(1s 2 2s 2 2p 2 5s 1 ) 4 P S 9+
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 | 12.196718 | .08938094 |
| 2 | 2s | 4.369670 | -.62633392 |
| 3 | 3s | 2.629894 | 3.35403592 |
| 4 | 4s | 2.329375 | -6.36209620 |
| 5 | 5s | 2.120968 | 4.11739715 |
| 6 | 5s | 14.876309 | -.00440170 |
| 7 | 4s | 29.675920 | .00051336 |
| ORB.ENERGY,a.u. | -2.259600 | ||
| NORM | .999999 | < R > | 3.331732 | < R2 > | 12.421862 | < 1/R > | .436858 | < 1/R**2 > | 1.923530 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.304536 | 1.13833087 |
| 2 | 3p | 7.404926 | -.16072935 |
| 3 | 2p | 15.440963 | .01993590 |
| 4 | 4p | 17.576884 | .00587661 |
| 5 | 5p | 27.180191 | -.00067532 |
| 6 | 5p | 6.633332 | -.00127855 |
| 7 | 4p | 70.648622 | .00002340 |
| ORB.ENERGY,a.u. | -18.163000 | ||
| NORM | 1.000000 | < R > | .378267 | < R2 > | .173635 | < 1/R > | 3.351575 | < 1/R**2 > | 15.253027 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 12.339498 | .43669192 |
| 2 | 2s | 7.110680 | -.89002321 |
| 3 | 3s | 6.727426 | -.29815221 |
| 4 | 4s | 27.376957 | .00206885 |
| 5 | 3s | 14.079589 | .02566414 |
| 6 | 5s | 9.449006 | -.00132717 |
| 7 | 4s | 2.395171 | .02538534 |
| 8 | 3s | 1.852958 | -.02622696 |
| ORB.ENERGY,a.u. | -17.188000 | ||
| NORM | 1.000000 | < R > | .433271 | < R2 > | .220013 | < 1/R > | 3.384620 | < 1/R**2 > | 46.485607 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 15.112615 | .92668519 |
| 2 | 1s | 23.104195 | .07205592 |
| 3 | 2s | 14.076680 | .01951231 |
| 4 | 3s | 17.693404 | -.01561649 |
| 5 | 5s | 37.682648 | .00087602 |
| 6 | 4s | 87.850643 | -.00003854 |
| 7 | 5s | 12.241581 | .00030080 |
| 8 | 3s | 1.770177 | .00191872 |
| 9 | 4s | 2.353031 | -.00188728 |
| ORB.ENERGY,a.u. | -102.910000 |
| NORM | 1.000000 | < R > | .096558 | < R2 > | .012497 | < 1/R > | 15.626818 | < 1/R**2 > | 491.742373 |
Total Energy= -337.17938050 a.u.
Kinetic Energy= 337.18466744 a.u.
Potential Energy= -674.36404793 a.u.
Virial Ratio = -1.99998432