(1s 1 2p 1 ) 1 P Ne 8+
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 | 17.927530 | .00157226 |
| 2 | 2p | 4.459009 | .98437602 |
| 3 | 3p | 6.181314 | .01562653 |
| 4 | 5p | 4.204640 | -.00049758 |
| 5 | 5p | 24.753763 | -.00030251 |
| ORB.ENERGY,a.u. | -10.121000 | ||
| NORM | 1.000000 | < R > | .560329 | < R2 > | .376500 | < 1/R > | 2.229692 | < 1/R**2 > | 6.631743 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 9.846739 | .75757598 |
| 2 | 1s | 10.102238 | .25684706 |
| 3 | 2s | 9.808755 | -.01585234 |
| 4 | 3s | 6.156562 | -.00098423 |
| 5 | 4s | 16.223130 | -.00057374 |
| ORB.ENERGY,a.u. | -47.621000 |
| NORM | 1.000000 | < R > | .149780 | < R2 > | .029896 | < 1/R > | 10.010464 | < 1/R**2 > | 200.343850 |
Total Energy= -60.23400231 a.u.
Kinetic Energy= 60.04790326 a.u.
Potential Energy= -120.28190557 a.u.
Virial Ratio = -2.00309918