(1s 2 2s 2 ) 1 S Si 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1020.
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 | 11.729634 | .39537028 |
| 2 | 2s | 5.716955 | -.79764910 |
| 3 | 3s | 7.146391 | -.29372372 |
| 4 | 5s | 13.541066 | -.01875359 |
| 5 | 4s | 27.653705 | .00293485 |
| 6 | 5s | 40.224216 | -.00051032 |
| 7 | 4s | 2.338320 | .00003877 |
| ORB.ENERGY,a.u. | -17.331000 | ||
| NORM | 1.000000 | < R > | .481976 | < R2 > | .271347 | < 1/R > | 3.042885 | < 1/R**2 > | 37.307922 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 13.435763 | .94277615 |
| 2 | 1s | 22.832429 | .04260287 |
| 3 | 2s | 18.529758 | .01714691 |
| 4 | 3s | 13.180641 | .00414517 |
| 5 | 4s | 53.811596 | -.00063740 |
| 6 | 5s | 71.346688 | .00023631 |
| ORB.ENERGY,a.u. | -84.439000 |
| NORM | 1.000000 | < R > | .110274 | < R2 > | .016279 | < 1/R > | 13.671194 | < 1/R**2 > | 376.208136 |
Total Energy= -223.82207867 a.u.
Kinetic Energy= 223.82208186 a.u.
Potential Energy= -447.64416054 a.u.
Virial Ratio = -1.99999999