(1s 1 4p 1 ) 3 P Ne 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3141.
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 | 4p- electron | |
| 1 | 2p | 2.629283 | 1.62199781 |
| 2 | 3p | 2.707605 | -3.10944551 |
| 3 | 4p | 2.188968 | 2.41307394 |
| 4 | 5p | 3.137998 | -.33941857 |
| 5 | 2p | 13.987417 | .00096681 |
| 6 | 4p | 10.009759 | -.00432493 |
| 7 | 5p | 1.721869 | -.00858396 |
| 8 | 5p | 21.923729 | -.00016339 |
| ORB.ENERGY,a.u. | -2.621400 | ||
| NORM | 1.000000 | < R > | 2.532488 | < R2 > | 7.275232 | < 1/R > | .569008 | < 1/R**2 > | .877247 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 9.839017 | .75703333 |
| 2 | 1s | 10.102312 | .25686415 |
| 3 | 2s | 10.011262 | -.01595133 |
| 4 | 3s | 6.042708 | -.00029815 |
| 5 | 4s | 10.289477 | .00026745 |
| 6 | 5s | 32.237776 | -.00001268 |
| ORB.ENERGY,a.u. | -49.496000 |
| NORM | 1.000000 | < R > | .150074 | < R2 > | .030032 | < 1/R > | 9.996296 | < 1/R**2 > | 199.878610 |
Total Energy= -52.54582050 a.u.
Kinetic Energy= 52.55352445 a.u.
Potential Energy= -105.09934495 a.u.
Virial Ratio = -1.99985341