(1s 2 ) 1 S Mg 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1010.
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 | 1s- electron | |
1 | 1s | 11.424323 | .96334180 |
2 | 1s | 22.882508 | .02943703 |
3 | 2s | 19.613037 | .01388958 |
4 | 3s | 20.788532 | -.00407378 |
5 | 5s | 26.052143 | .00153128 |
6 | 4s | 31.004879 | .00087328 |
ORB.ENERGY,a.u. | -64.845000 |
NORM | 1.000000 | < R > | .129042 | < R2 > | .022294 | < 1/R > | 11.687496 | < 1/R**2 > | 275.142218 |
Total Energy= -136.61109396 a.u.
Kinetic Energy= 136.61109261 a.u.
Potential Energy= -273.22218657 a.u.
Virial Ratio = -2.00000001