(1s 1 2p 1 ) 1 P He 0
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 | .492518 | 1.01859447 |
| 2 | 2p | .964720 | -.02297205 |
| 3 | 3p | 9.537648 | .00039845 |
| 4 | 4p | 3.053703 | -.00395656 |
| 5 | 5p | 17.305113 | -.00011248 |
| 6 | 3p | 54.975753 | .00000427 |
| ORB.ENERGY,a.u. | -.122572 | ||
| NORM | 1.000000 | < R > | 5.140976 | < R2 > | 31.570353 | < 1/R > | .241336 | < 1/R**2 > | .076778 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 1.944981 | .75945331 |
| 2 | 1s | 2.102347 | .25327342 |
| 3 | 2s | 1.744554 | -.01486241 |
| 4 | 3s | .885890 | -.00194745 |
| ORB.ENERGY,a.u. | -1.622600 |
| NORM | 1.000000 | < R > | .748142 | < R2 > | .745207 | < 1/R > | 2.002949 | < 1/R**2 > | 8.018095 |
Total Energy= -2.12715180 a.u.
Kinetic Energy= 2.12246210 a.u.
Potential Energy= -4.24961391 a.u.
Virial Ratio = -2.00220956