(1s 2 2s 2 2p 1 4p 1 ) 1 P Al 7+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1141.
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 | 4p- electron | |
| 1 | 2p | 5.892271 | .27650453 |
| 2 | 3p | 2.103439 | -.58928899 |
| 3 | 5p | 2.364572 | 1.18334639 |
| 4 | 4p | 3.425296 | -.58740644 |
| 5 | 5p | 7.601694 | .02690906 |
| 6 | 4p | 18.043740 | -.00287879 |
| 7 | 5p | 2.110027 | .41091375 |
| 8 | 5p | 40.453055 | -.00029039 |
| 9 | 4p | 62.666497 | -.00005737 |
| ORB.ENERGY,a.u. | -2.220400 | ||
| NORM | 1.000000 | < R > | 2.595478 | < R2 > | 7.618857 | < 1/R > | .545318 | < 1/R**2 > | .830976 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.178636 | 1.08265804 |
| 2 | 3p | 6.432123 | -.10263546 |
| 3 | 2p | 12.384509 | .01863470 |
| 4 | 5p | 14.850140 | .00383418 |
| 5 | 4p | 27.816994 | -.00034222 |
| 6 | 5p | 5.056200 | .00488762 |
| 7 | 5p | 89.368021 | -.00000496 |
| ORB.ENERGY,a.u. | -11.658000 | ||
| NORM | 1.000000 | < R > | .472101 | < R2 > | .270278 | < 1/R > | 2.683513 | < 1/R**2 > | 9.773816 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 11.328098 | .35682095 |
| 2 | 2s | 4.748514 | -.80050980 |
| 3 | 3s | 7.000376 | -.27937194 |
| 4 | 4s | 24.259627 | .00162798 |
| 5 | 5s | 13.621720 | -.01220415 |
| 6 | 5s | 5.239450 | .01596611 |
| 7 | 4s | 2.235531 | .00030210 |
| ORB.ENERGY,a.u. | -11.507000 | ||
| NORM | 1.000000 | < R > | .539369 | < R2 > | .340730 | < 1/R > | 2.708700 | < 1/R**2 > | 29.707983 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 12.171427 | .92320691 |
| 2 | 1s | 18.775527 | .07795593 |
| 3 | 2s | 10.767768 | .01822058 |
| 4 | 3s | 13.560681 | -.01676612 |
| 5 | 4s | 65.573682 | -.00006674 |
| 6 | 5s | 30.016246 | .00091430 |
| ORB.ENERGY,a.u. | -67.248000 |
| NORM | 1.000000 | < R > | .119347 | < R2 > | .019095 | < 1/R > | 12.649004 | < 1/R**2 > | 322.468923 |
Total Energy= -205.96070186 a.u.
Kinetic Energy= 205.98915248 a.u.
Potential Energy= -411.94985433 a.u.
Virial Ratio = -1.99986188