(1s 1 3p 1 ) 1 P S 14+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1131.
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 | 3p- electron | |
| 1 | 2p | 6.215799 | .94371939 |
| 2 | 3p | 4.835848 | -1.65479010 |
| 3 | 2p | 3.384003 | .08023454 |
| 4 | 4p | 8.196533 | .08502051 |
| 5 | 5p | 16.130922 | .00651252 |
| 6 | 4p | 38.566791 | -.00112540 |
| 7 | 5p | 51.019718 | .00034464 |
| 8 | 5p | 3.219152 | -.00127623 |
| 9 | 3p | 10.319855 | .00434043 |
| 10 | 3p | 84.197488 | -.00001314 |
| ORB.ENERGY,a.u. | -12.923000 | ||
| NORM | 1.000000 | < R > | .835437 | < R2 > | .804181 | < 1/R > | 1.663521 | < 1/R**2 > | 5.538771 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 15.766542 | .88939788 |
| 2 | 1s | 18.406670 | .10541921 |
| 3 | 2s | 16.718593 | .01066824 |
| 4 | 3s | 17.045262 | -.00509569 |
| 5 | 4s | 53.106404 | .00000982 |
| 6 | 5s | 8.311422 | .00016699 |
| ORB.ENERGY,a.u. | -126.700000 |
| NORM | 1.000000 | < R > | .093750 | < R2 > | .011720 | < 1/R > | 16.000876 | < 1/R**2 > | 512.061020 |
Total Energy= -140.56039617 a.u.
Kinetic Energy= 140.46687574 a.u.
Potential Energy= -281.02727191 a.u.
Virial Ratio = -2.00066578