(1s 2 5s 1 ) 2 S P 12+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2050.
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 | 5s- electron | |
| 1 | 1s | 5.981764 | .24376904 |
| 2 | 2s | 2.584970 | -4.90288999 |
| 3 | 3s | 2.686853 | 15.30133230 |
| 4 | 4s | 2.777935 | -16.43864737 |
| 5 | 5s | 2.608179 | 6.30494967 |
| 6 | 5s | 14.730635 | -.00258312 |
| 7 | 1s | 16.896385 | .01349634 |
| 8 | 4s | 58.544907 | -.00002759 |
| ORB.ENERGY,a.u. | -3.461200 | ||
| NORM | 1.000003 | < R > | 2.822459 | < R2 > | 8.922084 | < 1/R > | .527301 | < 1/R**2 > | 2.786991 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.430588 | .93850795 |
| 2 | 1s | 22.828587 | .04913370 |
| 3 | 2s | 17.513849 | .01708121 |
| 4 | 3s | 13.517400 | .00073590 |
| 5 | 4s | 49.657712 | -.00068291 |
| 6 | 5s | 60.166578 | .00022418 |
| 7 | 3s | 82.949744 | -.00003518 |
| ORB.ENERGY,a.u. | -102.970000 |
| NORM | 1.000000 | < R > | .102575 | < R2 > | .014075 | < 1/R > | 14.686905 | < 1/R**2 > | 433.857133 |
Total Energy= -219.19131859 a.u.
Kinetic Energy= 219.19129062 a.u.
Potential Energy= -438.38260921 a.u.
Virial Ratio = -2.00000013