(1s 2 2s 2 2p 4 3d 1 ) 4 D Ar 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4232.
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 | 3d- electron | |
| 1 | 3d | 3.581310 | 1.11893939 |
| 2 | 3d | 8.182434 | .04188567 |
| 3 | 4d | 4.348532 | -.14956328 |
| 4 | 5d | 25.325356 | -.00015332 |
| 5 | 5d | 3.320728 | .00670366 |
| 6 | 4d | 62.945386 | .00000404 |
| ORB.ENERGY,a.u. | -5.928800 | ||
| NORM | 1.000000 | < R > | .952166 | < R2 > | 1.049705 | < 1/R > | 1.247864 | < 1/R**2 > | 1.917226 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.111677 | 1.52292366 |
| 2 | 3p | 5.810769 | -.73540274 |
| 3 | 2p | 11.819456 | .16941360 |
| 4 | 4p | 16.758850 | .01652412 |
| 5 | 5p | 13.913918 | .02262270 |
| 6 | 4p | 5.049309 | -.03556874 |
| 7 | 5p | 41.115856 | -.00017139 |
| 8 | 3p | 3.207205 | .00120290 |
| ORB.ENERGY,a.u. | -18.590000 | ||
| NORM | 1.000000 | < R > | .349529 | < R2 > | .149392 | < 1/R > | 3.657668 | < 1/R**2 > | 18.327511 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.160413 | .41515595 |
| 2 | 2s | 7.820851 | -.86018032 |
| 3 | 3s | 7.334212 | -.30126636 |
| 4 | 4s | 13.049762 | .00378630 |
| 5 | 3s | 17.418094 | .01464791 |
| 6 | 5s | 39.243804 | .00064740 |
| 7 | 5s | 7.171354 | -.01092736 |
| 8 | 3s | 68.546953 | -.00002286 |
| ORB.ENERGY,a.u. | -20.023000 | ||
| NORM | 1.000000 | < R > | .394148 | < R2 > | .182726 | < 1/R > | 3.722426 | < 1/R**2 > | 56.556233 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.133116 | .91984655 |
| 2 | 1s | 24.598589 | .07653770 |
| 3 | 2s | 11.218760 | .02018799 |
| 4 | 3s | 13.637996 | -.02040611 |
| 5 | 4s | 16.394960 | .00883935 |
| 6 | 5s | 44.121621 | .00073770 |
| 7 | 4s | 106.560405 | -.00002307 |
| ORB.ENERGY,a.u. | -127.520000 |
| NORM | 1.000000 | < R > | .085836 | < R2 > | .009884 | < 1/R > | 17.588139 | < 1/R**2 > | 623.046756 |
Total Energy= -478.73638402 a.u.
Kinetic Energy= 478.84476590 a.u.
Potential Energy= -957.58114991 a.u.
Virial Ratio = -1.99977366