(1s 2 ) 1 S Al 11+
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 | 12.465668 | .95496012 |
2 | 1s | 20.254628 | .03999992 |
3 | 2s | 13.186866 | .01097246 |
4 | 3s | 18.454143 | -.00522634 |
5 | 5s | 25.560315 | .00224445 |
6 | 4s | 30.272802 | .00153779 |
ORB.ENERGY,a.u. | -76.813000 |
NORM | 1.000000 | < R > | .118820 | < R2 > | .018895 | < 1/R > | 12.687497 | < 1/R**2 > | 324.056942 |
Total Energy= -160.98608845 a.u.
Kinetic Energy= 160.98608967 a.u.
Potential Energy= -321.97217812 a.u.
Virial Ratio = -1.99999999