(1s 1 5s 1 ) 3 S Ne 8+
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 | 7.454476 | .12366929 |
| 2 | 2s | 2.628956 | -2.00546697 |
| 3 | 3s | 2.160081 | 6.09703564 |
| 4 | 4s | 1.662690 | -16.67130888 |
| 5 | 5s | 1.765992 | 13.29109211 |
| 6 | 2s | 5.051963 | .19675741 |
| 7 | 5s | 9.523267 | -.00439095 |
| 8 | 3s | 45.509394 | .00001825 |
| 9 | 4s | .881125 | .00322156 |
| ORB.ENERGY,a.u. | -1.719400 | ||
| NORM | 1.000007 | < R > | 4.088391 | < R2 > | 18.718939 | < 1/R > | .363414 | < 1/R**2 > | 1.296306 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 9.843366 | .75704791 |
| 2 | 1s | 10.102123 | .25675982 |
| 3 | 2s | 9.897037 | -.01582869 |
| 4 | 3s | 13.631206 | -.00011141 |
| ORB.ENERGY,a.u. | -49.719000 |
| NORM | 1.000000 | < R > | .149998 | < R2 > | .030000 | < 1/R > | 10.000239 | < 1/R**2 > | 200.010176 |
Total Energy= -51.64651216 a.u.
Kinetic Energy= 51.65142322 a.u.
Potential Energy= -103.29793538 a.u.
Virial Ratio = -1.99990492