(1s 1 4s 1 ) 1 S Ne 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1040.
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 | 3.999827 | .24657743 |
| 2 | 2s | 3.180651 | -2.09304297 |
| 3 | 3s | 2.360426 | 4.64615376 |
| 4 | 4s | 2.232474 | -3.83493433 |
| 5 | 2s | 5.139717 | .28820945 |
| 6 | 5s | 6.587974 | .04343192 |
| 7 | 4s | 18.968503 | .00080972 |
| 8 | 5s | 1.915958 | .02608293 |
| ORB.ENERGY,a.u. | -2.647000 | ||
| NORM | .999998 | < R > | 2.614774 | < R2 > | 7.696286 | < 1/R > | .526353 | < 1/R**2 > | 1.101627 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 1.173263 | .25028316 |
| 2 | 1s | 10.013711 | .99266168 |
| 3 | 2s | 3.921132 | -.12805509 |
| 4 | 3s | 1.787278 | -.22059261 |
| 5 | 4s | 3.251091 | .07844528 |
| 6 | 1s | .849857 | -.01789723 |
| 7 | 5s | 4.798126 | -.02315606 |
| 8 | 4s | 27.827839 | .00001912 |
| ORB.ENERGY,a.u. | -49.522000 |
| NORM | 1.000000 | < R > | .153672 | < R2 > | .045097 | < 1/R > | 10.041424 | < 1/R**2 > | 201.473086 |
Total Energy= -52.58915987 a.u.
Kinetic Energy= 52.57796177 a.u.
Potential Energy= -105.16712164 a.u.
Virial Ratio = -2.00021298