(1s 1 5s 1 ) 3 S S 14+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3050.
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 | 5s- electron | |
| 1 | 1s | 11.025498 | .14559188 |
| 2 | 2s | 4.413356 | -2.01906458 |
| 3 | 3s | 3.331266 | 7.71250039 |
| 4 | 4s | 2.787720 | -19.90163705 |
| 5 | 5s | 2.948174 | 14.84285137 |
| 6 | 2s | 7.992147 | .20323024 |
| 7 | 5s | 25.821061 | .00085673 |
| 8 | 4s | 1.753053 | .00926828 |
| 9 | 4s | 36.773678 | .00010511 |
| ORB.ENERGY,a.u. | -4.999600 | ||
| NORM | 1.000000 | < R > | 2.471080 | < R2 > | 6.838564 | < 1/R > | .603415 | < 1/R**2 > | 3.601362 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 15.765773 | .88939815 |
| 2 | 1s | 18.406221 | .10542699 |
| 3 | 2s | 16.682282 | .01065536 |
| 4 | 3s | 16.753807 | -.00519745 |
| 5 | 4s | 13.179056 | -.00001513 |
| 6 | 5s | 20.930957 | .00011102 |
| ORB.ENERGY,a.u. | -127.880000 |
| NORM | 1.000000 | < R > | .093750 | < R2 > | .011719 | < 1/R > | 16.000239 | < 1/R**2 > | 512.016691 |
Total Energy= -132.54488882 a.u.
Kinetic Energy= 132.55331456 a.u.
Potential Energy= -265.09820338 a.u.
Virial Ratio = -1.99993644