(1s 2 2s 2 2p 4 5p 1 ) 2 D Ar 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2251.
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 | 5p- electron | |
| 1 | 2p | 4.850099 | .28873163 |
| 2 | 3p | 2.631148 | -2.50538365 |
| 3 | 4p | 2.311100 | 5.23681217 |
| 4 | 5p | 2.083958 | -3.65129677 |
| 5 | 2p | 10.492184 | .05384248 |
| 6 | 5p | 14.345146 | .00111829 |
| 7 | 4p | 35.846206 | -.00021723 |
| 8 | 2p | 1.209075 | .03977039 |
| ORB.ENERGY,a.u. | -2.204200 | ||
| NORM | 1.000000 | < R > | 3.314319 | < R2 > | 12.352176 | < 1/R > | .434660 | < 1/R**2 > | .678233 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.511461 | 1.13122380 |
| 2 | 3p | 7.266154 | -.20675420 |
| 3 | 2p | 13.679819 | .07168231 |
| 4 | 4p | 16.431364 | .01040171 |
| 5 | 5p | 2.921595 | .01316378 |
| 6 | 5p | 43.200170 | -.00013040 |
| 7 | 4p | 2.406396 | -.01361017 |
| ORB.ENERGY,a.u. | -19.320000 | ||
| NORM | 1.000000 | < R > | .347813 | < R2 > | .147694 | < 1/R > | 3.670427 | < 1/R**2 > | 18.433159 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.150130 | .41654596 |
| 2 | 2s | 7.824514 | -.86279582 |
| 3 | 3s | 7.307028 | -.30259308 |
| 4 | 4s | 14.700925 | .00337189 |
| 5 | 3s | 17.577889 | .01390571 |
| 6 | 5s | 38.742642 | .00071439 |
| 7 | 5s | 7.252079 | -.00463404 |
| 8 | 3s | 72.957414 | -.00002651 |
| ORB.ENERGY,a.u. | -20.023000 | ||
| NORM | 1.000000 | < R > | .393123 | < R2 > | .181631 | < 1/R > | 3.731183 | < 1/R**2 > | 56.796366 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.131978 | .92015123 |
| 2 | 1s | 24.627209 | .07624221 |
| 3 | 2s | 11.258840 | .02012891 |
| 4 | 3s | 13.631470 | -.02040264 |
| 5 | 4s | 16.337338 | .00894915 |
| 6 | 5s | 44.105594 | .00069792 |
| 7 | 4s | 102.759440 | -.00002551 |
| ORB.ENERGY,a.u. | -127.520000 |
| NORM | 1.000000 | < R > | .085844 | < R2 > | .009886 | < 1/R > | 17.586935 | < 1/R**2 > | 622.978419 |
Total Energy= -475.12167452 a.u.
Kinetic Energy= 475.11773950 a.u.
Potential Energy= -950.23941402 a.u.
Virial Ratio = -2.00000828