(1s 2 ) 1 S Si 12+
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 | 13.453500 | .96227597 |
2 | 1s | 24.681344 | .02982532 |
3 | 2s | 19.142568 | .01408914 |
4 | 3s | 25.876962 | -.00293177 |
5 | 4s | 14.887042 | .00083524 |
6 | 5s | 41.478721 | .00031148 |
ORB.ENERGY,a.u. | -89.806000 |
NORM | 1.000000 | < R > | .110098 | < R2 > | .016219 | < 1/R > | 13.687497 | < 1/R**2 > | 376.971709 |
Total Energy= -187.36108113 a.u.
Kinetic Energy= 187.36108333 a.u.
Potential Energy= -374.72216446 a.u.
Virial Ratio = -1.99999999