(1s 1 2p 1 ) 1 P S 14+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1121.
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 | 2p- electron | |
| 1 | 2p | 7.344921 | .92543002 |
| 2 | 2p | 8.225826 | .07525576 |
| 3 | 2p | 27.198896 | .00140658 |
| 4 | 3p | 11.469189 | .00719349 |
| 5 | 4p | 7.657674 | -.01019053 |
| 6 | 5p | 42.543747 | -.00014260 |
| ORB.ENERGY,a.u. | -28.473000 | ||
| NORM | 1.000000 | < R > | .335101 | < R2 > | .134701 | < 1/R > | 3.729454 | < 1/R**2 > | 18.553966 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 15.775201 | .88940589 |
| 2 | 1s | 18.381054 | .10552322 |
| 3 | 2s | 18.310014 | .00878926 |
| 4 | 3s | 13.435829 | -.00600827 |
| 5 | 4s | 14.745324 | .00119496 |
| 6 | 5s | 18.318172 | .00148774 |
| ORB.ENERGY,a.u. | -124.470000 |
| NORM | 1.000000 | < R > | .093665 | < R2 > | .011694 | < 1/R > | 16.010686 | < 1/R**2 > | 512.567879 |
Total Energy= -156.32670874 a.u.
Kinetic Energy= 155.98882187 a.u.
Potential Energy= -312.31553062 a.u.
Virial Ratio = -2.00216610