(1s 2 5p 1 ) 2 P Mg 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2151.
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 | 5p- electron | |
| 1 | 2p | 1.385946 | 7.09488329 |
| 2 | 3p | 2.455409 | -7.03406775 |
| 3 | 4p | 1.815749 | 8.19375034 |
| 4 | 5p | 1.925187 | -9.85571767 |
| 5 | 2p | 11.983043 | .00504161 |
| 6 | 5p | 14.351705 | .00120033 |
| 7 | 5p | 1.267297 | -.06530393 |
| 8 | 4p | .801949 | .00676051 |
| ORB.ENERGY,a.u. | -2.016700 | ||
| NORM | 1.000013 | < R > | 3.620972 | < R2 > | 14.763811 | < 1/R > | .404442 | < 1/R**2 > | .558428 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 11.447380 | .93534176 |
| 2 | 1s | 18.680635 | .05189438 |
| 3 | 2s | 14.643837 | .01681501 |
| 4 | 3s | 12.241480 | .00271702 |
| 5 | 4s | 25.325953 | -.00074292 |
| 6 | 5s | 28.492270 | .00045093 |
| 7 | 3s | 33.724822 | -.00047867 |
| ORB.ENERGY,a.u. | -64.288000 |
| NORM | 1.000000 | < R > | .129062 | < R2 > | .022301 | < 1/R > | 11.686226 | < 1/R**2 > | 275.094314 |
Total Energy= -138.62673470 a.u.
Kinetic Energy= 138.62670531 a.u.
Potential Energy= -277.25344000 a.u.
Virial Ratio = -2.00000021