(1s 1 5p 1 ) 1 P Ar 16+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1151.
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 | 2.209505 | 8.43732308 |
| 2 | 3p | 4.025670 | -8.07571901 |
| 3 | 4p | 2.983969 | 10.73089864 |
| 4 | 5p | 3.254012 | -12.27686849 |
| 5 | 5p | 9.607737 | .01020471 |
| 6 | 4p | 24.339774 | -.00183377 |
| 7 | 5p | 2.621971 | -.79290058 |
| 8 | 5p | 51.506775 | -.00013977 |
| 9 | 3p | 38.026134 | -.00027579 |
| ORB.ENERGY,a.u. | -6.480500 | ||
| NORM | .999999 | < R > | 2.149670 | < R2 > | 5.203243 | < 1/R > | .679600 | < 1/R**2 > | 1.541890 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.774523 | .88945823 |
| 2 | 1s | 20.407594 | .10537389 |
| 3 | 2s | 17.923685 | .01065181 |
| 4 | 3s | 18.748349 | -.00513393 |
| 5 | 4s | 22.072555 | .00002251 |
| 6 | 5s | 12.205501 | .00002068 |
| ORB.ENERGY,a.u. | -162.000000 |
| NORM | 1.000000 | < R > | .083335 | < R2 > | .009260 | < 1/R > | 17.999974 | < 1/R**2 > | 648.003265 |
Total Energy= -167.79500246 a.u.
Kinetic Energy= 167.77273946 a.u.
Potential Energy= -335.56774192 a.u.
Virial Ratio = -2.00013270