(1s 2 2s 2 2p 4 4p 1 ) 2 P Cl 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2141.
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 | 4p- electron | |
| 1 | 2p | 8.399318 | .17179944 |
| 2 | 3p | 1.996096 | 2.42611352 |
| 3 | 4p | 3.465035 | -1.94278699 |
| 4 | 5p | 6.161946 | -.19099330 |
| 5 | 3p | 15.956794 | -.00228290 |
| 6 | 5p | 1.695928 | -.11323267 |
| 7 | 4p | 1.115287 | .05087952 |
| 8 | 4p | .829710 | -.02482881 |
| 9 | 3p | .603734 | .01032269 |
| 10 | 5p | 49.462711 | -.00002948 |
| ORB.ENERGY,a.u. | -2.842500 | ||
| NORM | 1.000000 | < R > | 2.278892 | < R2 > | 5.868435 | < 1/R > | .604424 | < 1/R**2 > | .975629 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.401747 | 1.22703341 |
| 2 | 3p | 7.990478 | -.24426630 |
| 3 | 2p | 18.790538 | .01214167 |
| 4 | 4p | 20.267822 | .00704069 |
| 5 | 5p | 2.611886 | .03227321 |
| 6 | 4p | 2.404863 | -.02296765 |
| 7 | 3p | 28.608415 | .00113159 |
| ORB.ENERGY,a.u. | -16.009000 | ||
| NORM | 1.000000 | < R > | .373581 | < R2 > | .171019 | < 1/R > | 3.422142 | < 1/R**2 > | 16.046658 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.504501 | .40458818 |
| 2 | 2s | 7.281147 | -.85538719 |
| 3 | 3s | 6.754609 | -.30060493 |
| 4 | 4s | 17.350936 | .00636044 |
| 5 | 3s | 19.837749 | .00919004 |
| 6 | 5s | 35.623130 | .00047551 |
| 7 | 5s | 5.660744 | -.00509138 |
| 8 | 4s | 4.201998 | .00236426 |
| 9 | 2s | 68.277505 | .00002132 |
| ORB.ENERGY,a.u. | -16.930000 | ||
| NORM | 1.000000 | < R > | .421001 | < R2 > | .208480 | < 1/R > | 3.479731 | < 1/R**2 > | 49.444113 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.158580 | .92083640 |
| 2 | 1s | 23.395316 | .07547164 |
| 3 | 2s | 10.462879 | .02020381 |
| 4 | 3s | 12.704920 | -.02019568 |
| 5 | 4s | 15.377033 | .00905157 |
| 6 | 5s | 41.566478 | .00074498 |
| 7 | 4s | 96.349999 | -.00002706 |
| ORB.ENERGY,a.u. | -112.130000 |
| NORM | 1.000000 | < R > | .091038 | < R2 > | .011122 | < 1/R > | 16.589298 | < 1/R**2 > | 554.511611 |
Total Energy= -420.23201358 a.u.
Kinetic Energy= 420.17826997 a.u.
Potential Energy= -840.41028355 a.u.
Virial Ratio = -2.00012791