(1s 2 2s 2 2p 5 5d 1 ) 1 P Ar 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1152.
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 | 5d- electron | |
| 1 | 3d | 2.242936 | 1.67334896 |
| 2 | 4d | 1.851344 | -5.38788792 |
| 3 | 5d | 1.795613 | 4.48201345 |
| 4 | 3d | 6.213889 | .02570961 |
| 5 | 5d | 9.148628 | -.00908388 |
| 6 | 4d | 17.874792 | .00061361 |
| 7 | 5d | 1.537850 | -.03449065 |
| 8 | 3d | 24.050240 | .00013495 |
| ORB.ENERGY,a.u. | -1.636400 | ||
| NORM | .999999 | < R > | 3.785264 | < R2 > | 16.282676 | < 1/R > | .369253 | < 1/R**2 > | .283039 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.390749 | 1.16588248 |
| 2 | 3p | 7.522444 | -.22945160 |
| 3 | 2p | 13.871724 | .06368542 |
| 4 | 4p | 16.948134 | .00844192 |
| 5 | 5p | 41.479318 | -.00014253 |
| 6 | 5p | 4.384934 | .00055870 |
| ORB.ENERGY,a.u. | -17.135000 | ||
| NORM | 1.000000 | < R > | .358791 | < R2 > | .157886 | < 1/R > | 3.577078 | < 1/R**2 > | 17.610271 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.335193 | .40042157 |
| 2 | 2s | 7.682671 | -.84673864 |
| 3 | 3s | 7.014516 | -.30616009 |
| 4 | 4s | 18.899784 | .00508617 |
| 5 | 3s | 21.418132 | .00687150 |
| 6 | 5s | 37.832793 | .00056911 |
| 7 | 5s | 6.084107 | -.00321813 |
| 8 | 4s | 4.277758 | .00133542 |
| 9 | 3s | 3.094941 | -.00042173 |
| 10 | 2s | 92.473436 | .00000779 |
| ORB.ENERGY,a.u. | -18.309000 | ||
| NORM | 1.000000 | < R > | .400725 | < R2 > | .189130 | < 1/R > | 3.657206 | < 1/R**2 > | 54.737036 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.190693 | .93053245 |
| 2 | 1s | 25.175868 | .06482425 |
| 3 | 2s | 10.853908 | .02185805 |
| 4 | 3s | 13.390862 | -.02197136 |
| 5 | 4s | 16.616656 | .01065890 |
| 6 | 5s | 42.911785 | .00068663 |
| 7 | 4s | 99.166374 | -.00003225 |
| ORB.ENERGY,a.u. | -124.690000 |
| NORM | 1.000000 | < R > | .085956 | < R2 > | .009918 | < 1/R > | 17.572569 | < 1/R**2 > | 622.192280 |
Total Energy= -492.15348790 a.u.
Kinetic Energy= 492.11567046 a.u.
Potential Energy= -984.26915836 a.u.
Virial Ratio = -2.00007685