(1s 2 2s 2 2p 1 4s 1 ) 1 P Si 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1140.
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 | 4s- electron | |
| 1 | 1s | 11.109440 | .11779301 |
| 2 | 2s | 2.848692 | -1.60355256 |
| 3 | 3s | 2.847449 | 3.44434168 |
| 4 | 4s | 2.391205 | -2.44739097 |
| 5 | 5s | 9.235499 | -.02847768 |
| 6 | 4s | 12.268634 | -.01867363 |
| 7 | 5s | 25.775238 | .00046326 |
| 8 | 5s | 1.263596 | .00039029 |
| ORB.ENERGY,a.u. | -2.896200 | ||
| NORM | 1.000000 | < R > | 2.343416 | < R2 > | 6.165063 | < 1/R > | .610248 | < 1/R**2 > | 2.900264 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.646115 | 1.10537931 |
| 2 | 3p | 7.085201 | -.13340798 |
| 3 | 2p | 13.706057 | .01479022 |
| 4 | 5p | 10.980068 | .01149576 |
| 5 | 4p | 19.137117 | .00061464 |
| 6 | 5p | 17.556283 | .00522455 |
| 7 | 5p | 3.816911 | .00088063 |
| ORB.ENERGY,a.u. | -14.179000 | ||
| NORM | 1.000000 | < R > | .431762 | < R2 > | .225830 | < 1/R > | 2.930854 | < 1/R**2 > | 11.642645 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 12.087909 | .36844279 |
| 2 | 2s | 5.185556 | -.83218150 |
| 3 | 3s | 7.814368 | -.27456300 |
| 4 | 4s | 22.507653 | .00517490 |
| 5 | 5s | 3.990219 | -.01149994 |
| 6 | 4s | 4.265825 | .03587993 |
| 7 | 2s | 20.171200 | -.00012098 |
| 8 | 3s | 1.094321 | -.01055881 |
| 9 | 5s | 52.336189 | .00020476 |
| 10 | 5s | 1.401378 | .00696832 |
| 11 | 4s | 79.109890 | .00003742 |
| ORB.ENERGY,a.u. | -14.065000 | ||
| NORM | 1.000000 | < R > | .493641 | < R2 > | .285334 | < 1/R > | 2.966344 | < 1/R**2 > | 35.603355 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 13.160228 | .92485411 |
| 2 | 1s | 20.163023 | .07563195 |
| 3 | 2s | 11.505695 | .01912043 |
| 4 | 3s | 14.485941 | -.01713987 |
| 5 | 4s | 70.369363 | -.00006288 |
| 6 | 5s | 32.500385 | .00083480 |
| 7 | 5s | 2.317810 | .00162287 |
| 8 | 3s | 1.624652 | -.00129544 |
| ORB.ENERGY,a.u. | -79.321000 |
| NORM | 1.000000 | < R > | .110561 | < R2 > | .016382 | < 1/R > | 13.648162 | < 1/R**2 > | 375.219522 |
Total Energy= -241.46362485 a.u.
Kinetic Energy= 241.44929316 a.u.
Potential Energy= -482.91291802 a.u.
Virial Ratio = -2.00005936