(1s 2 2s 2 2p 4 4d 1 ) 4 P Ar 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4142.
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 | 4d- electron | |
| 1 | 3d | 2.870155 | 1.29187596 |
| 2 | 4d | 2.536365 | -1.85227666 |
| 3 | 3d | 8.065216 | .04241929 |
| 4 | 4d | 5.789583 | .04564512 |
| 5 | 5d | 29.182890 | -.00009458 |
| ORB.ENERGY,a.u. | -3.239200 | ||
| NORM | 1.000001 | < R > | 2.007387 | < R2 > | 4.624833 | < 1/R > | .667018 | < 1/R**2 > | .747891 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.506197 | 1.12547957 |
| 2 | 3p | 7.273178 | -.20311124 |
| 3 | 2p | 13.724756 | .07218428 |
| 4 | 4p | 16.428983 | .01321334 |
| 5 | 5p | 20.038330 | -.00060220 |
| 6 | 5p | 4.896211 | -.00085742 |
| 7 | 4p | 71.035877 | .00002363 |
| ORB.ENERGY,a.u. | -19.052000 | ||
| NORM | 1.000000 | < R > | .348165 | < R2 > | .148025 | < 1/R > | 3.667771 | < 1/R**2 > | 18.411598 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.159310 | .41594619 |
| 2 | 2s | 7.817572 | -.86240508 |
| 3 | 3s | 7.318679 | -.30212886 |
| 4 | 4s | 13.704613 | .00393466 |
| 5 | 3s | 17.622841 | .01396913 |
| 6 | 5s | 38.381336 | .00067080 |
| 7 | 5s | 7.170518 | -.00598433 |
| 8 | 4s | 3.653505 | .00015674 |
| 9 | 3s | 67.776328 | -.00003243 |
| ORB.ENERGY,a.u. | -20.023000 | ||
| NORM | 1.000000 | < R > | .393324 | < R2 > | .181841 | < 1/R > | 3.729402 | < 1/R**2 > | 56.746241 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.132698 | .91984876 |
| 2 | 1s | 24.598884 | .07653883 |
| 3 | 2s | 11.204076 | .02021490 |
| 4 | 3s | 13.629519 | -.02041831 |
| 5 | 4s | 16.404496 | .00883624 |
| 6 | 5s | 44.031019 | .00073000 |
| 7 | 4s | 106.290003 | -.00002476 |
| ORB.ENERGY,a.u. | -127.520000 |
| NORM | 1.000000 | < R > | .085839 | < R2 > | .009885 | < 1/R > | 17.587667 | < 1/R**2 > | 623.019840 |
Total Energy= -476.16249140 a.u.
Kinetic Energy= 476.15427211 a.u.
Potential Energy= -952.31676351 a.u.
Virial Ratio = -2.00001726