(1s 1 2s 1 ) 1 S Ar 16+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1020.
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 | 2s- electron | |
| 1 | 1s | 6.109688 | .60311844 |
| 2 | 2s | 7.770888 | -1.11387859 |
| 3 | 3s | 11.101523 | -.48434021 |
| 4 | 4s | 13.275369 | .05213389 |
| 5 | 5s | 23.023106 | -.00539657 |
| 6 | 5s | 6.084471 | -.00122789 |
| 7 | 3s | 56.259014 | -.00005453 |
| ORB.ENERGY,a.u. | -37.955000 | ||
| NORM | 1.000000 | < R > | .345598 | < R2 > | .136451 | < 1/R > | 3.422943 | < 1/R**2 > | 19.656968 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 18.293741 | 1.02309801 |
| 2 | 2s | 20.700460 | .02086991 |
| 3 | 3s | 10.242259 | -.22608562 |
| 4 | 4s | 36.711217 | .00077802 |
| 5 | 5s | 13.706056 | .02306100 |
| 6 | 4s | 8.457293 | -.00837273 |
| 7 | 3s | 54.824632 | .00007310 |
| ORB.ENERGY,a.u. | -159.450000 |
| NORM | 1.000000 | < R > | .082157 | < R2 > | .011042 | < 1/R > | 18.883167 | < 1/R**2 > | 702.398461 |
Total Energy= -199.13745643 a.u.
Kinetic Energy= 199.06391827 a.u.
Potential Energy= -398.20137470 a.u.
Virial Ratio = -2.00036942