(1s 2 2s 2 2p 3 5p 1 ) 3 P Na 3+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3151.
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 | 2.592122 | .15925105 |
| 2 | 3p | 1.159508 | -1.80804220 |
| 3 | 4p | .999366 | 3.85638732 |
| 4 | 5p | .855540 | -2.80499338 |
| 5 | 2p | 6.139342 | .03521466 |
| 6 | 5p | 17.285350 | -.00068077 |
| 7 | 4p | 25.295597 | -.00021630 |
| 8 | 4p | .367901 | .00113247 |
| ORB.ENERGY,a.u. | -.371350 | ||
| NORM | 1.000002 | < R > | 7.861961 | < R2 > | 69.447772 | < 1/R > | .176331 | < 1/R**2 > | .100350 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.751978 | 1.51119599 |
| 2 | 3p | 4.864605 | -.65595648 |
| 3 | 4p | 6.041028 | .13999733 |
| 4 | 5p | 1.206857 | .13456764 |
| 5 | 4p | 1.024647 | -.14924283 |
| 6 | 4p | 15.169872 | -.00377222 |
| 7 | 3p | 16.760197 | -.00173074 |
| 8 | 3p | 1.300427 | .02632550 |
| 9 | 5p | .689547 | -.00506041 |
| ORB.ENERGY,a.u. | -4.881300 | ||
| NORM | 1.000000 | < R > | .644148 | < R2 > | .514659 | < 1/R > | 2.002264 | < 1/R**2 > | 5.553525 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 8.998953 | .35094845 |
| 2 | 2s | 4.340357 | -.83784079 |
| 3 | 3s | 3.916208 | -.28174176 |
| 4 | 4s | 17.606285 | .00261710 |
| 5 | 3s | 10.819313 | .01759494 |
| 6 | 5s | 4.076287 | -.01340946 |
| ORB.ENERGY,a.u. | -4.555500 | ||
| NORM | 1.000000 | < R > | .703468 | < R2 > | .584941 | < 1/R > | 2.060777 | < 1/R**2 > | 17.361398 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.165420 | .90296204 |
| 2 | 1s | 15.521397 | .09697353 |
| 3 | 2s | 8.942574 | .01718490 |
| 4 | 3s | 12.699558 | -.01503436 |
| 5 | 4s | 20.246020 | .00391614 |
| 6 | 5s | 39.856853 | .00009150 |
| 7 | 5s | 7.540653 | .00087913 |
| ORB.ENERGY,a.u. | -42.494000 |
| NORM | 1.000000 | < R > | .142454 | < R2 > | .027283 | < 1/R > | 10.625289 | < 1/R**2 > | 228.114437 |
Total Energy= -154.23150398 a.u.
Kinetic Energy= 154.22658836 a.u.
Potential Energy= -308.45809234 a.u.
Virial Ratio = -2.00003187