(1s 1 5p 1 ) 3 P Mg 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3151.
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 | 1.681389 | 6.02190813 |
| 2 | 3p | 2.798773 | -6.54288053 |
| 3 | 4p | 1.924509 | 8.80659666 |
| 4 | 5p | 2.092230 | -9.82204175 |
| 5 | 5p | 5.678441 | .05860118 |
| 6 | 4p | 13.271528 | -.00619959 |
| 7 | 5p | 30.677235 | -.00056466 |
| 8 | 4p | .923437 | -.01695556 |
| 9 | 4p | 47.916004 | -.00010331 |
| 10 | 5p | .888427 | .00702095 |
| ORB.ENERGY,a.u. | -2.573900 | ||
| NORM | 1.000006 | < R > | 3.298484 | < R2 > | 12.250322 | < 1/R > | .443314 | < 1/R**2 > | .664543 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 11.743373 | .88930957 |
| 2 | 1s | 14.405099 | .10561841 |
| 3 | 2s | 14.372175 | .01039691 |
| 4 | 3s | 11.834606 | -.00535040 |
| 5 | 4s | 13.036531 | .00016550 |
| 6 | 5s | 14.363940 | .00027540 |
| ORB.ENERGY,a.u. | -71.694000 |
| NORM | 1.000000 | < R > | .125026 | < R2 > | .020843 | < 1/R > | 11.998116 | < 1/R**2 > | 287.925516 |
Total Energy= -74.42939243 a.u.
Kinetic Energy= 74.43418210 a.u.
Potential Energy= -148.86357454 a.u.
Virial Ratio = -1.99993565