(1s 2 2s 2 2p 1 4d 1 ) 1 F Cl 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1342.
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 | 4d- electron | |
| 1 | 3d | 3.336260 | 1.48782078 |
| 2 | 4d | 2.978742 | -1.98068011 |
| 3 | 3d | 9.500674 | .01300464 |
| 4 | 5d | 28.432290 | -.00014098 |
| 5 | 4d | 17.776558 | .00012679 |
| 6 | 5d | 2.048226 | .00367638 |
| 7 | 3d | 1.293600 | -.00172431 |
| 8 | 5d | 8.534938 | .00176580 |
| ORB.ENERGY,a.u. | -4.532700 | ||
| NORM | 1.000000 | < R > | 1.731165 | < R2 > | 3.433067 | < 1/R > | .764586 | < 1/R**2 > | .951458 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.150938 | 1.08143215 |
| 2 | 3p | 8.607437 | -.09418593 |
| 3 | 2p | 17.698061 | .01155952 |
| 4 | 5p | 21.790404 | .00229886 |
| 5 | 5p | 6.799576 | .00137377 |
| 6 | 4p | 3.537003 | .00139889 |
| ORB.ENERGY,a.u. | -23.257000 | ||
| NORM | 1.000000 | < R > | .341935 | < R2 > | .141420 | < 1/R > | 3.691888 | < 1/R**2 > | 18.409359 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.561897 | .38512617 |
| 2 | 2s | 6.577506 | -.81421246 |
| 3 | 3s | 9.415103 | -.28527013 |
| 4 | 4s | 31.631733 | .00120132 |
| 5 | 5s | 18.363812 | -.00909575 |
| 6 | 5s | 7.229559 | .01613194 |
| ORB.ENERGY,a.u. | -23.265000 | ||
| NORM | 1.000000 | < R > | .396393 | < R2 > | .183775 | < 1/R > | 3.709502 | < 1/R**2 > | 55.614263 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.196981 | .93712113 |
| 2 | 1s | 24.926969 | .06006788 |
| 3 | 2s | 14.903367 | .02010197 |
| 4 | 3s | 18.255359 | -.01485647 |
| 5 | 4s | 81.940019 | -.00006460 |
| 6 | 5s | 38.984134 | .00065286 |
| 7 | 4s | 8.016724 | .00004719 |
| ORB.ENERGY,a.u. | -121.620000 |
| NORM | 1.000000 | < R > | .090550 | < R2 > | .010978 | < 1/R > | 16.646629 | < 1/R**2 > | 557.495010 |
Total Energy= -364.03110389 a.u.
Kinetic Energy= 363.95430353 a.u.
Potential Energy= -727.98540742 a.u.
Virial Ratio = -2.00021102