(1s 2 2s 2 2p 1 3s 1 ) 1 P Al 7+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1130.
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 | 3s- electron | |
| 1 | 1s | 10.261519 | .18017752 |
| 2 | 2s | 3.613971 | -1.10092499 |
| 3 | 3s | 3.011735 | 1.68287186 |
| 4 | 4s | 7.890814 | -.02983299 |
| 5 | 5s | 14.617721 | -.00626778 |
| 6 | 5s | 2.686407 | .01591619 |
| 7 | 4s | 2.281249 | -.01006207 |
| 8 | 4s | 51.061486 | -.00003497 |
| 9 | 2s | 21.086525 | -.00040134 |
| ORB.ENERGY,a.u. | -4.366000 | ||
| NORM | 1.000000 | < R > | 1.398406 | < R2 > | 2.201808 | < 1/R > | .996304 | < 1/R**2 > | 5.790166 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.155731 | 1.08525057 |
| 2 | 3p | 6.472011 | -.10212175 |
| 3 | 2p | 12.524618 | .01822975 |
| 4 | 5p | 17.770624 | .00314847 |
| 5 | 4p | 18.547333 | -.00086205 |
| 6 | 5p | 5.155613 | .00531757 |
| 7 | 5p | 60.564742 | -.00001423 |
| 8 | 4p | 4.093177 | -.00260325 |
| ORB.ENERGY,a.u. | -11.238000 | ||
| NORM | 1.000000 | < R > | .474313 | < R2 > | .272750 | < 1/R > | 2.671611 | < 1/R**2 > | 9.693791 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 11.202750 | .36481615 |
| 2 | 2s | 4.923904 | -.79245268 |
| 3 | 3s | 6.725603 | -.28366398 |
| 4 | 4s | 24.779057 | .00178515 |
| 5 | 5s | 13.403890 | -.01451583 |
| 6 | 5s | 3.739244 | .00941308 |
| 7 | 3s | 44.516772 | .00003817 |
| ORB.ENERGY,a.u. | -11.507000 | ||
| NORM | 1.000000 | < R > | .536017 | < R2 > | .335794 | < 1/R > | 2.723965 | < 1/R**2 > | 30.011640 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 12.190962 | .94108063 |
| 2 | 1s | 20.099878 | .06083165 |
| 3 | 2s | 12.021872 | .02197844 |
| 4 | 3s | 14.861768 | -.02238182 |
| 5 | 4s | 65.744610 | -.00007848 |
| 6 | 5s | 28.349269 | .00124851 |
| 7 | 5s | 3.948924 | -.00088789 |
| 8 | 3s | 6.595105 | .00051097 |
| ORB.ENERGY,a.u. | -67.248000 |
| NORM | 1.000000 | < R > | .119371 | < R2 > | .019106 | < 1/R > | 12.647502 | < 1/R**2 > | 322.407454 |
Total Energy= -208.16546423 a.u.
Kinetic Energy= 208.12850989 a.u.
Potential Energy= -416.29397412 a.u.
Virial Ratio = -2.00017756