(1s 2 2s 2 2p 2 3s 1 ) 4 P Ar 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4130.
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 | 13.889124 | .21510433 |
| 2 | 2s | 5.400696 | -1.17063624 |
| 3 | 3s | 4.440385 | 1.69669108 |
| 4 | 4s | 11.738269 | -.03513172 |
| 5 | 5s | 20.836558 | -.00582743 |
| 6 | 5s | 3.673525 | .00420431 |
| 7 | 4s | 78.794364 | -.00001547 |
| 8 | 4s | 2.838701 | -.00182316 |
| ORB.ENERGY,a.u. | -9.653000 | ||
| NORM | 1.000000 | < R > | .942745 | < R2 > | 1.008762 | < 1/R > | 1.539882 | < 1/R**2 > | 14.427994 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.176090 | 1.17085166 |
| 2 | 3p | 8.092370 | -.18693057 |
| 3 | 2p | 18.120141 | .01594759 |
| 4 | 4p | 16.671622 | .00297917 |
| 5 | 5p | 15.234978 | -.00664927 |
| 6 | 5p | 6.136795 | .00089848 |
| 7 | 4p | 75.251627 | .00002066 |
| ORB.ENERGY,a.u. | -24.007000 | ||
| NORM | 1.000000 | < R > | .329262 | < R2 > | .131470 | < 1/R > | 3.845428 | < 1/R**2 > | 20.039471 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.789159 | .44885874 |
| 2 | 2s | 8.155669 | -.88308077 |
| 3 | 3s | 8.275486 | -.28796732 |
| 4 | 4s | 31.256855 | .00185686 |
| 5 | 3s | 15.424798 | .02676103 |
| 6 | 3s | 11.276735 | .00565904 |
| 7 | 5s | 8.844655 | -.03160099 |
| 8 | 4s | 5.454461 | -.01573169 |
| 9 | 2s | 5.686444 | .00197665 |
| 10 | 5s | 3.489846 | -.00028528 |
| ORB.ENERGY,a.u. | -23.662000 | ||
| NORM | 1.000000 | < R > | .380587 | < R2 > | .170012 | < 1/R > | 3.866782 | < 1/R**2 > | 60.682244 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.066727 | .92629559 |
| 2 | 1s | 25.618687 | .07245615 |
| 3 | 2s | 15.357809 | .01948094 |
| 4 | 3s | 19.303659 | -.01575113 |
| 5 | 5s | 42.828080 | .00067194 |
| 6 | 4s | 93.108352 | -.00004097 |
| 7 | 5s | 6.138391 | .00046486 |
| ORB.ENERGY,a.u. | -133.590000 |
| NORM | 1.000000 | < R > | .085562 | < R2 > | .009807 | < 1/R > | 17.623909 | < 1/R**2 > | 625.006327 |
Total Energy= -439.97376333 a.u.
Kinetic Energy= 440.01682893 a.u.
Potential Energy= -879.99059226 a.u.
Virial Ratio = -1.99990213