(1s 2 2s 2 2p 4 5s 1 ) 4 P Cl 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4150.
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 | 5s- electron | |
| 1 | 1s | 13.558805 | .07320004 |
| 2 | 2s | 4.853920 | -.42153514 |
| 3 | 3s | 2.487307 | 2.73060571 |
| 4 | 4s | 2.246408 | -5.08511550 |
| 5 | 5s | 1.954665 | 3.25540945 |
| 6 | 5s | 15.501367 | -.00497975 |
| 7 | 4s | 17.039629 | -.00380251 |
| 8 | 5s | 77.937595 | -.00001559 |
| ORB.ENERGY,a.u. | -1.919100 | ||
| NORM | 1.000000 | < R > | 3.532636 | < R2 > | 13.964934 | < 1/R > | .408592 | < 1/R**2 > | 1.690704 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.026398 | 1.13606678 |
| 2 | 3p | 6.794883 | -.21463206 |
| 3 | 2p | 12.923210 | .07400594 |
| 4 | 4p | 15.117904 | .01580058 |
| 5 | 5p | 17.540543 | -.00153827 |
| 6 | 4p | 5.427670 | -.00292758 |
| 7 | 4p | 67.185448 | .00002484 |
| ORB.ENERGY,a.u. | -16.300000 | ||
| NORM | 1.000000 | < R > | .374153 | < R2 > | .171149 | < 1/R > | 3.417929 | < 1/R**2 > | 16.017094 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.712856 | .35603640 |
| 2 | 2s | 6.213493 | -.82444955 |
| 3 | 3s | 9.542391 | -.21362234 |
| 4 | 4s | 8.043395 | -.04145020 |
| 5 | 5s | 19.817395 | -.00829571 |
| 6 | 5s | 1.547475 | -.03466803 |
| 7 | 4s | 1.253756 | .05179835 |
| 8 | 3s | 62.570284 | -.00009549 |
| 9 | 4s | 106.810619 | .00002072 |
| 10 | 3s | .858814 | -.02068786 |
| 11 | 5s | .875275 | .00299201 |
| ORB.ENERGY,a.u. | -16.930000 | ||
| NORM | 1.000000 | < R > | .420719 | < R2 > | .208204 | < 1/R > | 3.482203 | < 1/R**2 > | 49.509664 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.160056 | .92057446 |
| 2 | 1s | 23.292136 | .07608239 |
| 3 | 2s | 9.749295 | .02110244 |
| 4 | 3s | 11.933537 | -.02182038 |
| 5 | 4s | 14.824264 | .00934110 |
| 6 | 5s | 41.122524 | .00071595 |
| 7 | 3s | 64.767667 | -.00006920 |
| 8 | 5s | 1.235911 | .00132650 |
| 9 | 4s | 1.006882 | -.00121648 |
| ORB.ENERGY,a.u. | -112.130000 |
| NORM | 1.000000 | < R > | .091029 | < R2 > | .011120 | < 1/R > | 16.590336 | < 1/R**2 > | 554.564993 |
Total Energy= -419.24866900 a.u.
Kinetic Energy= 419.25341287 a.u.
Potential Energy= -838.50208186 a.u.
Virial Ratio = -1.99998868