(1s 2 2s 2 2p 4 5p 1 ) 2 P Cl 8+
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 | 4.220597 | .30492163 |
| 2 | 3p | 2.283016 | -2.83011214 |
| 3 | 4p | 2.069158 | 5.74290428 |
| 4 | 5p | 1.874199 | -3.79485986 |
| 5 | 2p | 10.217024 | .04225263 |
| 6 | 5p | 12.622474 | .00132551 |
| 7 | 4p | 33.152987 | -.00020518 |
| ORB.ENERGY,a.u. | -1.774400 | ||
| NORM | .999997 | < R > | 3.703722 | < R2 > | 15.428807 | < 1/R > | .383104 | < 1/R**2 > | .495037 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.011733 | 1.02637723 |
| 2 | 3p | 6.530365 | -.14295547 |
| 3 | 2p | 11.077861 | .13419012 |
| 4 | 4p | 32.054633 | -.00034202 |
| 5 | 5p | 2.436902 | .04728433 |
| 6 | 4p | 1.878258 | -.04282058 |
| 7 | 3p | 17.100102 | -.00622741 |
| 8 | 3p | 1.251676 | -.00507853 |
| ORB.ENERGY,a.u. | -16.265000 | ||
| NORM | 1.000000 | < R > | .373917 | < R2 > | .171485 | < 1/R > | 3.420325 | < 1/R**2 > | 16.035160 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.490713 | .40545729 |
| 2 | 2s | 7.288916 | -.85540375 |
| 3 | 3s | 6.779244 | -.29976344 |
| 4 | 4s | 17.615787 | .00766026 |
| 5 | 3s | 20.458951 | .00790317 |
| 6 | 5s | 35.478441 | .00063816 |
| 7 | 5s | 6.643710 | -.00449907 |
| 8 | 2s | 83.219444 | .00000998 |
| ORB.ENERGY,a.u. | -16.930000 | ||
| NORM | 1.000000 | < R > | .420739 | < R2 > | .208199 | < 1/R > | 3.481892 | < 1/R**2 > | 49.500394 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.159275 | .92075141 |
| 2 | 1s | 23.384789 | .07555436 |
| 3 | 2s | 10.457472 | .02019154 |
| 4 | 3s | 12.716174 | -.02018194 |
| 5 | 4s | 15.399861 | .00901648 |
| 6 | 5s | 41.389035 | .00077058 |
| 7 | 4s | 99.108928 | -.00002628 |
| ORB.ENERGY,a.u. | -112.130000 |
| NORM | 1.000000 | < R > | .091033 | < R2 > | .011121 | < 1/R > | 16.589831 | < 1/R**2 > | 554.539550 |
Total Energy= -419.13698837 a.u.
Kinetic Energy= 419.11113264 a.u.
Potential Energy= -838.24812101 a.u.
Virial Ratio = -2.00006169