(1s 2 2s 2 2p 1 5p 1 ) 3 S Ar 12+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3051.
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 | 5.713709 | .40261179 |
| 2 | 3p | 2.995730 | -3.56496585 |
| 3 | 4p | 2.658452 | 9.74466458 |
| 4 | 5p | 2.668914 | -7.09009433 |
| 5 | 2p | 11.319412 | .03235850 |
| 6 | 5p | 4.982678 | -.16129453 |
| 7 | 5p | 40.817425 | -.00038964 |
| 8 | 4p | 63.997224 | -.00005851 |
| 9 | 4p | 1.454741 | .00118417 |
| ORB.ENERGY,a.u. | -3.550600 | ||
| NORM | 1.000000 | < R > | 2.675985 | < R2 > | 8.054612 | < 1/R > | .541331 | < 1/R**2 > | 1.014053 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.634669 | 1.08210800 |
| 2 | 3p | 9.158830 | -.09420502 |
| 3 | 2p | 18.741151 | .01103843 |
| 4 | 5p | 22.927365 | .00235629 |
| 5 | 5p | 9.099762 | .00069641 |
| ORB.ENERGY,a.u. | -27.210000 | ||
| NORM | 1.000000 | < R > | .319916 | < R2 > | .123678 | < 1/R > | 3.942732 | < 1/R**2 > | 20.977350 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 15.374163 | .39047295 |
| 2 | 2s | 7.027671 | -.81733495 |
| 3 | 3s | 10.041734 | -.28737251 |
| 4 | 4s | 33.358138 | .00121705 |
| 5 | 5s | 19.387633 | -.00811773 |
| 6 | 5s | 7.767701 | .01766890 |
| ORB.ENERGY,a.u. | -26.841000 | ||
| NORM | 1.000000 | < R > | .371550 | < R2 > | .161406 | < 1/R > | 3.962150 | < 1/R**2 > | 63.417314 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.201462 | .93937646 |
| 2 | 1s | 26.462174 | .05706813 |
| 3 | 2s | 16.036168 | .02009868 |
| 4 | 3s | 19.557924 | -.01411796 |
| 5 | 4s | 87.615181 | -.00005885 |
| 6 | 5s | 41.297821 | .00064335 |
| 7 | 5s | 10.172059 | .00003638 |
| ORB.ENERGY,a.u. | -137.760000 |
| NORM | 1.000000 | < R > | .085405 | < R2 > | .009764 | < 1/R > | 17.645061 | < 1/R**2 > | 626.185738 |
Total Energy= -408.75795928 a.u.
Kinetic Energy= 408.75848264 a.u.
Potential Energy= -817.51644192 a.u.
Virial Ratio = -1.99999872