(1s 2 2s 2 2p 3 5p 1 ) 5 P Cl 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 5151.
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 | 4.854601 | .30008324 |
| 2 | 3p | 2.486863 | -2.95770976 |
| 3 | 4p | 2.265841 | 6.31115385 |
| 4 | 5p | 2.103279 | -4.20410656 |
| 5 | 2p | 9.799330 | .05374521 |
| 6 | 5p | 31.374000 | -.00058960 |
| 7 | 4p | 45.658562 | -.00015404 |
| 8 | 5p | 1.693801 | -.02662508 |
| ORB.ENERGY,a.u. | -2.192400 | ||
| NORM | 1.000002 | < R > | 3.333065 | < R2 > | 12.491140 | < 1/R > | .433022 | < 1/R**2 > | .669738 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.776368 | 1.26783641 |
| 2 | 3p | 8.850565 | -.34869114 |
| 3 | 4p | 11.231331 | .07434845 |
| 4 | 5p | 21.954512 | .00377771 |
| 5 | 4p | 3.945732 | .00260422 |
| 6 | 5p | 21.829862 | -.00047437 |
| 7 | 5p | 3.531905 | -.00421800 |
| 8 | 3p | 2.489381 | .00381387 |
| ORB.ENERGY,a.u. | -19.103000 | ||
| NORM | 1.000000 | < R > | .361373 | < R2 > | .158858 | < 1/R > | 3.518111 | < 1/R**2 > | 16.858895 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.375221 | .41954623 |
| 2 | 2s | 7.395530 | -.86625509 |
| 3 | 3s | 7.185428 | -.28990061 |
| 4 | 4s | 28.936699 | .00189484 |
| 5 | 3s | 15.524842 | .01635395 |
| 6 | 5s | 7.345981 | -.01353428 |
| ORB.ENERGY,a.u. | -18.579000 | ||
| NORM | 1.000000 | < R > | .412320 | < R2 > | .199524 | < 1/R > | 3.556774 | < 1/R**2 > | 51.481726 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.180413 | .94115921 |
| 2 | 1s | 25.222984 | .05649209 |
| 3 | 2s | 14.496783 | .01864645 |
| 4 | 3s | 20.369801 | -.01477519 |
| 5 | 4s | 30.945690 | .00269959 |
| 6 | 5s | 59.358249 | .00009428 |
| 7 | 5s | 12.109557 | .00045440 |
| ORB.ENERGY,a.u. | -114.870000 |
| NORM | 1.000000 | < R > | .090895 | < R2 > | .011080 | < 1/R > | 16.605797 | < 1/R**2 > | 555.366048 |
Total Energy= -402.84828744 a.u.
Kinetic Energy= 402.85943994 a.u.
Potential Energy= -805.70772738 a.u.
Virial Ratio = -1.99997232