(1s 2 2s 2 2p 4 3p 1 ) 2 P Cl 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2131.
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 | 3p- electron | |
| 1 | 2p | 5.010045 | .45260384 |
| 2 | 3p | 3.229506 | -1.00177978 |
| 3 | 4p | 3.800276 | -.20213431 |
| 4 | 2p | 10.784321 | .06919475 |
| 5 | 5p | 17.681417 | .00147533 |
| 6 | 5p | 41.485708 | -.00020111 |
| 7 | 4p | 61.774555 | -.00003742 |
| ORB.ENERGY,a.u. | -5.290500 | ||
| NORM | 1.000000 | < R > | 1.201943 | < R2 > | 1.629813 | < 1/R > | 1.069816 | < 1/R**2 > | 2.260463 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.464853 | 1.37545246 |
| 2 | 3p | 8.190937 | -.49205260 |
| 3 | 4p | 9.757456 | .11266883 |
| 4 | 5p | 4.188895 | -.01750254 |
| 5 | 5p | 17.910810 | .00543116 |
| 6 | 4p | 34.903291 | -.00057372 |
| 7 | 4p | 2.706139 | -.00128735 |
| 8 | 3p | 50.812454 | -.00005004 |
| ORB.ENERGY,a.u. | -15.399000 | ||
| NORM | 1.000000 | < R > | .370640 | < R2 > | .166890 | < 1/R > | 3.434426 | < 1/R**2 > | 16.124876 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.525139 | .40288119 |
| 2 | 2s | 7.271538 | -.85328806 |
| 3 | 3s | 6.776059 | -.29911429 |
| 4 | 4s | 17.553368 | .00831026 |
| 5 | 3s | 21.090909 | .00797106 |
| 6 | 5s | 33.914704 | .00058502 |
| 7 | 5s | 6.232979 | -.00690214 |
| 8 | 2s | 63.935461 | .00003286 |
| ORB.ENERGY,a.u. | -16.930000 | ||
| NORM | 1.000000 | < R > | .421857 | < R2 > | .209425 | < 1/R > | 3.472873 | < 1/R**2 > | 49.267192 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.156683 | .92125972 |
| 2 | 1s | 23.435862 | .07507284 |
| 3 | 2s | 10.511439 | .02018790 |
| 4 | 3s | 12.683527 | -.02021630 |
| 5 | 4s | 15.262077 | .00919791 |
| 6 | 5s | 41.781681 | .00065599 |
| 7 | 4s | 89.007798 | -.00003496 |
| ORB.ENERGY,a.u. | -112.130000 |
| NORM | 1.000000 | < R > | .091051 | < R2 > | .011126 | < 1/R > | 16.587638 | < 1/R**2 > | 554.424860 |
Total Energy= -422.76727644 a.u.
Kinetic Energy= 422.62377056 a.u.
Potential Energy= -845.39104700 a.u.
Virial Ratio = -2.00033956