(1s 2 2s 2 2p 4 5p 1 ) 4 P Ne +
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4151.
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 | 3.499431 | .08065373 |
| 2 | 3p | .912427 | -.63476834 |
| 3 | 4p | .542954 | 2.23431172 |
| 4 | 5p | .471966 | -2.32247784 |
| 5 | 2p | 7.347609 | .00563558 |
| 6 | 5p | 3.757905 | .01697177 |
| 7 | 3p | 10.915840 | -.00055170 |
| ORB.ENERGY,a.u. | -.106000 | ||
| NORM | 1.000005 | < R > | 13.724331 | < R2 > | 211.963584 | < 1/R > | .102899 | < 1/R**2 > | .041809 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | .761096 | -.03791424 |
| 2 | 2p | 2.646109 | .68046999 |
| 3 | 2p | 4.511859 | .36658863 |
| 4 | 2p | 11.003472 | .01114378 |
| 5 | 3p | 1.832889 | .04056808 |
| 6 | 4p | 6.566749 | -.02798044 |
| 7 | 4p | 1.082325 | .02342903 |
| 8 | 5p | 23.465314 | -.00016821 |
| 9 | 5p | .435014 | .00144173 |
| ORB.ENERGY,a.u. | -2.152300 | ||
| NORM | 1.000000 | < R > | .804991 | < R2 > | .813746 | < 1/R > | 1.638114 | < 1/R**2 > | 3.808548 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 8.311602 | .31825970 |
| 2 | 2s | 3.750795 | -.82001927 |
| 3 | 3s | 3.036488 | -.30640945 |
| 4 | 4s | 12.925160 | .01322160 |
| 5 | 3s | 15.759304 | .00331668 |
| 6 | 5s | 25.924897 | .00042184 |
| 7 | 5s | 1.966187 | -.00870782 |
| 8 | 3s | 1.511635 | .01223700 |
| ORB.ENERGY,a.u. | -2.422000 | ||
| NORM | 1.000000 | < R > | .828419 | < R2 > | .818889 | < 1/R > | 1.746341 | < 1/R**2 > | 12.533478 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 9.241720 | .89830667 |
| 2 | 1s | 13.939734 | .09839052 |
| 3 | 1s | 14.431581 | .00065711 |
| 4 | 2s | 6.900374 | .01559062 |
| 5 | 3s | 10.770315 | -.00729383 |
| 6 | 4s | 18.595289 | .00284464 |
| 7 | 5s | 61.311923 | -.00003545 |
| 8 | 5s | 5.195016 | .00051599 |
| ORB.ENERGY,a.u. | -32.883000 |
| NORM | 1.000000 | < R > | .157457 | < R2 > | .033373 | < 1/R > | 9.624079 | < 1/R**2 > | 187.370791 |
Total Energy= -126.47573104 a.u.
Kinetic Energy= 126.47810836 a.u.
Potential Energy= -252.95383940 a.u.
Virial Ratio = -1.99998120