(1s 2 ) 1 S N 5+
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 | 5.593644 | .39577653 |
2 | 1s | 7.084571 | .65821112 |
3 | 2s | 9.100466 | -.04407727 |
4 | 3s | 6.066797 | -.01653086 |
5 | 4s | 12.332313 | .00423506 |
6 | 5s | 43.449910 | -.00005384 |
ORB.ENERGY,a.u. | -20.260000 |
NORM | 1.000000 | < R > | .226470 | < R2 > | .068885 | < 1/R > | 6.687488 | < 1/R**2 > | 90.568727 |
Total Energy= -44.73616399 a.u.
Kinetic Energy= 44.73616419 a.u.
Potential Energy= -89.47232818 a.u.
Virial Ratio = -2.00000000