(1s 1 4p 1 ) 1 P Cl 15+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1141.
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 | 4p- electron | |
| 1 | 2p | 7.501651 | .47153594 |
| 2 | 3p | 3.889559 | -1.03249604 |
| 3 | 5p | 4.263903 | 1.81009230 |
| 4 | 4p | 5.884219 | -.58225198 |
| 5 | 5p | 12.695843 | .00684309 |
| 6 | 4p | 30.002087 | -.00129748 |
| 7 | 5p | 3.594627 | .07052209 |
| 8 | 5p | 62.302092 | -.00005460 |
| 9 | 3p | 47.718662 | -.00012554 |
| ORB.ENERGY,a.u. | -8.554900 | ||
| NORM | 1.000000 | < R > | 1.439884 | < R2 > | 2.351769 | < 1/R > | .999046 | < 1/R**2 > | 2.664890 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.770341 | .88942362 |
| 2 | 1s | 19.407334 | .10539427 |
| 3 | 2s | 17.311786 | .01065731 |
| 4 | 3s | 17.872825 | -.00511234 |
| 5 | 4s | 19.917364 | .00002021 |
| 6 | 5s | 11.114397 | .00005547 |
| ORB.ENERGY,a.u. | -144.020000 |
| NORM | 1.000000 | < R > | .088238 | < R2 > | .010382 | < 1/R > | 17.000083 | < 1/R**2 > | 578.012815 |
Total Energy= -152.52741121 a.u.
Kinetic Energy= 152.48615020 a.u.
Potential Energy= -305.01356140 a.u.
Virial Ratio = -2.00027059