(1s 2 2s 2 3p 1 ) 2 P Ar 13+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2131.
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 | 3p- electron | |
| 1 | 2p | 5.986940 | .89822395 |
| 2 | 3p | 4.756619 | -1.52125376 |
| 3 | 2p | 12.964003 | .04554107 |
| 4 | 4p | 15.629288 | .01049514 |
| 5 | 5p | 4.482749 | .00524397 |
| 6 | 5p | 46.531094 | -.00009767 |
| ORB.ENERGY,a.u. | -11.582000 | ||
| NORM | 1.000000 | < R > | .839794 | < R2 > | .812121 | < 1/R > | 1.656363 | < 1/R**2 > | 5.648846 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.985742 | .41225812 |
| 2 | 2s | 7.472712 | -.81693868 |
| 3 | 3s | 9.730246 | -.28859886 |
| 4 | 5s | 17.606198 | -.01275592 |
| 5 | 4s | 35.142809 | .00227999 |
| 6 | 5s | 51.284285 | -.00035987 |
| 7 | 5s | 11.455263 | -.00128010 |
| ORB.ENERGY,a.u. | -35.400000 | ||
| NORM | 1.000000 | < R > | .366149 | < R2 > | .156632 | < 1/R > | 4.026083 | < 1/R**2 > | 65.300259 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.072955 | .93128770 |
| 2 | 1s | 26.486453 | .06721226 |
| 3 | 2s | 18.824104 | .01868023 |
| 4 | 3s | 20.148832 | -.01584412 |
| 5 | 5s | 40.660897 | .00072818 |
| 6 | 4s | 89.117581 | -.00005819 |
| 7 | 5s | 10.743479 | -.00009595 |
| ORB.ENERGY,a.u. | -143.150000 |
| NORM | 1.000000 | < R > | .085261 | < R2 > | .009724 | < 1/R > | 17.664439 | < 1/R**2 > | 627.258119 |
Total Energy= -389.09958569 a.u.
Kinetic Energy= 389.09958849 a.u.
Potential Energy= -778.19917418 a.u.
Virial Ratio = -1.99999999