(1s 2 2s 2 2p 1 5s 1 ) 3 P Al 7+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3150.
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 | 10.476300 | .07999357 |
| 2 | 2s | 2.702333 | -.99483164 |
| 3 | 3s | 2.418886 | 2.87561970 |
| 4 | 4s | 1.746579 | -6.29587523 |
| 5 | 5s | 1.697678 | 5.15687909 |
| 6 | 5s | 15.395566 | -.00584648 |
| 7 | 4s | 8.251651 | -.03122040 |
| 8 | 5s | 1.418312 | -.06569984 |
| 9 | 4s | 22.699089 | -.00080200 |
| 10 | 5s | 70.567129 | -.00002076 |
| ORB.ENERGY,a.u. | -1.446000 | ||
| NORM | 1.000004 | < R > | 4.162644 | < R2 > | 19.388723 | < 1/R > | .348548 | < 1/R**2 > | 1.209547 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.174654 | 1.08782512 |
| 2 | 3p | 6.511895 | -.10829383 |
| 3 | 2p | 11.923038 | .01978172 |
| 4 | 5p | 13.264662 | .00434479 |
| 5 | 4p | 25.843287 | -.00085829 |
| 6 | 5p | 4.847855 | .00478188 |
| 7 | 5p | 79.666202 | -.00001900 |
| 8 | 4p | 3.673774 | -.00153718 |
| ORB.ENERGY,a.u. | -11.810000 | ||
| NORM | 1.000000 | < R > | .472397 | < R2 > | .270560 | < 1/R > | 2.681507 | < 1/R**2 > | 9.758807 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 11.206093 | .36319881 |
| 2 | 2s | 4.917715 | -.78899808 |
| 3 | 3s | 6.707854 | -.28247575 |
| 4 | 4s | 25.130716 | .00136845 |
| 5 | 5s | 13.578733 | -.01557607 |
| 6 | 5s | 2.590787 | .00268651 |
| 7 | 3s | 1.083330 | -.00220620 |
| 8 | 5s | 92.016915 | .00000430 |
| ORB.ENERGY,a.u. | -11.507000 | ||
| NORM | 1.000000 | < R > | .538653 | < R2 > | .339789 | < 1/R > | 2.712568 | < 1/R**2 > | 29.787813 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 12.175879 | .92424254 |
| 2 | 1s | 18.859527 | .07668730 |
| 3 | 2s | 11.205638 | .01778703 |
| 4 | 3s | 13.921223 | -.01627504 |
| 5 | 4s | 69.845876 | -.00005120 |
| 6 | 5s | 30.281073 | .00107791 |
| 7 | 5s | 6.953104 | .00014981 |
| 8 | 4s | 2.762708 | -.00004393 |
| ORB.ENERGY,a.u. | -67.248000 |
| NORM | 1.000000 | < R > | .119329 | < R2 > | .019088 | < 1/R > | 12.650345 | < 1/R**2 > | 322.522247 |
Total Energy= -205.21227160 a.u.
Kinetic Energy= 205.21434381 a.u.
Potential Energy= -410.42661541 a.u.
Virial Ratio = -1.99998990