(1s 2 2s 2 2p 4 4d 1 ) 2 D Ar 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2242.
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 | 2.782910 | 1.47673628 |
| 2 | 4d | 2.510773 | -1.99246352 |
| 3 | 3d | 9.123478 | .01855528 |
| 4 | 4d | 6.132845 | .02157074 |
| 5 | 5d | 28.888227 | -.00006684 |
| ORB.ENERGY,a.u. | -3.182500 | ||
| NORM | 1.000000 | < R > | 2.050664 | < R2 > | 4.822491 | < 1/R > | .648815 | < 1/R**2 > | .694433 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.508182 | 1.13282691 |
| 2 | 3p | 7.281390 | -.20825295 |
| 3 | 2p | 13.777960 | .07043139 |
| 4 | 4p | 16.476931 | .01250455 |
| 5 | 5p | 3.805053 | .00059588 |
| 6 | 5p | 19.759004 | -.00042578 |
| 7 | 4p | 72.743534 | .00002133 |
| 8 | 4p | 5.056332 | -.00169759 |
| ORB.ENERGY,a.u. | -18.996000 | ||
| NORM | 1.000000 | < R > | .347886 | < R2 > | .147781 | < 1/R > | 3.670222 | < 1/R**2 > | 18.432973 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.158415 | .41601005 |
| 2 | 2s | 7.818369 | -.86242155 |
| 3 | 3s | 7.321154 | -.30211234 |
| 4 | 4s | 13.758853 | .00393691 |
| 5 | 3s | 17.604373 | .01401827 |
| 6 | 5s | 38.426494 | .00067540 |
| 7 | 5s | 7.166056 | -.00610447 |
| 8 | 4s | 3.626927 | .00015694 |
| 9 | 3s | 68.344907 | -.00003162 |
| ORB.ENERGY,a.u. | -20.023000 | ||
| NORM | 1.000000 | < R > | .393306 | < R2 > | .181824 | < 1/R > | 3.729603 | < 1/R**2 > | 56.752438 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.132489 | .91985350 |
| 2 | 1s | 24.600269 | .07653586 |
| 3 | 2s | 11.202527 | .02021776 |
| 4 | 3s | 13.629160 | -.02041882 |
| 5 | 4s | 16.406114 | .00883514 |
| 6 | 5s | 44.041430 | .00072840 |
| 7 | 4s | 106.238675 | -.00002449 |
| ORB.ENERGY,a.u. | -127.520000 |
| NORM | 1.000000 | < R > | .085840 | < R2 > | .009885 | < 1/R > | 17.587553 | < 1/R**2 > | 623.013404 |
Total Energy= -476.15882633 a.u.
Kinetic Energy= 476.09742925 a.u.
Potential Energy= -952.25625559 a.u.
Virial Ratio = -2.00012896