(1s 1 2s 1 ) 3 S He 0
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3020.
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 | 2s- electron | |
| 1 | 1s | 1.809952 | .21552391 |
| 2 | 2s | .577993 | -.68442966 |
| 3 | 3s | .949258 | -.30653625 |
| 4 | 4s | 2.302833 | .01222266 |
| 5 | 5s | .906680 | -.09777982 |
| 6 | 4s | .788219 | .03305837 |
| ORB.ENERGY,a.u. | -.174366 | ||
| NORM | 1.000000 | < R > | 4.370777 | < R2 > | 22.373430 | < 1/R > | .305903 | < 1/R**2 > | .323649 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 1.946233 | .75341261 |
| 2 | 1s | 2.090396 | .26047049 |
| 3 | 2s | 1.982522 | -.01196402 |
| 4 | 3s | 2.132028 | -.00579888 |
| 5 | 4s | 5.065338 | .00021972 |
| 6 | 5s | 2.238509 | .00160477 |
| ORB.ENERGY,a.u. | -1.674400 |
| NORM | 1.000000 | < R > | .748928 | < R2 > | .748090 | < 1/R > | 2.002836 | < 1/R**2 > | 8.020290 |
Total Energy= -2.16721489 a.u.
Kinetic Energy= 2.17425089 a.u.
Potential Energy= -4.34146578 a.u.
Virial Ratio = -1.99676394