(1s 2 2s 2 2p 1 3s 1 ) 1 P Si 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1130.
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 | 3s- electron | |
| 1 | 1s | 11.057169 | .18705304 |
| 2 | 2s | 3.909785 | -1.16066821 |
| 3 | 3s | 3.340990 | 1.74946996 |
| 4 | 4s | 8.229790 | -.04224329 |
| 5 | 5s | 15.560870 | -.00770687 |
| 6 | 5s | 2.935896 | .00273440 |
| 7 | 4s | 28.214422 | .00027698 |
| ORB.ENERGY,a.u. | -5.423700 | ||
| NORM | 1.000000 | < R > | 1.265300 | < R2 > | 1.803636 | < 1/R > | 1.108149 | < 1/R**2 > | 7.203754 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.669887 | 1.08714041 |
| 2 | 3p | 7.113978 | -.11857760 |
| 3 | 2p | 13.578688 | .01535919 |
| 4 | 5p | 10.599653 | .00887078 |
| 5 | 4p | 39.599051 | -.00003052 |
| 6 | 5p | 17.921530 | .00457433 |
| 7 | 4p | 6.063753 | .00922905 |
| ORB.ENERGY,a.u. | -13.760000 | ||
| NORM | 1.000000 | < R > | .432954 | < R2 > | .227064 | < 1/R > | 2.923454 | < 1/R**2 > | 11.589389 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 11.987549 | .37401968 |
| 2 | 2s | 5.401996 | -.79837722 |
| 3 | 3s | 7.301414 | -.28447172 |
| 4 | 4s | 26.507582 | .00173410 |
| 5 | 5s | 14.466325 | -.01322243 |
| 6 | 5s | 4.127364 | .00868837 |
| 7 | 3s | 46.187159 | .00003570 |
| ORB.ENERGY,a.u. | -14.065000 | ||
| NORM | 1.000000 | < R > | .491878 | < R2 > | .282687 | < 1/R > | 2.974496 | < 1/R**2 > | 35.772400 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 13.181507 | .94486319 |
| 2 | 1s | 21.813053 | .05669333 |
| 3 | 2s | 13.129075 | .02201403 |
| 4 | 3s | 16.173075 | -.02216943 |
| 5 | 4s | 70.518257 | -.00007405 |
| 6 | 5s | 30.606604 | .00117867 |
| 7 | 5s | 5.332577 | -.00136605 |
| 8 | 3s | 3.887937 | .00149080 |
| 9 | 4s | 3.359876 | -.00070452 |
| ORB.ENERGY,a.u. | -79.321000 |
| NORM | 1.000000 | < R > | .110587 | < R2 > | .016391 | < 1/R > | 13.646103 | < 1/R**2 > | 375.129463 |
Total Energy= -244.01209303 a.u.
Kinetic Energy= 243.97033991 a.u.
Potential Energy= -487.98243295 a.u.
Virial Ratio = -2.00017114