(1s 1 4s 1 ) 3 S Na 9+
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 | 6.790982 | .23256579 |
| 2 | 2s | 3.514740 | -1.29801286 |
| 3 | 3s | 2.320218 | 5.69072046 |
| 4 | 4s | 2.470943 | -5.65388866 |
| 5 | 5s | 3.726569 | .34324180 |
| 6 | 4s | 6.573080 | -.06715917 |
| 7 | 5s | 40.559727 | -.00007001 |
| ORB.ENERGY,a.u. | -3.295600 | ||
| NORM | 1.000002 | < R > | 2.349025 | < R2 > | 6.206773 | < 1/R > | .631690 | < 1/R**2 > | 3.143739 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.740556 | .88921273 |
| 2 | 1s | 13.406930 | .10562404 |
| 3 | 2s | 13.828088 | .01064516 |
| 4 | 3s | 10.555929 | -.00550346 |
| 5 | 4s | 28.836917 | .00004265 |
| 6 | 5s | 11.335988 | .00041644 |
| ORB.ENERGY,a.u. | -60.014000 |
| NORM | 1.000000 | < R > | .136361 | < R2 > | .024794 | < 1/R > | 11.000510 | < 1/R**2 > | 242.023489 |
Total Energy= -63.68328016 a.u.
Kinetic Energy= 63.69428890 a.u.
Potential Energy= -127.37756906 a.u.
Virial Ratio = -1.99982716