(1s 2 2s 2 2p 4 5p 1 ) 2 P P 6+
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 | 3.665988 | .24613133 |
| 2 | 3p | 1.832434 | -2.49735428 |
| 3 | 4p | 1.646278 | 5.16506702 |
| 4 | 5p | 1.471921 | -3.49490064 |
| 5 | 2p | 9.060298 | .03662873 |
| 6 | 5p | 13.652360 | .00129706 |
| 7 | 4p | 31.478414 | -.00012836 |
| ORB.ENERGY,a.u. | -1.092300 | ||
| NORM | 1.000002 | < R > | 4.678564 | < R2 > | 24.610850 | < 1/R > | .300660 | < 1/R**2 > | .300214 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.077126 | 1.03220644 |
| 2 | 3p | 5.655176 | -.15325845 |
| 3 | 2p | 9.583085 | .14373457 |
| 4 | 4p | 16.036803 | -.00429438 |
| 5 | 5p | 1.939245 | .05425657 |
| 6 | 4p | 1.495110 | -.05079355 |
| 7 | 3p | 18.203472 | -.00419184 |
| 8 | 5p | 35.534093 | -.00018241 |
| 9 | 3p | .910983 | -.00422288 |
| ORB.ENERGY,a.u. | -10.968000 | ||
| NORM | 1.000000 | < R > | .440620 | < R2 > | .239392 | < 1/R > | 2.915436 | < 1/R**2 > | 11.710278 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 12.024198 | .38703112 |
| 2 | 2s | 6.241848 | -.85800916 |
| 3 | 3s | 5.511054 | -.30523580 |
| 4 | 4s | 17.040172 | .00858007 |
| 5 | 3s | 19.490722 | .00612413 |
| 6 | 5s | 32.319493 | .00065274 |
| 7 | 5s | 6.359819 | .01797205 |
| 8 | 4s | 3.423227 | .00036596 |
| 9 | 2s | 84.850910 | .00000597 |
| ORB.ENERGY,a.u. | -11.509000 | ||
| NORM | 1.000000 | < R > | .489545 | < R2 > | .282417 | < 1/R > | 2.983744 | < 1/R**2 > | 36.413521 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.210532 | .92279720 |
| 2 | 1s | 20.928661 | .07367561 |
| 3 | 2s | 8.774990 | .02038213 |
| 4 | 3s | 10.778041 | -.02031851 |
| 5 | 4s | 13.355744 | .00940976 |
| 6 | 5s | 35.807030 | .00084864 |
| 7 | 4s | 85.143786 | -.00003773 |
| ORB.ENERGY,a.u. | -84.413000 |
| NORM | 1.000000 | < R > | .103540 | < R2 > | .014397 | < 1/R > | 14.596670 | < 1/R**2 > | 429.654266 |
Total Energy= -317.79828592 a.u.
Kinetic Energy= 317.77981064 a.u.
Potential Energy= -635.57809656 a.u.
Virial Ratio = -2.00005814