(1s 2 2s 2 2p 1 5d 1 ) 1 P Cl 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1152.
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 | 2.379084 | 3.60300391 |
| 2 | 4d | 2.402571 | -9.05759630 |
| 3 | 5d | 2.417320 | 6.12022877 |
| 4 | 3d | 7.107689 | .02816050 |
| 5 | 5d | 1.752566 | .02262026 |
| 6 | 5d | 10.548930 | -.00829076 |
| 7 | 4d | 31.129259 | .00004035 |
| 8 | 4d | 1.323906 | -.00799783 |
| 9 | 3d | 33.123301 | .00002351 |
| ORB.ENERGY,a.u. | -2.901300 | ||
| NORM | 1.000003 | < R > | 2.848908 | < R2 > | 9.216976 | < 1/R > | .488521 | < 1/R**2 > | .489554 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.145494 | 1.08212660 |
| 2 | 3p | 8.624967 | -.09473393 |
| 3 | 2p | 17.635650 | .01170233 |
| 4 | 5p | 21.762512 | .00237994 |
| 5 | 5p | 6.816503 | .00145219 |
| ORB.ENERGY,a.u. | -23.571000 | ||
| NORM | 1.000000 | < R > | .342044 | < R2 > | .141464 | < 1/R > | 3.690250 | < 1/R**2 > | 18.393020 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.567722 | .38519047 |
| 2 | 2s | 6.569840 | -.81557550 |
| 3 | 3s | 9.410581 | -.28507942 |
| 4 | 4s | 32.017252 | .00106950 |
| 5 | 5s | 18.396120 | -.00963441 |
| 6 | 5s | 7.343841 | .01868529 |
| ORB.ENERGY,a.u. | -23.265000 | ||
| NORM | 1.000000 | < R > | .396102 | < R2 > | .183484 | < 1/R > | 3.712327 | < 1/R**2 > | 55.692955 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.196294 | .93697076 |
| 2 | 1s | 24.922270 | .06019623 |
| 3 | 2s | 14.924893 | .02011968 |
| 4 | 3s | 18.265984 | -.01485608 |
| 5 | 4s | 82.080923 | -.00006404 |
| 6 | 5s | 39.008417 | .00065626 |
| 7 | 4s | 8.040693 | .00004648 |
| ORB.ENERGY,a.u. | -121.620000 |
| NORM | 1.000000 | < R > | .090550 | < R2 > | .010978 | < 1/R > | 16.646684 | < 1/R**2 > | 557.497601 |
Total Energy= -362.35957392 a.u.
Kinetic Energy= 362.32337708 a.u.
Potential Energy= -724.68295100 a.u.
Virial Ratio = -2.00009990