(1s 1 4s 1 ) 3 S F 7+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3040.
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 | 4s- electron | |
| 1 | 1s | 5.684243 | .21935791 |
| 2 | 2s | 3.051919 | -1.05198383 |
| 3 | 3s | 1.837201 | 5.09709701 |
| 4 | 4s | 1.971878 | -5.38192511 |
| 5 | 5s | 3.000764 | .45304790 |
| 6 | 4s | 5.350711 | -.08127244 |
| 7 | 5s | 32.553424 | -.00007942 |
| ORB.ENERGY,a.u. | -2.100200 | ||
| NORM | 1.000000 | < R > | 2.921423 | < R2 > | 9.599888 | < 1/R > | .506690 | < 1/R**2 > | 2.014435 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 8.856755 | .75719099 |
| 2 | 1s | 9.102258 | .25650411 |
| 3 | 2s | 8.907813 | -.01558656 |
| 4 | 3s | 10.927636 | -.00030823 |
| 5 | 4s | 9.347434 | .00011145 |
| ORB.ENERGY,a.u. | -40.069000 |
| NORM | 1.000000 | < R > | .166662 | < R2 > | .037037 | < 1/R > | 9.000497 | < 1/R**2 > | 162.018603 |
Total Energy= -42.54620421 a.u.
Kinetic Energy= 42.55487092 a.u.
Potential Energy= -85.10107513 a.u.
Virial Ratio = -1.99979634