(1s 2 2s 2 2p 1 5p 1 ) 3 P Al 7+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3151.
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 | 5p- electron | |
| 1 | 2p | 3.413071 | .32989217 |
| 2 | 3p | 1.948445 | -3.16821969 |
| 3 | 4p | 1.663704 | 8.44170804 |
| 4 | 5p | 1.672858 | -6.52026577 |
| 5 | 2p | 8.125724 | .02248990 |
| 6 | 5p | 2.436372 | .20853278 |
| 7 | 5p | 24.972608 | -.00047431 |
| 8 | 4p | 36.821760 | -.00010892 |
| ORB.ENERGY,a.u. | -1.380300 | ||
| NORM | 1.000000 | < R > | 4.225248 | < R2 > | 20.081812 | < 1/R > | .321240 | < 1/R**2 > | .263259 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.096919 | .94578407 |
| 2 | 3p | 1.351449 | -.40292406 |
| 3 | 2p | 10.139466 | .06583935 |
| 4 | 5p | 3.387285 | .03968169 |
| 5 | 4p | 11.162310 | .02023506 |
| 6 | 5p | 2.186077 | .36457229 |
| 7 | 3p | 16.989499 | .00016537 |
| 8 | 3p | .639740 | .00082593 |
| 9 | 4p | 24.472562 | -.00042544 |
| ORB.ENERGY,a.u. | -11.811000 | ||
| NORM | 1.000000 | < R > | .480108 | < R2 > | .337193 | < 1/R > | 2.703344 | < 1/R**2 > | 9.918384 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 11.335351 | .35684843 |
| 2 | 2s | 4.738559 | -.80251447 |
| 3 | 3s | 7.007194 | -.27863992 |
| 4 | 4s | 24.576823 | .00146121 |
| 5 | 5s | 13.659847 | -.01297634 |
| 6 | 5s | 5.283755 | .01934065 |
| ORB.ENERGY,a.u. | -11.507000 | ||
| NORM | 1.000000 | < R > | .538830 | < R2 > | .340003 | < 1/R > | 2.711487 | < 1/R**2 > | 29.764509 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 12.174375 | .92352102 |
| 2 | 1s | 18.811903 | .07742282 |
| 3 | 2s | 11.005889 | .01806651 |
| 4 | 3s | 13.752228 | -.01648086 |
| 5 | 4s | 67.872073 | -.00005752 |
| 6 | 5s | 30.147420 | .00101002 |
| 7 | 5s | 7.587980 | .00006545 |
| ORB.ENERGY,a.u. | -67.248000 |
| NORM | 1.000000 | < R > | .119337 | < R2 > | .019091 | < 1/R > | 12.649784 | < 1/R**2 > | 322.500428 |
Total Energy= -205.14894816 a.u.
Kinetic Energy= 205.14957118 a.u.
Potential Energy= -410.29851934 a.u.
Virial Ratio = -1.99999696