(1s 2 5p 1 ) 2 P Cl 14+
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 | 2.117089 | 6.89229893 |
| 2 | 3p | 3.646364 | -7.32529318 |
| 3 | 4p | 2.736722 | 9.08071568 |
| 4 | 5p | 2.904263 | -10.15807997 |
| 5 | 2p | 19.510932 | .00232371 |
| 6 | 5p | 2.242845 | -.12415924 |
| 7 | 5p | 7.478423 | .01643268 |
| ORB.ENERGY,a.u. | -4.530900 | ||
| NORM | 1.000000 | < R > | 2.419419 | < R2 > | 6.591074 | < 1/R > | .604676 | < 1/R**2 > | 1.238965 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.398347 | .93882624 |
| 2 | 1s | 25.824672 | .04857872 |
| 3 | 2s | 20.361081 | .01728056 |
| 4 | 3s | 15.732680 | .00038958 |
| 5 | 4s | 52.465360 | -.00061794 |
| 6 | 5s | 62.058228 | .00020936 |
| 7 | 3s | 77.203564 | -.00005086 |
| ORB.ENERGY,a.u. | -133.800000 |
| NORM | 1.000000 | < R > | .090239 | < R2 > | .010889 | < 1/R > | 16.686121 | < 1/R**2 > | 559.641386 |
Total Energy= -283.01124932 a.u.
Kinetic Energy= 283.01122700 a.u.
Potential Energy= -566.02247632 a.u.
Virial Ratio = -2.00000008