(1s 1 4d 1 ) 3 D He 0
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3242.
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 | 4d- electron | |
| 1 | 3d | .321098 | 1.06244132 |
| 2 | 4d | .245384 | -1.78542183 |
| 3 | 5d | .354236 | .31611353 |
| 4 | 4d | .711742 | -.02527095 |
| 5 | 5d | 6.271141 | .00002541 |
| 6 | 4d | 1.353350 | -.00258454 |
| ORB.ENERGY,a.u. | -.031366 | ||
| NORM | 1.000002 | < R > | 20.990582 | < R2 > | 503.599280 | < 1/R > | .062556 | < 1/R**2 > | .006270 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 1.944437 | .75310708 |
| 2 | 1s | 2.094629 | .25941951 |
| 3 | 2s | 1.912602 | -.01332751 |
| 4 | 3s | 2.155969 | -.00130879 |
| 5 | 4s | 3.719332 | .00008706 |
| ORB.ENERGY,a.u. | -1.906400 |
| NORM | 1.000000 | < R > | .750017 | < R2 > | .750047 | < 1/R > | 1.999977 | < 1/R**2 > | 7.999864 |
Total Energy= -2.03171338 a.u.
Kinetic Energy= 2.03125907 a.u.
Potential Energy= -4.06297245 a.u.
Virial Ratio = -2.00022366