(1s 1 5p 1 ) 1 P Cl 15+
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 | 2.103637 | 8.20415208 |
| 2 | 3p | 3.813501 | -7.87629786 |
| 3 | 4p | 2.799798 | 10.43038566 |
| 4 | 5p | 3.054224 | -12.04188615 |
| 5 | 5p | 9.282583 | .01082374 |
| 6 | 4p | 23.588380 | -.00183396 |
| 7 | 5p | 2.456419 | -.64865621 |
| 8 | 5p | 49.917974 | -.00013692 |
| 9 | 3p | 37.166140 | -.00025448 |
| ORB.ENERGY,a.u. | -5.676200 | ||
| NORM | 1.000000 | < R > | 2.284199 | < R2 > | 5.874885 | < 1/R > | .639590 | < 1/R**2 > | 1.365739 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.770137 | .88942459 |
| 2 | 1s | 19.407571 | .10539568 |
| 3 | 2s | 17.300352 | .01065458 |
| 4 | 3s | 17.813780 | -.00512240 |
| 5 | 4s | 21.017015 | .00002332 |
| 6 | 5s | 11.530837 | .00002242 |
| ORB.ENERGY,a.u. | -144.400000 |
| NORM | 1.000000 | < R > | .088237 | < R2 > | .010381 | < 1/R > | 16.999991 | < 1/R**2 > | 578.003904 |
Total Energy= -149.63407012 a.u.
Kinetic Energy= 149.61325053 a.u.
Potential Energy= -299.24732065 a.u.
Virial Ratio = -2.00013916