(1s 2 2s 2 2p 2 3p 1 ) 4 S Ar 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4031.
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 | 3p- electron | |
| 1 | 2p | 5.506606 | .77842326 |
| 2 | 3p | 4.157708 | -1.47106822 |
| 3 | 2p | 14.775296 | .02416808 |
| 4 | 4p | 9.499463 | -.04468905 |
| 5 | 5p | 24.076776 | .00133757 |
| 6 | 5p | 4.934985 | .02666154 |
| 7 | 4p | 45.767224 | .00001935 |
| 8 | 4p | 3.805786 | .02399808 |
| ORB.ENERGY,a.u. | -8.907300 | ||
| NORM | 1.000000 | < R > | .955922 | < R2 > | 1.030580 | < 1/R > | 1.348891 | < 1/R**2 > | 3.502738 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.213296 | 1.35615554 |
| 2 | 3p | 9.166668 | -.37850075 |
| 3 | 2p | 3.854579 | -.08694137 |
| 4 | 4p | 11.509747 | .08661556 |
| 5 | 5p | 22.401939 | .00386160 |
| 6 | 3p | 3.412677 | -.01528965 |
| 7 | 4p | 2.976529 | .00213961 |
| 8 | 3p | 29.053877 | -.00014435 |
| ORB.ENERGY,a.u. | -23.739000 | ||
| NORM | 1.000000 | < R > | .321031 | < R2 > | .123668 | < 1/R > | 3.908598 | < 1/R**2 > | 20.565683 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.081877 | .43536055 |
| 2 | 2s | 7.965484 | -.87195444 |
| 3 | 3s | 8.147621 | -.28695904 |
| 4 | 4s | 30.601168 | .00186240 |
| 5 | 3s | 16.439190 | .01653960 |
| 6 | 5s | 7.830508 | -.01943987 |
| ORB.ENERGY,a.u. | -23.662000 | ||
| NORM | 1.000000 | < R > | .379724 | < R2 > | .168950 | < 1/R > | 3.871790 | < 1/R**2 > | 60.798352 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.064276 | .92757672 |
| 2 | 1s | 25.795593 | .07102099 |
| 3 | 2s | 15.819199 | .01938167 |
| 4 | 3s | 19.780663 | -.01551168 |
| 5 | 5s | 42.285220 | .00071019 |
| 6 | 4s | 94.875016 | -.00004032 |
| 7 | 5s | 14.708847 | .00025386 |
| ORB.ENERGY,a.u. | -133.590000 |
| NORM | 1.000000 | < R > | .085592 | < R2 > | .009815 | < 1/R > | 17.619924 | < 1/R**2 > | 624.792058 |
Total Energy= -439.34985566 a.u.
Kinetic Energy= 439.29339611 a.u.
Potential Energy= -878.64325177 a.u.
Virial Ratio = -2.00012852