(1s 2 2s 2 2p 5 5p 1 ) 1 S Mg 2+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1051.
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 | 2.136838 | .11941421 |
| 2 | 3p | 1.036474 | -1.13524371 |
| 3 | 4p | .739884 | 3.27253478 |
| 4 | 5p | .663711 | -2.92027368 |
| 5 | 2p | 6.981760 | .01543442 |
| 6 | 5p | 9.421215 | .00145627 |
| 7 | 4p | 23.203407 | -.00008811 |
| ORB.ENERGY,a.u. | -.216520 | ||
| NORM | 1.000005 | < R > | 10.109427 | < R2 > | 114.728462 | < 1/R > | .132275 | < 1/R**2 > | .044602 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.397951 | 1.32301961 |
| 2 | 3p | 4.110908 | -.41562913 |
| 3 | 2p | 8.593942 | .09124341 |
| 4 | 4p | 9.868774 | .01835614 |
| 5 | 5p | .899952 | .06373053 |
| 6 | 4p | .678199 | -.06190382 |
| 7 | 5p | 25.990737 | -.00032879 |
| 8 | 4p | 34.011074 | -.00008018 |
| 9 | 3p | .372573 | -.00324728 |
| ORB.ENERGY,a.u. | -3.784000 | ||
| NORM | 1.000000 | < R > | .640050 | < R2 > | .524323 | < 1/R > | 2.055785 | < 1/R**2 > | 5.972225 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.867769 | .33698667 |
| 2 | 2s | 4.614681 | -.84358280 |
| 3 | 3s | 3.594586 | -.31727267 |
| 4 | 4s | 19.959377 | .00610903 |
| 5 | 3s | 21.869525 | .00144066 |
| 6 | 5s | 16.623604 | .00669419 |
| 7 | 5s | 4.023402 | .03782634 |
| ORB.ENERGY,a.u. | -4.396500 | ||
| NORM | 1.000000 | < R > | .669202 | < R2 > | .533219 | < 1/R > | 2.171106 | < 1/R**2 > | 19.416066 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 11.193295 | .90716247 |
| 2 | 1s | 16.608105 | .09137952 |
| 3 | 2s | 6.093845 | .01902571 |
| 4 | 3s | 7.735214 | -.02090279 |
| 5 | 4s | 9.887675 | .01072517 |
| 6 | 5s | 28.748399 | .00102967 |
| 7 | 4s | 67.684473 | -.00004176 |
| ORB.ENERGY,a.u. | -49.033000 |
| NORM | 1.000000 | < R > | .130495 | < R2 > | .022911 | < 1/R > | 11.603177 | < 1/R**2 > | 272.032939 |
Total Energy= -196.16291295 a.u.
Kinetic Energy= 196.15918824 a.u.
Potential Energy= -392.32210120 a.u.
Virial Ratio = -2.00001899