(1s 2 2s 2 2p 4 5d 1 ) 2 F Ar 9+
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 | 2.718014 | 1.24937914 |
| 2 | 4d | 2.024346 | -5.21209738 |
| 3 | 5d | 2.019831 | 4.72497416 |
| 4 | 3d | 6.473546 | .05380634 |
| 5 | 5d | 9.748645 | -.01178047 |
| 6 | 4d | 22.935462 | .00019140 |
| 7 | 5d | 1.588868 | -.01541053 |
| 8 | 3d | 31.885243 | .00003950 |
| ORB.ENERGY,a.u. | -2.057000 | ||
| NORM | 1.000003 | < R > | 3.341905 | < R2 > | 12.690958 | < 1/R > | .419781 | < 1/R**2 > | .373600 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.494343 | 1.12932616 |
| 2 | 3p | 7.285435 | -.20618223 |
| 3 | 2p | 13.693325 | .07296699 |
| 4 | 4p | 15.982131 | .01525992 |
| 5 | 5p | 18.104927 | -.00188889 |
| 6 | 4p | 5.955658 | -.00395969 |
| 7 | 4p | 70.655383 | .00002460 |
| ORB.ENERGY,a.u. | -19.308000 | ||
| NORM | 1.000000 | < R > | .347890 | < R2 > | .147761 | < 1/R > | 3.669909 | < 1/R**2 > | 18.429486 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.181043 | .41521544 |
| 2 | 2s | 7.812569 | -.86221881 |
| 3 | 3s | 7.313106 | -.30210805 |
| 4 | 4s | 13.998405 | .00368634 |
| 5 | 3s | 17.983539 | .01405770 |
| 6 | 5s | 39.837581 | .00051617 |
| 7 | 5s | 7.079867 | -.00436597 |
| 8 | 2s | 101.902953 | .00000455 |
| ORB.ENERGY,a.u. | -20.023000 | ||
| NORM | 1.000000 | < R > | .393101 | < R2 > | .181613 | < 1/R > | 3.731450 | < 1/R**2 > | 56.803500 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.132489 | .91985382 |
| 2 | 1s | 24.600560 | .07653498 |
| 3 | 2s | 11.204549 | .02021514 |
| 4 | 3s | 13.629937 | -.02041768 |
| 5 | 4s | 16.406168 | .00883536 |
| 6 | 5s | 44.057157 | .00072852 |
| 7 | 4s | 106.239401 | -.00002431 |
| ORB.ENERGY,a.u. | -127.520000 |
| NORM | 1.000000 | < R > | .085840 | < R2 > | .009885 | < 1/R > | 17.587576 | < 1/R**2 > | 623.014576 |
Total Energy= -474.97939056 a.u.
Kinetic Energy= 474.97207224 a.u.
Potential Energy= -949.95146280 a.u.
Virial Ratio = -2.00001541