(1s 1 2p 1 ) 3 P Ar 16+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3121.
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 | 2p- electron | |
| 1 | 2p | 8.546410 | .97961278 |
| 2 | 2p | 16.356424 | .01525690 |
| 3 | 3p | 11.039894 | .01247087 |
| 4 | 4p | 11.038830 | -.00389843 |
| 5 | 5p | 34.375630 | -.00037767 |
| ORB.ENERGY,a.u. | -37.287000 | ||
| NORM | 1.000000 | < R > | .290303 | < R2 > | .101304 | < 1/R > | 4.316703 | < 1/R**2 > | 24.939058 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.737560 | .92958740 |
| 2 | 1s | 22.022133 | .06538740 |
| 3 | 2s | 18.120097 | .01111640 |
| 4 | 3s | 21.458944 | -.00494633 |
| 5 | 4s | 59.055427 | .00001028 |
| 6 | 5s | 15.260767 | .00038676 |
| ORB.ENERGY,a.u. | -158.790000 |
| NORM | 1.000000 | < R > | .083624 | < R2 > | .009336 | < 1/R > | 17.957497 | < 1/R**2 > | 645.565987 |
Total Energy= -198.36700028 a.u.
Kinetic Energy= 198.50601285 a.u.
Potential Energy= -396.87301313 a.u.
Virial Ratio = -1.99929971