(1s 2 ) 1 S O 6+
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 | 6.484938 | .39042362 |
2 | 1s | 8.082968 | .66342374 |
3 | 2s | 10.293116 | -.04361452 |
4 | 3s | 7.109121 | -.01727515 |
5 | 4s | 14.252694 | .00362960 |
6 | 5s | 48.922780 | -.00004963 |
ORB.ENERGY,a.u. | -27.154000 |
NORM | 1.000000 | < R > | .196757 | < R2 > | .051945 | < 1/R > | 7.687491 | < 1/R**2 > | 119.483445 |
Total Energy= -59.11114262 a.u.
Kinetic Energy= 59.11114753 a.u.
Potential Energy= -118.22229016 a.u.
Virial Ratio = -1.99999992