(1s 2 2s 2 2p 2 5d 1 ) 2 F Ar 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2352.
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 | 3.006676 | 1.71722148 |
| 2 | 4d | 2.579858 | -4.58873708 |
| 3 | 5d | 2.384969 | 3.60301456 |
| 4 | 3d | 9.680934 | .01323546 |
| 5 | 5d | 5.364226 | -.03058826 |
| 6 | 4d | 23.326430 | -.00015841 |
| 7 | 5d | 1.867688 | -.01431656 |
| ORB.ENERGY,a.u. | -2.923900 | ||
| NORM | 1.000000 | < R > | 2.825971 | < R2 > | 9.069986 | < 1/R > | .493239 | < 1/R**2 > | .502498 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.205645 | 1.14966058 |
| 2 | 3p | 8.315666 | -.17248458 |
| 3 | 2p | 16.817592 | .02099979 |
| 4 | 4p | 18.415654 | .00461628 |
| 5 | 5p | 40.614850 | -.00021801 |
| 6 | 5p | 7.528499 | -.00836033 |
| 7 | 4p | 6.053561 | .00349539 |
| ORB.ENERGY,a.u. | -24.685000 | ||
| NORM | 1.000000 | < R > | .328264 | < R2 > | .130579 | < 1/R > | 3.855086 | < 1/R**2 > | 20.132402 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.061977 | .43766755 |
| 2 | 2s | 7.991956 | -.87192537 |
| 3 | 3s | 8.193855 | -.28700670 |
| 4 | 4s | 30.488868 | .00189852 |
| 5 | 3s | 16.578624 | .01626809 |
| 6 | 5s | 8.296987 | -.01965805 |
| 7 | 4s | 5.441757 | -.00045334 |
| ORB.ENERGY,a.u. | -23.662000 | ||
| NORM | 1.000000 | < R > | .378497 | < R2 > | .167759 | < 1/R > | 3.884303 | < 1/R**2 > | 61.154272 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.068188 | .92683644 |
| 2 | 1s | 25.714413 | .07171088 |
| 3 | 2s | 15.773362 | .01936689 |
| 4 | 3s | 19.684635 | -.01555041 |
| 5 | 5s | 42.444471 | .00077869 |
| 6 | 4s | 99.610209 | -.00003420 |
| 7 | 5s | 12.685869 | .00022929 |
| ORB.ENERGY,a.u. | -133.590000 |
| NORM | 1.000000 | < R > | .085562 | < R2 > | .009807 | < 1/R > | 17.624163 | < 1/R**2 > | 625.030178 |
Total Energy= -433.34501080 a.u.
Kinetic Energy= 433.32076623 a.u.
Potential Energy= -866.66577703 a.u.
Virial Ratio = -2.00005595