(1s 2 5p 1 ) 2 P O 5+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2151.
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 | 5p- electron | |
| 1 | 2p | .890935 | 5.91577809 |
| 2 | 3p | 1.471181 | -6.89165468 |
| 3 | 4p | 1.137537 | 8.19325995 |
| 4 | 5p | 1.176299 | -8.62196048 |
| 5 | 2p | 7.096437 | .00887863 |
| 6 | 5p | 8.204011 | .00240269 |
| 7 | 3p | 10.257468 | -.00048761 |
| 8 | 5p | .586606 | -.00239081 |
| ORB.ENERGY,a.u. | -.728270 | ||
| NORM | 1.000011 | < R > | 6.013471 | < R2 > | 40.722539 | < 1/R > | .244000 | < 1/R**2 > | .206014 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 7.364319 | .73005218 |
| 2 | 1s | 10.607092 | .20553480 |
| 3 | 2s | 7.652361 | .09851806 |
| 4 | 3s | 8.220393 | -.02362616 |
| 5 | 4s | 14.442894 | .00452412 |
| 6 | 5s | 60.535500 | -.00001845 |
| 7 | 5s | 7.972162 | -.00065738 |
| ORB.ENERGY,a.u. | -26.866000 |
| NORM | 1.000000 | < R > | .196798 | < R2 > | .051969 | < 1/R > | 7.686407 | < 1/R**2 > | 119.456732 |
Total Energy= -59.83926974 a.u.
Kinetic Energy= 59.83925829 a.u.
Potential Energy= -119.67852803 a.u.
Virial Ratio = -2.00000019