(1s 1 3d 1 ) 1 D Mg 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1232.
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 | 3d- electron | |
| 1 | 3d | 3.665918 | 1.00016407 |
| 2 | 3d | 9.079485 | -.00033070 |
| 3 | 4d | 39.096688 | .00002404 |
| ORB.ENERGY,a.u. | -6.861100 | ||
| NORM | 1.000000 | < R > | .954873 | < R2 > | 1.041976 | < 1/R > | 1.221682 | < 1/R**2 > | 1.790726 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 11.745381 | .88929133 |
| 2 | 1s | 14.405451 | .10559679 |
| 3 | 2s | 14.311335 | .01066856 |
| 4 | 3s | 12.044311 | -.00534366 |
| 5 | 4s | 6.530802 | -.00004020 |
| 6 | 5s | 13.293542 | .00012205 |
| ORB.ENERGY,a.u. | -70.861000 |
| NORM | 1.000000 | < R > | .124993 | < R2 > | .020830 | < 1/R > | 12.000394 | < 1/R**2 > | 288.014088 |
Total Energy= -78.74191466 a.u.
Kinetic Energy= 78.72098788 a.u.
Potential Energy= -157.46290254 a.u.
Virial Ratio = -2.00026583