(1s 1 2p 1 ) 3 P Na 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3121.
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 | 5.084239 | .98264764 |
| 2 | 2p | 10.617749 | .01473876 |
| 3 | 2p | 55.620819 | -.00000292 |
| 4 | 3p | 4.996811 | .01255625 |
| 5 | 4p | 6.488558 | -.00480007 |
| 6 | 5p | 20.299290 | -.00049919 |
| ORB.ENERGY,a.u. | -12.819000 | ||
| NORM | 1.000000 | < R > | .489551 | < R2 > | .288404 | < 1/R > | 2.564091 | < 1/R**2 > | 8.821733 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.704298 | .91676110 |
| 2 | 1s | 14.324542 | .07846510 |
| 3 | 2s | 13.974561 | .01105988 |
| 4 | 3s | 13.310168 | -.00481867 |
| 5 | 4s | 19.358734 | -.00002450 |
| 6 | 5s | 9.772080 | .00080259 |
| ORB.ENERGY,a.u. | -58.194000 |
| NORM | 1.000000 | < R > | .137103 | < R2 > | .025114 | < 1/R > | 10.959989 | < 1/R**2 > | 240.603119 |
Total Energy= -73.13274937 a.u.
Kinetic Energy= 73.21200773 a.u.
Potential Energy= -146.34475710 a.u.
Virial Ratio = -1.99891741