(1s 2 2s 2 2p 1 5d 1 ) 1 F Al 7+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1352.
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 | 5d- electron | |
| 1 | 3d | 1.588665 | 3.61537591 |
| 2 | 4d | 1.602752 | -9.05679682 |
| 3 | 5d | 1.611784 | 6.10398958 |
| 4 | 3d | 5.130383 | .02488135 |
| 5 | 5d | 1.190452 | .03244990 |
| 6 | 5d | 7.536677 | -.00800269 |
| 7 | 4d | 18.322199 | .00007637 |
| 8 | 4d | .895970 | -.01093717 |
| 9 | 3d | 20.877943 | .00005561 |
| ORB.ENERGY,a.u. | -1.288300 | ||
| NORM | .999996 | < R > | 4.274732 | < R2 > | 20.760732 | < 1/R > | .326229 | < 1/R**2 > | .219077 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.178342 | 1.08600579 |
| 2 | 3p | 6.504433 | -.10594018 |
| 3 | 2p | 12.132410 | .01922472 |
| 4 | 5p | 13.991410 | .00447201 |
| 5 | 4p | 27.272908 | -.00053519 |
| 6 | 5p | 4.371308 | .00350022 |
| 7 | 5p | 87.157206 | -.00000949 |
| 8 | 4p | 1.003307 | -.00020354 |
| ORB.ENERGY,a.u. | -11.773000 | ||
| NORM | 1.000000 | < R > | .471988 | < R2 > | .270151 | < 1/R > | 2.684008 | < 1/R**2 > | 9.776611 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 11.333988 | .35695582 |
| 2 | 2s | 4.742911 | -.80176361 |
| 3 | 3s | 6.993708 | -.27864196 |
| 4 | 4s | 24.836259 | .00133669 |
| 5 | 5s | 13.709377 | -.01356333 |
| 6 | 5s | 5.295431 | .01895135 |
| ORB.ENERGY,a.u. | -11.507000 | ||
| NORM | 1.000000 | < R > | .538780 | < R2 > | .339948 | < 1/R > | 2.711801 | < 1/R**2 > | 29.770590 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 12.172811 | .92274512 |
| 2 | 1s | 18.729446 | .07846395 |
| 3 | 2s | 10.627079 | .01824810 |
| 4 | 3s | 13.399531 | -.01685872 |
| 5 | 4s | 65.149409 | -.00007003 |
| 6 | 5s | 30.045092 | .00087814 |
| 7 | 4s | 3.674182 | .00002220 |
| ORB.ENERGY,a.u. | -67.248000 |
| NORM | 1.000000 | < R > | .119327 | < R2 > | .019088 | < 1/R > | 12.650497 | < 1/R**2 > | 322.529412 |
Total Energy= -205.08169520 a.u.
Kinetic Energy= 205.05811675 a.u.
Potential Energy= -410.13981195 a.u.
Virial Ratio = -2.00011498