(1s 2 2s 2 2p 4 4d 1 ) 4 F Ar 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4342.
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 | 4d- electron | |
| 1 | 3d | 2.912319 | 1.24267231 |
| 2 | 4d | 2.541638 | -1.80486343 |
| 3 | 3d | 8.046062 | .04360141 |
| 4 | 5d | 28.408751 | -.00011072 |
| 5 | 4d | 5.868038 | .04717201 |
| ORB.ENERGY,a.u. | -3.255200 | ||
| NORM | 1.000001 | < R > | 1.997598 | < R2 > | 4.579170 | < 1/R > | .670203 | < 1/R**2 > | .755667 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.505303 | 1.12538069 |
| 2 | 3p | 7.269884 | -.20295422 |
| 3 | 2p | 13.731207 | .07214372 |
| 4 | 4p | 16.506793 | .01318182 |
| 5 | 5p | 20.952855 | -.00057778 |
| 6 | 5p | 4.885279 | -.00085090 |
| 7 | 4p | 70.973775 | .00002453 |
| ORB.ENERGY,a.u. | -19.068000 | ||
| NORM | 1.000000 | < R > | .348198 | < R2 > | .148053 | < 1/R > | 3.667453 | < 1/R**2 > | 18.408647 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.158932 | .41595948 |
| 2 | 2s | 7.817776 | -.86242776 |
| 3 | 3s | 7.318022 | -.30214244 |
| 4 | 4s | 13.706159 | .00392949 |
| 5 | 3s | 17.620148 | .01397521 |
| 6 | 5s | 38.389163 | .00067197 |
| 7 | 5s | 7.178023 | -.00595693 |
| 8 | 4s | 3.615336 | .00014760 |
| 9 | 3s | 67.889184 | -.00003221 |
| ORB.ENERGY,a.u. | -20.023000 | ||
| NORM | 1.000000 | < R > | .393326 | < R2 > | .181844 | < 1/R > | 3.729375 | < 1/R**2 > | 56.745389 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.132698 | .91984894 |
| 2 | 1s | 24.599185 | .07653791 |
| 3 | 2s | 11.205993 | .02021291 |
| 4 | 3s | 13.631838 | -.02041487 |
| 5 | 4s | 16.406280 | .00883481 |
| 6 | 5s | 44.044252 | .00073048 |
| 7 | 4s | 106.317136 | -.00002455 |
| ORB.ENERGY,a.u. | -127.520000 |
| NORM | 1.000000 | < R > | .085839 | < R2 > | .009885 | < 1/R > | 17.587684 | < 1/R**2 > | 623.020782 |
Total Energy= -476.16241166 a.u.
Kinetic Energy= 476.17029812 a.u.
Potential Energy= -952.33270978 a.u.
Virial Ratio = -1.99998344