | .75723431 |
| 2 | 1s | 9.102369 | .25653436 |
| 3 | 2s | 8.916228 | -.01575989 |
| 4 | 3s | 8.181484 | -.00017135 |
| ORB.ENERGY,a.u. | -40.012000 |
| NORM | 1.000000 | < R > | .166661 | < R2 > | .037034 | < 1/R > | 9.000169 | < 1/R**2 > | 162.004596 |
Total Energy= -42.50702069 a.u.
Kinetic Energy= 42.49954760 a.u.
Potential Energy= -85.00656829 a.u.
Virial Ratio = -2.00017584