(1s 1 4d 1 ) 3 D Ar 16+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3242.
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 | 4.437785 | 1.82569745 |
| 2 | 4d | 4.238984 | -2.33188910 |
| 3 | 3d | 16.169083 | .00053948 |
| 4 | 4d | 3.426860 | .00192917 |
| 5 | 5d | 25.134104 | -.00015548 |
| ORB.ENERGY,a.u. | -9.739900 | ||
| NORM | 1.000000 | < R > | 1.234816 | < R2 > | 1.742713 | < 1/R > | 1.063211 | < 1/R**2 > | 1.809956 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.774089 | .88945834 |
| 2 | 1s | 20.407096 | .10537906 |
| 3 | 2s | 17.896388 | .01065053 |
| 4 | 3s | 18.752477 | -.00513292 |
| 5 | 4s | 31.553566 | .00001726 |
| 6 | 5s | 18.909549 | .00001439 |
| ORB.ENERGY,a.u. | -161.610000 |
| NORM | 1.000000 | < R > | .083338 | < R2 > | .009261 | < 1/R > | 17.999463 | < 1/R**2 > | 647.971272 |
Total Energy= -171.04827527 a.u.
Kinetic Energy= 171.03370582 a.u.
Potential Energy= -342.08198109 a.u.
Virial Ratio = -2.00008518