(1s 1 3p 1 ) 1 P Be 2+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1131.
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 | 3p | .990462 | -2.08229549 |
| 2 | 2p | 1.036617 | 1.51437743 |
| 3 | 4p | 3.171223 | -.01139756 |
| 4 | 3p | 4.826522 | -.00933409 |
| 5 | 2p | 4.884441 | .00053673 |
| ORB.ENERGY,a.u. | -.496390 | ||
| NORM | 1.000002 | < R > | 4.213902 | < R2 > | 20.453078 | < 1/R > | .329174 | < 1/R**2 > | .215669 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 3.919929 | .75848350 |
| 2 | 1s | 4.102183 | .25478564 |
| 3 | 2s | 3.876670 | -.01489193 |
| 4 | 3s | 4.093668 | -.00064133 |
| 5 | 4s | 1.327529 | .00038095 |
| ORB.ENERGY,a.u. | -7.607500 |
| NORM | 1.000000 | < R > | .374788 | < R2 > | .187273 | < 1/R > | 4.001753 | < 1/R**2 > | 32.023369 |
Total Energy= -8.50720020 a.u.
Kinetic Energy= 8.49465317 a.u.
Potential Energy= -17.00185337 a.u.
Virial Ratio = -2.00147705